SMILES for Serine/threonine-protein kinase Chk1

[H][C@@]12C[C@@H]([C@H](OC)[C@@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |TLB:11:10:9:4.3.2,17:33:9:4.3.2,THB:24:32:9:4.3.2,5:4:9:10.31.33.32,30:31:9:4.3.2|

BDBM31095

Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1

BDBM31096

CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13

BDBM4814

CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C

BDBM91915

OC1CCC(C1)Oc1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91889

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc3cc(O)ccc3c2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.75,4.46,;7.68,5.69,;9.21,5.5,;10.14,6.73,;11.66,6.53,;12.59,7.76,;12.26,5.12,;11.33,3.89,;9.8,4.08,;8.88,2.85,;.89,2.24,)|

BDBM91954

COc1cc(ccc1O)-c1ccc(cc1)-c1[nH]nc2-c3ccccc3C(=O)c12

BDBM50221585

COc1cc2Cc3c([nH]nc3-c3ccc(cc3)-c3nnn[nH]3)-c2cc1OC

BDBM91837

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(NC(=O)c4cn[nH]c4)cc3NC2=O)c1

BDBM91886

COc1cc(ccc1O)-c1ccc2c(Nc3c(O)cccc3NC2=O)c1

BDBM91849

COC(=O)Cc1ccc2c(c1)NC(=O)c3ccc(cc3N2)Nc4ccncc4

BDBM91961

OC(C(O)=O)c1ccc2Nc3cc(Cl)ccc3C(=O)Nc2c1

BDBM91929

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cccc(c1)C#N

BDBM91938

COc1ccc(Cl)cc1NC(=O)Nc1ccc(cn1)C(N)=O

BDBM50221607

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(O)cc1

BDBM91881

CCN1CCN(Cc2ccc3Cc4c(n[nH]c4-c3c2)-c2cccc(OC)c2)CC1

BDBM91967

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(c1)N(C)c1ccccc1NC2=O

BDBM91934

OC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(o2)C(O)=O)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.9,4.52,;8.16,5.4,;9.39,4.47,;8.89,3.01,;10.87,4.91,;11.21,6.41,;11.99,3.86,;.89,2.24,)|

BDBM91946

COc1cc(ccc1O)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(CNC3CCC(O)CC3)ccc-21 |(-6.97,-13.41,;-6.04,-12.19,;-6.64,-10.77,;-5.71,-9.54,;-6.31,-8.12,;-7.84,-7.93,;-8.77,-9.16,;-8.17,-10.58,;-9.1,-11.8,;-5.38,-6.89,;-5.98,-5.47,;-5.05,-4.25,;-3.52,-4.44,;-2.92,-5.86,;-3.85,-7.08,;-2.59,-3.21,;-3.04,-1.74,;-1.77,-.86,;-.55,-1.78,;-1.05,-3.24,;.18,-4.17,;1.44,-3.29,;2.94,-3.64,;3.99,-2.51,;5.49,-2.86,;6.55,-1.74,;8.05,-2.09,;9.1,-.97,;10.6,-1.32,;11.05,-2.79,;12.54,-3.14,;9.99,-3.91,;8.49,-3.56,;3.55,-1.04,;2.05,-.69,;.99,-1.82,)|

BDBM91921

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2cccc(CC(O)=O)c2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;8.88,2.85,;9.8,4.08,;9.21,5.5,;7.68,5.69,;7.08,7.11,;8.01,8.34,;7.41,9.75,;9.54,8.14,;6.75,4.46,;.89,2.24,)|

BDBM91846

COc1cc(ccc1[N+]([O-])=O)-c1cc2Nc3ccc(CC(=O)Nc4ccc(cc4)N4CCOCC4)cc3NC(=O)c2cc1C

BDBM91966

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cc(OC)ncc1C

BDBM91866

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3cc(CC(=O)NCc4cccs4)ccc3NC2=O)c1

BDBM91931

OC1CCC(CC1)NCc1ccc-2c(Cc3c-2n[nH]c3-c2ccc(s2)-c2ccc(C=O)s2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;4.37,.39,;5.6,-.54,;6.86,.34,;6.42,1.81,;7.35,3.04,;8.89,3.01,;9.39,4.47,;8.16,5.4,;6.9,4.52,;8.19,6.94,;9.46,7.82,;9.01,9.29,;7.47,9.32,;6.59,10.58,;5.06,10.45,;6.97,7.87,;.89,2.24,)|

BDBM91933

COc1cc(ccn1)-c1ccc2c(Nc3ccc(CC(O)=O)cc3NC2=O)c1

BDBM91909

OC(=O)c1ccccc1-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM91949

CC(C)(C)OC(=O)NCCCCOc1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91958

[O-][N+](=O)c1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1

BDBM91901

OC(=O)c1ccc(Cl)cc1Nc1ccc2c(Nc3ccccc3NC2=O)c1

BDBM91925

Nc1cccc(c1)-c1ccc2c(Nc3ccc(CC(O)=O)cc3NC2=O)c1

BDBM91944

CC(C)(C)c1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1

BDBM91891

CCCN(CC)c1ccc(cc1NC(=O)Nc1cnc(cn1)C#N)C#N

BDBM91854

Nc1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91855

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cn(C)cn1

BDBM91914

OC1CC(CC1O)Oc1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91950

COc1ccc(Nc2[nH]nc-3c2Cc2ccccc-32)cc1

BDBM50221594

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1cccc(N)c1

BDBM91847

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(cc3NC2=O)C(C)(C)C(=O)Nc2ccc(cc2)N2CCOCC2)c1

BDBM91957

c1cc(cc2c1cc(cc2)NC(=O)Nc3cnc(cn3)C#N)C(=O)O

BDBM91936

OCC(O)CNC(=O)c1ccc(o1)-c1n[nH]c-2c1Cc1cc(CNC3CCC(O)CC3)ccc-21 |(-8.47,-13.64,;-7.12,-12.9,;-7.09,-11.36,;-8.41,-10.56,;-5.75,-10.61,;-5.72,-9.07,;-4.37,-8.33,;-3.05,-9.13,;-4.34,-6.79,;-5.56,-5.86,;-5.06,-4.41,;-3.52,-4.44,;-3.07,-5.91,;-2.59,-3.21,;-3.04,-1.74,;-1.77,-.86,;-.55,-1.78,;-1.05,-3.24,;.18,-4.17,;1.44,-3.29,;2.94,-3.64,;3.99,-2.51,;5.49,-2.86,;6.55,-1.74,;8.05,-2.09,;9.1,-.97,;10.6,-1.32,;11.05,-2.79,;12.54,-3.14,;9.99,-3.91,;8.49,-3.56,;3.55,-1.04,;2.05,-.69,;.99,-1.82,)|

BDBM91835

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(NC(=O)c4ccn[nH]4)cc3NC2=O)c1

BDBM50214567

CCc1ccc(CCOc2cc3Cc4c(n[nH]c4-c3cc2OC)-c2ccc(cc2)-c2ccc(O)cc2)nc1

BDBM91888

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc3cc(ccc3c2)C(O)=O)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.75,4.46,;7.68,5.69,;9.21,5.5,;10.14,6.73,;11.66,6.53,;12.26,5.12,;11.33,3.89,;9.8,4.08,;8.88,2.85,;12.59,7.76,;12,9.18,;14.12,7.57,;.89,2.24,)|

BDBM91932

OC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cccc(c1)[N+]([O-])=O

BDBM91890

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.75,4.46,;7.68,5.69,;9.21,5.5,;9.8,4.08,;8.88,2.85,;10.14,6.73,;9.54,8.14,;10.47,9.37,;12,9.18,;12.92,10.41,;12.59,7.76,;11.66,6.53,;.89,2.24,)|

BDBM91918

ON1CC(Cl)Cc2nc(=O)c3ccccc3nc12

BDBM91882

CC(C)(C)OC(=O)N1CCC(C1)Oc1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91910

OC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(O)cc2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.75,4.46,;7.68,5.69,;9.21,5.5,;10.14,6.73,;9.8,4.08,;8.88,2.85,;.89,2.24,)|

BDBM91923

OC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2cccc(CC(O)=O)c2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;8.88,2.85,;9.8,4.08,;9.21,5.5,;7.68,5.69,;7.08,7.11,;8.01,8.34,;7.41,9.75,;9.54,8.14,;6.75,4.46,;.89,2.24,)|

BDBM91902

COc1cc(ccc1O)-c1ccc2c(Nc3ccc(cc3NC2=O)C(=O)NCCCN2CCOCC2)c1

BDBM91900

COc1ccc(Cl)cc1NC(=O)Nc1cc(C(O)=O)c(cn1)C#N

BDBM91904

Brc1ccc(N2CCCCC2)c(NC(=O)Nc2cnc(cn2)C#N)c1

BDBM91947

COc1ccc(Cl)cc1NC(=O)Nc1ccc(I)cn1

BDBM91833

COc1cc(NC(=O)C(=O)c2c[nH]c3ccccc23)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91956

Oc1cccc2cc(NC(=O)Nc3cnc(cn3)C#N)ccc12

BDBM91962

O=C(Nc1cc(=O)[nH][nH]1)Nc1cnc(cn1)C#N

BDBM91948

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(CC(=O)N(C)C)cc3NC2=O)c1

BDBM91852

COc1cc(C=Cc2[nH]nc-3c2Cc2ccccc-32)ccc1O |w:5.4|

BDBM91887

COC(=O)C1CCCN1C(=O)c1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1ccc(O)c(OC)c1

BDBM91883

Clc1ccc(OC2CCNC2)c(NC(=O)Nc2cnc(cn2)C#N)c1

BDBM91843

COc1cc(ccc1O)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(ccc-21)C(=O)NC1CCC(O)CC1 |(-6.97,-13.41,;-6.04,-12.19,;-6.64,-10.77,;-5.71,-9.54,;-6.31,-8.12,;-7.84,-7.93,;-8.77,-9.16,;-8.17,-10.58,;-9.1,-11.8,;-5.38,-6.89,;-5.98,-5.47,;-5.05,-4.25,;-3.52,-4.44,;-2.92,-5.86,;-3.85,-7.08,;-2.59,-3.21,;-3.04,-1.74,;-1.77,-.86,;-.55,-1.78,;-1.05,-3.24,;.18,-4.17,;1.44,-3.29,;2.94,-3.64,;3.99,-2.51,;3.55,-1.04,;2.05,-.69,;.99,-1.82,;5.49,-2.86,;5.94,-4.34,;6.55,-1.74,;8.05,-2.09,;9.1,-.97,;10.6,-1.32,;11.05,-2.79,;12.54,-3.14,;9.99,-3.91,;8.49,-3.56,)|

BDBM91963

OCc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(O)ccc-21

BDBM91840

COc1cc(ccc1Cl)-c1ccc2c(Nc3ccc(CC(=O)N4CCCC(O)C4)cc3NC2=O)c1

BDBM91952

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ncccc3NC2=O)c1

BDBM50220753

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(nc1)C#N

BDBM91906

OC1CCCN(C1)c1ccc(Br)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91924

NNC(=O)c1ccc(s1)-c1[nH]nc-2c1Cc1cc(CNC3CCC(O)CC3)ccc-21 |(-8.86,-8.26,;-7.39,-7.81,;-7.04,-6.31,;-8.16,-5.26,;-5.56,-5.86,;-4.34,-6.79,;-3.07,-5.91,;-3.52,-4.44,;-5.06,-4.41,;-2.59,-3.21,;-3.04,-1.74,;-1.77,-.86,;-.55,-1.78,;-1.05,-3.24,;.18,-4.17,;1.44,-3.29,;2.94,-3.64,;3.99,-2.51,;5.49,-2.86,;6.55,-1.74,;8.05,-2.09,;9.1,-.97,;10.6,-1.32,;11.05,-2.79,;12.54,-3.14,;9.99,-3.91,;8.49,-3.56,;3.55,-1.04,;2.05,-.69,;.99,-1.82,)|

BDBM91830

OC1CCC(CC1)NC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-2.11,2.94,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.75,4.46,;7.68,5.69,;9.21,5.5,;9.8,4.08,;8.88,2.85,;10.14,6.73,;9.54,8.14,;10.47,9.37,;12,9.18,;12.92,10.41,;12.59,7.76,;11.66,6.53,;.89,2.24,)|

BDBM91928

CN(C)CCN(C)c1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91913

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccccc2F)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;8.88,2.85,;9.8,4.08,;9.21,5.5,;7.68,5.69,;6.75,4.46,;5.22,4.65,;.89,2.24,)|

BDBM91869

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc3OCOc3c2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;8.88,2.85,;9.8,4.08,;9.21,5.5,;9.86,6.89,;8.74,7.94,;7.39,7.2,;7.68,5.69,;6.75,4.46,;.89,2.24,)|

BDBM91884

COc1cc(OC)c(NC(=O)Nc2nccnn2)cc1Cl

BDBM91968

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(N)cc3NC2=O)c1

BDBM91927

COc1cc(ccc1NC(=O)Nc1cnc(cn1)C#N)[N+]([O-])=O

BDBM91834

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(NC(=O)Cc4cnc[nH]4)cc3NC2=O)c1

BDBM91960

O=C(Nc1cnc(cn1)C#N)Nc1cnc2ccccc2n1

BDBM91829

CC(=O)Nc1cccc(c1)-c1n[nH]c-2c1Cc1cc(ccc-21)C(N)=O

BDBM91939

COc1cc(ccc1C(O)=O)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM91905

CCC1CCCCN1c1ccc(Br)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91911

COc1cc(ccc1O)-c1ccc2c(Nc3ccc(cc3NC2=O)C(=O)N2CCCC2CO)c1

BDBM91897

CC(C)c1ccc(COc2ccc(Cl)cc2NC(=O)Nc2cnc(cn2)C#N)cc1

BDBM91945

CC(C)(C)OC(=O)N1CCC(C1)Oc1ccc(cc1NC(=O)Nc1cnc(cn1)C#N)C#N

BDBM91941

c1ccc2cnc(cc2c1)NC(=O)Nc3cnc(cn3)C#N

BDBM91964

Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(O)ccc-21

BDBM91844

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(OCCN4CCOCC4)cc3NC2=O)c1

BDBM91959

O=C(Nc1cc(n[nH]1)-c1ccccc1)Nc1cnc(cn1)C#N

BDBM91942

OC(=O)c1ccc(NC(=O)Nc2cnc(cn2)C#N)c(OC(F)(F)F)c1

BDBM91908

OC1CCN(C1)c1ccc(cc1NC(=O)Nc1cnc(cn1)C#N)C#N

BDBM91965

COc1cc(ccc1C(=O)N1CCCC1CO)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM91848

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cccc2ccccc12

BDBM50218734

c1ccc2c(c1)C(=O)Nc3cc(ccc3N2)Cl

BDBM91863

Clc1ccc(Nc2ccc3c(Nc4ccccc4NC3=O)c2)cc1

BDBM91825

COc1cc(ccc1O)-c1ccc2c(Nc3cccc(Cl)c3NC2=O)c1

BDBM91853

COC(=O)Cc1ccc2Nc3cc(c(C)cc3C(=O)Nc2c1)-c1cccc(NC(C)=O)c1

BDBM91926

Clc1ccc(OCC2CCCCC2)c(NC(=O)Nc2cnc(cn2)C#N)c1

BDBM91930

COC(=O)c1ccc(o1)-c1n[nH]c-2c1Cc1cc(CNC3CCC(O)CC3)ccc-21 |(-5.75,-10.61,;-5.72,-9.07,;-4.37,-8.33,;-3.05,-9.13,;-4.34,-6.79,;-5.56,-5.86,;-5.06,-4.41,;-3.52,-4.44,;-3.07,-5.91,;-2.59,-3.21,;-3.04,-1.74,;-1.77,-.86,;-.55,-1.78,;-1.05,-3.24,;.18,-4.17,;1.44,-3.29,;2.94,-3.64,;3.99,-2.51,;5.49,-2.86,;6.55,-1.74,;8.05,-2.09,;9.1,-.97,;10.6,-1.32,;11.05,-2.79,;12.54,-3.14,;9.99,-3.91,;8.49,-3.56,;3.55,-1.04,;2.05,-.69,;.99,-1.82,)|

BDBM91953

OC1CCCC(Oc2ccc(Cl)cc2NC(=O)Nc2cnc(cn2)C#N)C1O

BDBM91917

CCOC(=O)CCCCCOc1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91842

COC(=O)Cc1ccc2Nc3cc(c(C)cc3C(=O)Nc2c1)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM91860

COC(=O)Cc1ccc2Nc3cc(N)ccc3C(=O)Nc2c1

BDBM91832

Oc1ccc-2c(Cc3c-2[nH]nc3-c2ccc(cc2)-c2cc[nH]c(=O)c2)c1

BDBM91907

CN(CC(O)c1ccccc1)c1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91828

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cncn1C

BDBM91859

COc1cc2NC(=O)c3ccc(cc3Nc2cc1OCc1ccncc1)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50214559

COc1cc2Cc3c(n[nH]c3-c2cc1O)-c1ccc(cc1)-c1ccc(O)cc1

BDBM91893

CCCN(CC)c1ccc(Br)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91919

Cc1ccc(s1)-c1[nH]nc-2c1Cc1cc(CNC3CCC(O)CC3)ccc-21 |(-7.04,-6.31,;-5.56,-5.86,;-4.34,-6.79,;-3.07,-5.91,;-3.52,-4.44,;-5.06,-4.41,;-2.59,-3.21,;-3.04,-1.74,;-1.77,-.86,;-.55,-1.78,;-1.05,-3.24,;.18,-4.17,;1.44,-3.29,;2.94,-3.64,;3.99,-2.51,;5.49,-2.86,;6.55,-1.74,;8.05,-2.09,;9.1,-.97,;10.6,-1.32,;11.05,-2.79,;12.54,-3.14,;9.99,-3.91,;8.49,-3.56,;3.55,-1.04,;2.05,-.69,;.99,-1.82,)|

BDBM91894

Clc1ccc(C#N)c(NC(=O)Nc2cnc(cn2)C#N)c1

BDBM50214577

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1ccc(O)cc1

BDBM91955

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(CC(=O)NC(CO)c4ccccc4)cc3NC2=O)c1

BDBM91845

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(CC(=O)N4CCOCC4)cc3NC2=O)c1

BDBM91880

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2cc(C)cc(C)c2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.75,4.46,;7.68,5.69,;7.08,7.11,;9.21,5.5,;9.8,4.08,;11.33,3.89,;8.88,2.85,;.89,2.24,)|

BDBM91940

Brc1nc(NC(=O)Nc2cnc(cn2)C#N)cc2ccccc12

BDBM91839

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(NC(=O)c4ccccn4)cc3NC2=O)c1

BDBM91943

ONC(=O)c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(CNC3CCC(O)CC3)ccc-21 |(-6.64,-10.77,;-5.71,-9.54,;-6.31,-8.12,;-7.84,-7.93,;-5.38,-6.89,;-5.98,-5.47,;-5.05,-4.25,;-3.52,-4.44,;-2.92,-5.86,;-3.85,-7.08,;-2.59,-3.21,;-3.04,-1.74,;-1.77,-.86,;-.55,-1.78,;-1.05,-3.24,;.18,-4.17,;1.44,-3.29,;2.94,-3.64,;3.99,-2.51,;5.49,-2.86,;6.55,-1.74,;8.05,-2.09,;9.1,-.97,;10.6,-1.32,;11.05,-2.79,;12.54,-3.14,;9.99,-3.91,;8.49,-3.56,;3.55,-1.04,;2.05,-.69,;.99,-1.82,)|

BDBM91826

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(NC(N)=O)cc3NC2=O)c1

BDBM50221567

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(nc1)-c1ccc(O)cc1

BDBM91899

c1cc2c(cc1CC(=O)O)NC(=O)c3ccc(cc3N2)Cl

BDBM91838

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(NC(=O)CCS(=O)(=O)c4ccccc4)cc3NC2=O)c1

BDBM50221589

COc1cc2Cc3c(n[nH]c3C#Cc3ccc(O)c(OC)c3)-c2cc1OC

BDBM91920

OC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc[nH]2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;8.89,3.01,;9.39,4.47,;8.16,5.4,;6.9,4.52,;.89,2.24,)|

BDBM91831

COc1cc(NC(=O)CCCCCCC(O)=O)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91896

COc1ccc(Br)cc1COc1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM91951

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(cc3NC2=O)-c2cccc(N)c2)c1

BDBM91903

COc1cc(ccc1O)-c1ccc2c(Nc3ccc(cc3NC2=O)C(=O)N2CCCC2C(O)=O)c1

BDBM91937

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1ccc(OC)cc1

BDBM91850

COc1ccc(COc2cc3Cc4c([nH]nc4-c4ccc(Br)cc4)-c3cc2OC)cc1

BDBM91836

COc1ccc(cc1NC(=O)Nc1cnc(cn1)C#N)-c1ccccc1

BDBM91827

OCc1ccc2Cc3c([nH]nc3-c3ccc(cc3)-c3ccc(O)cc3)-c2c1

BDBM91895

COc1cc2Cc3c(n[nH]c3-c3ccc(OCc4ccccc4)cc3)-c2cc1OC

BDBM91856

Fc1cc(ccc1Cl)-c1ccc2c(Nc3ccc(CC(=O)Nc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1

BDBM91841

CNC(=O)c1ccc2Cc3c(n[nH]c3-c2c1)-c1ccc(cc1)C(O)=O

BDBM91898

Clc1ccc(OC2Cc3ccccc3C2)c(NC(=O)Nc2cnc(cn2)C#N)c1

BDBM91922

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccccc2N)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;8.88,2.85,;9.8,4.08,;9.21,5.5,;7.68,5.69,;6.75,4.46,;5.22,4.65,;.89,2.24,)|

BDBM91935

OC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccoc2)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.9,4.52,;8.16,5.4,;9.39,4.47,;8.89,3.01,;.89,2.24,)|

BDBM91851

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cc[nH]c(=O)c1

BDBM91885

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C(O)=O)c1 |(-8.72,1.74,;-7.22,1.4,;-6.17,2.52,;-4.67,2.17,;-4.22,.7,;-5.27,-.43,;-6.77,-.08,;-2.72,.35,;-1.67,1.47,;-.17,1.12,;.28,-.35,;1.78,-.7,;2.83,.42,;2.39,1.89,;3.65,2.77,;4.88,1.84,;6.42,1.81,;6.86,.34,;5.6,-.54,;4.37,.39,;7.35,3.04,;6.75,4.46,;7.68,5.69,;9.21,5.5,;9.8,4.08,;8.88,2.85,;10.14,6.73,;9.54,8.14,;11.66,6.53,;.89,2.24,)|

BDBM91892

Clc1ccc(OCCCN2C(=O)c3ccccc3C2=O)c(NC(=O)Nc2cnc(cn2)C#N)c1

BDBM92906

O[C@H]1CN(C[C@H]1O)C(=O)c1[nH]c2cc(NC(=O)C3C[C@H]3c3ccccc3)cc3c2c1cn[nH]c3=O |r|

BDBM92907

CC(OC(=O)Nc1ccc(Cl)c(Cl)c1)c1nc2ccccc2[nH]1

BDBM92908

CC(C)(C)c1ccc(cc1[N+](O)=O)C(=O)NC(=O)Nc1cccc2ccccc12

BDBM120868

O=C(Nc1ccc(CCNCc2ccccc2)cc1)Nc1cnc(cn1)C#N

BDBM120869

Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2)cc1

BDBM120870

Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2)c(F)c1

BDBM120871

Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120872

Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c(F)c1

BDBM120873

Fc1ccc(CNCCOc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c(F)c1

BDBM120874

Fc1ccc(CCNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120875

Clc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120876

Fc1cccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c1

BDBM120877

Clc1ccccc1CNCCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl

BDBM120878

CN(CCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl)Cc1ccc(F)cc1

BDBM120879

COc1cccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c1

BDBM120880

Clc1cccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c1

BDBM120881

FC(F)(F)Oc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120882

COc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120883

COc1ccccc1CNCCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl

BDBM120884

FC(F)(F)c1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120885

C[C@H](NCCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl)c1ccc(F)cc1 |r|

BDBM120886

COc1cc(CCNCc2cccc(F)c2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120887

COc1cc(CCNCc2ccc(F)cc2)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120888

COc1cc(OCCNCc2ccc(F)cc2)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120889

COc1cc(CNCc2ccccc2)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120890

Fc1ccccc1CNCCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl

BDBM120891

C[C@@H](NCCc1ccc(NC(=O)Nc2cnc(cn2)C#N)cc1Cl)c1ccc(F)cc1 |r|

BDBM120892

Clc1cc(NC(=O)Nc2cnc(cn2)C#N)ccc1CCNCc1ccc(cc1)N1CCOCC1

BDBM120893

Fc1ccc(CNCCOc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120894

COc1cc(CCNCc2ccc(F)cc2)ccc1NC(=O)Nc1cnc(C)cn1

BDBM120895

Fc1ccc(CCNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c(F)c1

BDBM120896

O=C(Nc1ccc(CNCc2ccccc2)cc1)Nc1cnc(cn1)C#N

BDBM120897

COc1cc(CCNCc2ccc(F)cc2F)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120898

COc1cc(CCNCCc2ccc(F)cc2)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120899

COc1cc(CCNCc2ccccc2)ccc1NC(=O)Nc1cnc(C)cn1

BDBM120900

COc1cc(OCCNCc2ccc(F)cc2F)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120901

Fc1ccc(CNCCc2cccc(NC(=O)Nc3cnc(cn3)C#N)c2)cc1

BDBM120902

CN1CCN(CC1)c1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120903

Cc1cc(NC(=O)Nc2cnc(cn2)C#N)ccc1CCNCc1ccc(F)cc1

BDBM120904

COc1cc(CCNCc2ccc(F)cc2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120905

CN1CCN(CC1)c1cccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c1

BDBM120906

Clc1cc(NC(=O)Nc2cnc(cn2)C#N)ccc1CCNCc1cccc(c1)N1CCOCC1

BDBM120907

Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1F

BDBM120908

Fc1ccc(CNCCc2ccc(NC(=O)Nc3cnc(cn3)C#N)cc2Br)cc1

BDBM120909

COc1cc(CCNCc2ccc(F)cc2)c(Br)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120910

COc1cc(CCN[C@H](C)c2ccc(F)cc2)ccc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM120911

COc1cc(CCN[C@@H](C)c2ccc(F)cc2)ccc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM120912

CCOc1cc(CCNCc2ccc(F)cc2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120913

CC(C)Oc1cc(CCNCc2ccc(F)cc2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120914

COc1cc(OCCNCc2ccc(F)cc2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120915

COc1cccc(CNCCc2cc(OC)c(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)c1

BDBM120916

COc1ccc(CNCCc2cc(OC)c(NC(=O)Nc3cnc(cn3)C#N)cc2Cl)cc1

BDBM120917

COc1cc(CCNCc2ccc(cc2)N2CCN(C)CC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120918

COc1cc(CCNCc2ccc(cc2)N2CCN(C)CC2)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120919

COc1cc(CCN[C@@H](C)c2ccc(cc2)N2CCNCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM120920

COc1ccc(cc1)[C@H](C)NCCc1cc(OC)c(NC(=O)Nc2cnc(cn2)C#N)cc1Cl |r|

BDBM120921

COc1cc(CCNCc2ccc3OCOc3c2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120922

COc1ccccc1CNCCc1cc(OC)c(NC(=O)Nc2cnc(cn2)C#N)cc1Cl

BDBM120923

COc1cc(CNCc2ccccc2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120924

COc1cc(CNCc2ccc(F)cc2)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120925

COc1cc(CNCc2cccc(F)c2)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120926

COc1cc(CNCc2ccccc2F)ccc1NC(=O)Nc1cnc(cn1)C#N

BDBM120927

COc1ccc(CNCc2ccc(NC(=O)Nc3cnc(cn3)C#N)c(OC)c2)cc1

BDBM120928

COc1cccc(CNCc2ccc(NC(=O)Nc3cnc(cn3)C#N)c(OC)c2)c1

BDBM120929

COc1ccccc1CNCc1ccc(NC(=O)Nc2cnc(cn2)C#N)c(OC)c1

BDBM120930

COc1cc(CNCc2ccc(F)cc2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120931

COc1cc(CCNCc2ccc(cc2)N2CCNCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM120932

COc1cccc(c1)[C@H](C)NCCc1cc(OC)c(NC(=O)Nc2cnc(cn2)C#N)cc1Cl |r|

BDBM236557

Nc1ccc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1

BDBM50401614

COc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401617

CNc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1-c1cnn(C)c1 |r|

BDBM316492

COc1cc(CCNCC2CCNCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |$;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;$|

BDBM316493

COc1cc(CCNCC2CNCCO2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |$;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;$|

BDBM323098

COc1cc(CCNC[C@@H]2CNCCO2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323106

COc1cc(CCNC[C@H]2CNCCO2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323107

COc1cc(CCNC[C@H]2CCCNC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323143

COc1cc(CCNC[C@@H]2CCCNC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323144

COc1cc(CCNCCN2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323145

CC(C)Oc1cc(CCNCCN2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323146

COc1cc(CCNCCN2CCN(C)CC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323147

COc1cc(CCN[C@@H](C)C2CCN(CC2)C(=O)C2CC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323148

COc1cc(CCN[C@@H](C)C2CCN(CC2)S(C)(=O)=O)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323149

Clc1cc(NC(=O)Nc2cnc(cn2)C#N)ccc1CCNCC1CCCCC1

BDBM323150

COc1cc(CCN[C@H](C)C2CCN(CC2)S(C)(=O)=O)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323151

COc1cc(CCNC[C@H]2CN(CCO2)C(=O)C2CC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323153

COc1cc(CCNC(=O)[C@H]2CNCCO2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323154

COc1cc(CCNC(=O)CN2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323155

COc1cc(CCNC(=O)CN2CCN(C)CC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323156

COc1cc(CCN[C@@H](C)CN2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323159

COc1cc(CCNCC(=O)N2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323161

CC(C)Oc1cc(CCNC(=O)[C@H]2CNCCO2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323162

COc1cc(CCNC[C@H]2CN(CCO2)C(=O)C2CC2)ccc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323163

CC(C)Oc1cc(CCNC(=O)CN2CCN(C)CC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323165

COc1cc(CCN[C@@H](C)CN2CCOCC2)ccc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323166

COc1cc(CCN[C@H](C)CN2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323167

COc1cc(OCCNCCN2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323168

COc1cc(CCNCC(=O)N2CCN(C)CC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323169

CC(C)Oc1cc(CCNCC(=O)N2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM323170

COc1cc(CCN[C@@H](C)C(=O)N2CCOCC2)c(Cl)cc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM323171

CC(C)Oc1cc(CCN[C@@H](C)C(=O)N2CCOCC2)ccc1NC(=O)Nc1cnc(cn1)C#N |r|

BDBM328993

FC(F)(F)c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM328994

FC(F)(F)c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM328995

COCC#Cc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM328996

COC(=O)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CNCCO1

BDBM328997

Cn1cc(cn1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM328998

CC(C)(O)C#Cc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM328999

COc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM329000

CC(C)(O)C#Cc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM329001

COC(C)(C)C#Cc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM329002

COCCOc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM329003

COCc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM329004

COc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM329005

COCc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM329006

COCCOc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM329007

Fc1cccc(c1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM329008

O=C(Nc1ccccc1)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CNCCO1

BDBM329009

COCCCc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM329010

Fc1ccc(cc1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM401893

COc1cc(NCc2ccccc2)cc(OC)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401894

COc1cc(NCc2ccccc2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401895

COc1cc(CNCc2ccccc2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401896

COc1cc(CCNCc2ccccc2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401897

N#Cc1cnc(Nc2cc([nH]n2)-c2ccc(CNCc3ccccc3)cc2)cn1

BDBM401898

COc1cc(CN[C@@H](C)c2ccc(F)cc2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401899

COc1cc(CN[C@H](C)c2ccc(F)cc2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401900

COc1cc(CNCc2ccc(F)cc2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401901

COc1cc(CNCCN2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401902

COc1cc(CNCCN2CCOCC2)ccc1-c1cc(Nc2cnccn2)n[nH]1

BDBM401903

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(C)CC1

BDBM401904

COc1cc(CNCC2CCN(CC2)C(=O)C2CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401905

COc1cc(CNC(=O)C2CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401906

COc1cc(CNC2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401907

COc1cc(CN(C)CCN2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401908

COc1cc(NCCN2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401909

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(CC1)C(=O)CN(C)C

BDBM401910

COc1cc(CN[C@H](C)CN2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401911

COc1cc(CNC(C)(C)CN2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401912

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCNCC1

BDBM401913

CN1CCC(CC1)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(F)c1

BDBM401914

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCN(C)CC1

BDBM401915

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCCN(C)CC1

BDBM401916

COc1cc(ccc1-c1cc(Nc2ccc(nc2)C#N)n[nH]1)C1CCN(C)CC1

BDBM401917

COc1cc(ccc1-c1cc(Nc2ccc(cn2)C#N)n[nH]1)C1CCN(C)CC1

BDBM401918

COc1cc(ccc1-c1cc(Nc2cnc(C)cn2)n[nH]1)C1CCN(C)CC1

BDBM401919

CN1CCC(CC1)c1ccc(cc1)-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401920

COc1cc(OC2CCN(C)CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401921

COc1cc(OCC2CCN(C)CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401922

COc1cc(ccc1-c1cc(Nc2ccc(C#N)c(F)c2)n[nH]1)C1CCN(C)CC1

BDBM401923

COc1cc(CNc2ccccn2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401924

COc1cc(C2CCN(C)CC2)c(F)cc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401925

COc1cc(O[C@H]2CCNC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401926

COc1cc(OCC2CCCN2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401927

COc1cc(OCC2CCCN2C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401928

COc1cc(OCC2CCNCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401929

COc1cc(CNC2CCN(C)CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401930

CC(C)Oc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(C)CC1

BDBM401931

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCCNC1

BDBM401932

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCCN(C)C1

BDBM401933

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCCCN1C

BDBM401934

COc1cc(O[C@H]2CCN(C)C2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401935

COc1cc(ccc1-c1cc(Nc2cnc(Cl)cn2)n[nH]1)C1CCNCC1

BDBM401936

COc1cc(ccc1-c1cc(Nc2cnc(Cl)cn2)n[nH]1)C1CCN(C)CC1

BDBM401937

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C(O)=O)n[nH]1)C1CCNCC1

BDBM401938

Oc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCNCC1

BDBM401939

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1C[C@H](C)N[C@@H](C)C1

BDBM401940

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCOCC1

BDBM401941

COc1cc(ccc1-c1cc(Nc2ccc(C#N)c(F)c2)n[nH]1)C1CCNCC1

BDBM401942

COc1cc(ccc1-c1cc(Nc2ccc(cn2)C#N)n[nH]1)C1CCNCC1

BDBM401943

Fc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCNCC1

BDBM401944

COc1cc(ccc1-c1cc(Nc2ccc(nc2)C#N)n[nH]1)C1CCNCC1

BDBM401945

CC(C)Oc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCNCC1

BDBM401946

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCCNCC1

BDBM401947

COc1cc(ccc1-c1cc(Nc2cnc(C)cn2)n[nH]1)C1CCNCC1

BDBM401948

N#Cc1cnc(Nc2cc([nH]n2)-c2ccc(cc2)C2CCNCC2)cn1

BDBM401949

COc1cc(OC2CCNCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401950

COc1cc(C2CCNCC2)c(F)cc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401951

COc1cc(CNC(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401952

CCN1CCC(CC1)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM401953

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(CC1)C(C)C

BDBM401954

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(CC(N)=O)CC1

BDBM401955

COc1cc(CN(C)C2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401956

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1(F)CCN(C)CC1

BDBM401957

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CN(C)C1

BDBM401958

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1(F)CN(C)C1

BDBM401959

COc1cc(C2CCN(C)CC2)c(Cl)cc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401960

COc1cc(C2CCNCC2)c(Cl)cc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401961

COc1c(Cl)c(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(C)CC1

BDBM401962

COc1c(Cl)c(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCNCC1

BDBM401963

COC(=O)c1cnc(Nc2cc([nH]n2)-c2ccc(cc2OC)C2CCNCC2)cn1

BDBM401964

COc1cc(CNC2CCOC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401965

COc1cc(CN(C)C2CCOC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401966

COc1cc(NCC2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401967

COc1cc(OCC2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401968

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1(F)CCNCC1

BDBM401969

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1(F)CNC1

BDBM401970

COc1cc(O[C@@H]2CCN(C)C2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401971

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCOCC1

BDBM401972

CCN1CCN(CC1)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM401973

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCN(CC1)C(C)C

BDBM401974

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCN[C@H](C)C1

BDBM401975

CCN1CCCN(CC1)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM401976

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCCN(CC1)C(C)C

BDBM401977

CCN1CCC(F)(CC1)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM401978

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1(F)CCN(CC1)C(C)C

BDBM401979

CCN1CCC(C(F)C1)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM401980

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(CC1F)C(C)C

BDBM401981

COCCN1CCC(CC1)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM401982

CCNCc1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM401983

COc1cc(CNC2CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401984

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCN(C)[C@H](C)C1

BDBM401985

CCN1CCN(C[C@H]1C)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM401986

COc1cc(O[C@H]2CCN(C2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401987

COc1cc(O[C@@H]2CCN(C2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401988

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)[C@H]1CCN(C)C[C@@H]1C

BDBM401989

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(C)CC1(F)F

BDBM401990

CCN1CCC(c2ccc(-c3cc(Nc4cnc(cn4)C#N)n[nH]3)c(OC)c2)C(F)(F)C1

BDBM401991

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(CCO)CC1

BDBM401992

COc1cc(CN(C)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401993

COc1cc(CN2CCCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401994

COc1cc(CN2CCOCC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401995

COc1cc(OC[C@H]2CCCN2C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401996

COc1cc(OC[C@@H]2CCCN2C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401997

COc1cc(OCc2cocn2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM401998

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)C1CCN(CCF)CC1

BDBM401999

COc1cc(NCC2CCN(C)CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402000

CCN1CCC(CNc2ccc(-c3cc(Nc4cnc(cn4)C#N)n[nH]3)c(OC)c2)CC1

BDBM402001

COc1cc(NCC2CCN(CC2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402002

COc1cc(NC2CCN(C)CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402003

CCN1CCC(CC1)Nc1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402004

COc1cc(NC2CCN(CC2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402005

COc1cc(COC2CCN(C)CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402006

CCN1CCC(CC1)OCc1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402007

COc1cc(COC2CCN(CC2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402008

COc1cc(cc(F)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCNCC1

BDBM402009

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)[C@@H]1CN(C)CCO1

BDBM402010

CCN1CCO[C@@H](C1)c1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402011

COc1cc(cc(OC)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCNCC1

BDBM402012

COc1cc(cc(OC)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCN(C)CC1

BDBM402013

COc1cc(CN2CC[C@@H](F)C2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402014

CO[C@H]1CCN(Cc2ccc(-c3cc(Nc4cnc(cn4)C#N)n[nH]3)c(OC)c2)C1

BDBM402015

CO[C@@H]1CCN(Cc2ccc(-c3cc(Nc4cnc(cn4)C#N)n[nH]3)c(OC)c2)C1

BDBM402016

CCN1CCC[C@@H]1COc1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402017

COc1cc(OC[C@H]2CCCN2C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402018

CCN1CCC[C@H]1COc1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402019

COc1cc(OC[C@@H]2CCCN2C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402020

COc1cc(CNCC2CC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402021

COc1cc(CN[C@@H]2CCOC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402022

COc1cc(CN[C@H]2CCOC2)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402023

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCN(C(C)C)[C@H](C)C1

BDBM402024

CCN1CCC(CC1)Oc1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402025

COc1cc(OC2CCN(CC2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402026

CCN1CCN(CC1)c1cc(F)c(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402027

COc1cc(cc(F)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCN(CC1)C(C)C

BDBM402028

CCN1CC[C@@H](C1)OCc1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402029

COc1cc(CO[C@H]2CCN(C2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402030

CCN1CC[C@H](C1)OCc1ccc(-c2cc(Nc3cnc(cn3)C#N)n[nH]2)c(OC)c1

BDBM402031

COc1cc(CO[C@@H]2CCN(C2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402032

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCN(CC(C)C)CC1

BDBM402033

CCN1CCC(Cc2ccc(-c3cc(Nc4cnc(cn4)C#N)n[nH]3)c(OC)c2)CC1

BDBM402034

COc1cc(CC2CCN(CC2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402035

CCN1CCC(CN(C)c2ccc(-c3cc(Nc4cnc(cn4)C#N)n[nH]3)c(OC)c2)CC1

BDBM402036

COc1cc(CNCC(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM402037

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)[C@@H]1CN(CCO1)C(C)C

BDBM402038

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N(C)CC1CCN(CC1)C(C)C

BDBM402039

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N(C)CC1CCNCC1

BDBM411427

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411428

C[C@@H]1COCCN1c1cc(N=S2(=O)CCCC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411429

CCS(=O)(CC)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411431

C[C@@H]1COCCN1c1cc(N=S2(=O)CCCCC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411432

C[C@@H]1COCCN1c1cc(N=S2(=O)CCOCC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM466903

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CCOCC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411433

CCS(C)(=O)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466905

CC(C)S(C)(=O)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466906

C[C@@H]1COCCN1c1cc(N=S(C)(=O)CC2CC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411437

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1c(F)cnc2[nH]ccc12 |r|

BDBM411438

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]c(C)cc12 |r|

BDBM411439

C[C@@H]1COCCN1c1cc(N=S2(=O)CCN(CC2)C(C)=O)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411441

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(N)nc(Cl)c1 |r|

BDBM411442

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(C)nc(N)c1 |r|

BDBM411443

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(N)nc(c1)C#N |r|

BDBM411444

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411445

CC[S@](C)(=O)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411449

COc1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=[S@](C)(=O)C1CC1 |r|

BDBM411452

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(Cl)nc2[nH]ccc12 |r|

BDBM411453

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(nc2[nH]ccc12)C#N |r|

BDBM411454

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(C)nc2[nH]ccc12 |r|

BDBM411455

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]ncc12 |r|

BDBM411456

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cccc2[nH]ncc12 |r|

BDBM411457

CNc1cc(ccn1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(C)=O |r|

BDBM411463

COc1cc(-c2nc(cc(n2)N2CCOC[C@H]2C)N=S(C)(C)=O)c2cc[nH]c2n1 |r|

BDBM411464

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]cnc12 |r|

BDBM411465

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]c(cc12)C1CC1 |r|

BDBM411466

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]c(C)nc12 |r|

BDBM411467

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(nc2ccccc12)C1CC1 |r|

BDBM411468

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(C)nc2ccccc12 |r|

BDBM411469

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CC2)nc(n1)-c1cncc2[nH]ccc12 |r|

BDBM411470

CS(C)(=O)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1CF |r|

BDBM411471

CS(C)(=O)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C(F)F |r|

BDBM411472

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(C)nc2c(F)cccc12 |r|

BDBM411473

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc2ccc(cc12)C#N |r|

BDBM411474

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(C)nc2ncccc12 |r|

BDBM411475

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2COC2)nc(n1)-c1ccnc(N)c1 |r|

BDBM411476

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2COC2)nc(n1)-n1cnc2ccccc12 |r|

BDBM411478

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2CC2)nc(n1)-c1ccnc(N)c1 |r|

BDBM411480

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2CC2)nc(n1)-n1cnc2ccccc12 |r|

BDBM411482

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2COC2)nc(n1)-n1c(C)nc2ccccc12 |r|

BDBM411484

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2CC2)nc(n1)-c1cc(N)nc(Cl)c1 |r|

BDBM411486

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2COC2)nc(n1)-c1ccnc(N)c1 |r|

BDBM411490

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2CC2)nc(n1)-n1c(C)nc2ccccc12 |r|

BDBM411492

COc1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=[S@](C)(=O)C1COC1 |r|

BDBM411494

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2CC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411496

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1ccc2ccccc12 |r|

BDBM411497

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1c(C)nc2ccccn12 |r|

BDBM411498

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(N)nc(c1)C(N)=O |r|

BDBM411499

CCNC(=O)c1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(C)=O |r|

BDBM411500

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1c(C)nn2ccccc12 |r|

BDBM411501

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(CO)nc2ccccc12 |r|

BDBM411502

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(CF)nc2ccccc12 |r|

BDBM411503

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cncn1C |r|

BDBM411504

CCC(=O)N1CCS(=O)(CC1)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411505

COC(=O)N1CCS(=O)(CC1)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411506

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CCN(CC2)C(C)=O)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411507

COC(=O)N1CCC(CC1)S(C)(=O)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411508

CCC(=O)N1CCC(CC1)S(C)(=O)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411509

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2COC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411510

C[C@@H]1COCCN1c1cc(N=S2(=O)CCN(CC2)C(=O)C2CC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411511

COCC(=O)N1CCS(=O)(CC1)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411512

CC(C)OC(=O)N1CCS(=O)(CC1)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411513

CCOC(=O)N1CCS(=O)(CC1)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM411514

C[C@@H]1COCCN1c1cc(N=S2(=O)CCNCC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411515

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc(N)c1 |r|

BDBM411516

C[C@@H]1COCCN1c1cc(N=S2(=O)CCN(CC2)C(=O)CO)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411517

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cccc2nccn12 |r|

BDBM411518

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ncnc2[nH]ccc12 |r|

BDBM411519

CCc1nc2ccccc2n1-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(C)=O |r|

BDBM411520

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc2ccccc12 |r|

BDBM411521

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1nnc2ccccc12 |r|

BDBM411522

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(F)cc2[nH]ncc12 |r|

BDBM411523

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cccc(O)c1 |r|

BDBM411524

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cnc(N)nc1 |r|

BDBM411525

CC(C)c1nc2ccccc2n1-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(C)=O |r|

BDBM411526

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccc(N)nc1 |r|

BDBM411527

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cncc2[nH]ccc12 |r|

BDBM411528

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc2cnccc12 |r|

BDBM411529

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc2ccc(C)cc12 |r|

BDBM411530

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1ccnc1 |r|

BDBM411531

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc(C)c1 |r|

BDBM411532

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(nc2ccccc12)C(F)(F)F |r|

BDBM411533

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc(C)c1C |r|

BDBM411534

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1ncc2ccccc12 |r|

BDBM411535

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(nc2ccccc12)C(F)F |r|

BDBM411536

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]c(OCC(F)(F)F)cc12 |r|

BDBM411537

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(F)cc2[nH]ccc12 |r|

BDBM411538

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(C)cnc1C |r|

BDBM411539

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]c(nc12)C(F)(F)F |r|

BDBM411540

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1ccnc1Cl |r|

BDBM411541

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CC2)nc(n1)-n1cnc2ccccc12 |r|

BDBM411542

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CC2)nc(n1)-c1ccc(N)nc1 |r|

BDBM411543

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(C)nc2cccc(F)c12 |r|

BDBM411544

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CC2)nc(n1)-n1c(C)nc2ccccc12 |r|

BDBM411545

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2COC2)nc(n1)-n1c(C)nc2ccccc12 |r|

BDBM411546

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cccnc1 |r|

BDBM411547

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccncc1 |r|

BDBM411548

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cccc2[nH]ccc12 |r|

BDBM411549

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2COC2)nc(n1)-c1cncc2[nH]ccc12 |r|

BDBM411550

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cccc2[nH]cnc12 |r|

BDBM411551

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc2cc(F)c(F)cc12 |r|

BDBM411552

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc(C)c1 |r|

BDBM411553

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc2[nH]c(cc12)C#N |r|

BDBM411554

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc(N)nc(c1)C1CC1 |r|

BDBM411555

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc2ccc(F)cc12 |r|

BDBM411556

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(C)nc2ccc(F)cc12 |r|

BDBM411557

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1c(C)nc2cc(F)ccc12 |r|

BDBM411558

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-n1cnc2cc(F)ccc12 |r|

BDBM411560

COc1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(C)=O |r|

BDBM411561

CNC(=O)c1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(C)=O |r|

BDBM411562

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CC2)nc(n1)-c1cc(N)nc(Cl)c1 |r|

BDBM411563

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1cc[nH]n1 |r|

BDBM411564

COc1cc(ccn1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(C)=O |r|

BDBM411565

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2COC2)nc(n1)-c1cc(N)nc(Cl)c1 |r|

BDBM411566

CCOc1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(C)=O |r|

BDBM411567

COc1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=S(C)(=O)C1COC1 |r|

BDBM411568

C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2cccnc2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411569

C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2cnn(C)c2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM411570

C[C@@H]1COCCN1c1cc(N=S2(=O)CCCC2)nc(n1)-c1cc(Cl)nc2[nH]ccc12 |r|

BDBM411571

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc(N)n1 |r|

BDBM411572

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(n1)-c1ccnc(O)c1 |r|

BDBM466898

CCN1CCCN(c2cc(nc(n2)-c2ccnc3[nH]ccc23)N2CCOC[C@H]2C)S1(=O)=O |r|

BDBM466899

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCS1(=O)=O |r|

BDBM466900

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(C)C1=O |r|

BDBM466901

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)S(C)(=O)=O |r|

BDBM466902

C[C@@H]1COCCN1c1cc(nc(n1)-c1cc(Cl)nc2[nH]ccc12)[C@H]1CCCS1(=O)=O |r|

BDBM466904

C[C@@H]1COCCN1c1cc(nc(n1)-c1cc(Cl)nc2[nH]ccc12)[C@@H]1CCCS1(=O)=O |r|

BDBM466907

C[C@@H]1COCCN1c1cc(nc(n1)-c1cc(Cl)nc2[nH]ccc12)N1CCCN(C)S1(=O)=O |r|

BDBM466908

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCCN(C)S1(=O)=O |r|

BDBM466909

CC(C)N1CCCN(c2cc(nc(n2)-c2ccnc3[nH]ccc23)N2CCOC[C@H]2C)S1(=O)=O |r|

BDBM466910

CCN1CCCN(c2cc(nc(n2)-c2cc(Cl)nc3[nH]ccc23)N2CCOC[C@H]2C)S1(=O)=O |r|

BDBM466911

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCN(C1)S(C)(=O)=O |r|

BDBM466912

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(C1)S(C)(=O)=O |r|

BDBM466913

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)C(C)=O |r|

BDBM466914

COC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466915

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCOCC1 |r|

BDBM466916

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCN(C1)C(C)=O |r|

BDBM466917

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(C1)C(C)=O |r|

BDBM466918

COC(=O)N1CCC(C1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466919

CNC(=O)N1CCC(C1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466920

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCN(C)C1=O |r|

BDBM466921

CCC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466922

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)C(=O)C1CC1 |r|

BDBM466923

CCOC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466924

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)S(=O)(=O)C1CC1 |r|

BDBM466925

COCC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466926

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)C(=O)CC1CC1 |r|

BDBM466927

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCCS1(=O)=O |r|

BDBM466928

CC(C)OC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466929

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)C(=O)OCC1CC1 |r|

BDBM466930

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(C)CCCS1(=O)=O |r|

BDBM466931

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)[C@]1(C)CCCS1(=O)=O |r|

BDBM466933

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)[C@@]1(C)CCCS1(=O)=O |r|

BDBM490847

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCNCC1

BDBM490897

COc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)[C@H]1CCN(C)C[C@@H]1F |r|

BDBM490915

CCN1CCC(COc2ccc(-c3cc(Nc4cnc(cn4)C#N)n[nH]3)c(OC)c2)CC1

BDBM490916

COc1cc(OCC2CCN(CC2)C(C)C)ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM490948

FC(F)(F)Oc1cc(ccc1-c1cc(Nc2cnc(cn2)C#N)n[nH]1)N1CCNCC1

BDBM50248946

CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3ccccc23)c2ccccc2)cc1

BDBM50248937

COC(=O)c1ccc2NC(=O)\C(=C(/Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)c2c1

BDBM50248938

CN(C(=O)CN1CCN(C)CC1)c1ccc(N\C(=C2/C(=O)Nc3ccc(cc23)C(O)=O)c2ccccc2)cc1

BDBM50524300

COc1cccc(OCCCN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590717

COc1ccnc(OCCCNC(=O)OC(C)(C)C)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590718

COc1cc(Cl)nc(OCCCN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590719

COc1cncc(OCCCN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590720

COc1nccc(OCCCN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590721

COc1cncc(OCC2(F)CNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590722

COc1nccc(OCC2(C)CNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590723

COc1nccc(OCC2(O)CNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590724

COc1nccc(OCC2(CO)CNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590725

COc1cncc(OCC[C@@H](C)N)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590726

COc1cncc(OCC[C@H](C)N)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590727

COc1cncc(OCC2(CN)CC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590728

COc1cncc(OC[C@@H]2CNCCO2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590729

COc1cncc(OC[C@H]2CNCCO2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590730

COc1cncc(OC[C@@H](O)CN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590731

COc1ccnc(OCCCN)c1-c1cc(Nc2cnc(Cl)cn2)n[nH]1

BDBM590732

COc1ccnc(OCCCN)c1-c1cc(Nc2cnc(cn2)C(F)(F)F)n[nH]1

BDBM590733

COc1ncnc(OCCCN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590734

COc1cncc(OCC2CNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590735

COc1cncc(O[C@@H]2CCC[C@H](N)C2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590736

COc1cncc(OC[C@]2(F)CCNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590737

COc1cncc(OC[C@H]2CCNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590738

COc1cncc(OC[C@@]2(F)CCNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590739

COc1ncnc(OCC2(CN)CC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590740

NCCCOc1cncc(OCF)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590741

COc1cncc(OCC2(C)CNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590742

COc1cncc(OCC2(CNC2)C(F)F)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590743

COc1cncc(OC[C@@H](C)CN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590744

COc1cncc(OC[C@H](C)CN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590745

COc1cncc(OC[C@H](F)CN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590746

CNCCCOc1cncc(OC)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590747

COc1cncc(O[C@@H]2CC[C@@H](N)C2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590748

COc1cncc(O[C@H](C)C2CNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590749

COc1cncc(O[C@H](C)C2(O)CNC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590750

CN[C@@H]1CC[C@H](C1)Oc1cncc(OC)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590751

COc1cncc(O[C@H]2C[C@H](N)[C@H]3C[C@@H]23)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1 |r|

BDBM590752

COc1ccnc(OCC2(CN)CC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM590753

COc1nccc(OCC2(CN)CC2)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM773956

N#Cc1cnc(Nc2cc(NCC3CNCCO3)c(C(N)=O)nn2)cn1

BDBM773960

N#Cc1cnc(Nc2cc(NCC3CCNCC3)c(C(N)=O)nn2)cn1

BDBM773962

CC(C)(C)OC(=O)N1CCOC(CNc2cc(Nc3cnc(C#N)cn3)nnc2C(F)(F)F)C1

BDBM774014

N#Cc1cnc(Nc2cc(NCC3CNCCO3)c(C(F)(F)F)nn2)cn1

BDBM774015

N#Cc1cnc(Nc2cc(NCC3CCNCC3)c(C(F)(F)F)nn2)cn1

BDBM601386

COc1nc(C)ccc1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1

BDBM601389

COc1nc(C)ccc1-c1cc(Nc2cnc3c(F)cn(C4CCNCC4)c3n2)n[nH]1

BDBM601390

COc1nc(C)ccc1-c1cc(Nc2cnc3ccn(CC4CCNCC4)c3n2)n[nH]1

BDBM601391

COc1nc(C)ccc1-c1cc(Nc2cnc3ccn(CC4CNC4)c3n2)n[nH]1

BDBM601393

COc1nc(C)ccc1-c1cc(Nc2cnc3ccn(C[C@H]4CCNC4)c3n2)n[nH]1 |r|

BDBM601395

COc1cccc(F)c1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1

BDBM601396

COc1ccc(F)cc1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1

BDBM601397

COc1nc(ccc1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1)C(F)(F)F

BDBM601399

COc1ccccc1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1

BDBM601400

Fc1cccc(OC(F)(F)F)c1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1

BDBM601408

COc1cc(F)ccc1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1

BDBM601445

COc1cc(C)ccc1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1

BDBM601446

COc1cc(Cl)ccc1-c1cc(Nc2cnc3ccn(C4CCNCC4)c3n2)n[nH]1

BDBM601449

COc1cccc(F)c1-c1[nH]nc(Nc2cnc3ccn(C4CCNCC4)c3n2)c1F |(-7.05,-30.43,;-6.4,-28.98,;-7.31,-27.73,;-8.84,-27.89,;-9.75,-26.64,;-9.12,-25.24,;-7.59,-25.08,;-6.94,-23.62,;-6.68,-26.32,;-5.15,-26.16,;-4.38,-24.83,;-2.88,-25.15,;-2.71,-26.68,;-1.38,-27.45,;-.05,-26.68,;-.05,-25.14,;1.29,-24.37,;2.62,-25.14,;4.09,-24.66,;4.99,-25.91,;4.09,-27.16,;4.56,-28.62,;3.53,-29.76,;3.96,-31.27,;5.54,-31.61,;6.61,-30.4,;6.07,-28.94,;2.62,-26.68,;1.29,-27.45,;-4.12,-27.31,;-4.45,-28.86,)|

BDBM601450

COc1cccc(F)c1-c1cc(Nc2cnc3c(F)cn(C4CCNCC4)c3n2)n[nH]1

BDBM601451

COc1cccc(F)c1-c1cc(Nc2cnc3cc(C)n(C4CCNCC4)c3n2)n[nH]1

BDBM601452

COc1nc(C)ccc1-c1cc(Nc2cnc3ccn(C4CCN(C)CC4)c3n2)n[nH]1

BDBM601453

COc1nc(C)ccc1-c1cc(Nc2cnc3c(F)cn(C4CCN(C)CC4)c3n2)n[nH]1

BDBM774016

N#Cc1cnc(Nc2cc(NCC3CNCCO3)cnn2)cn1

BDBM734336

N#Cc4cnc(Nc3cc(c1c(OCCCN)ccc2cccnc12)[nH]n3)cn4

BDBM734390

N#Cc1cnc(Nc2cc(-c3c(OCCCN)ccc4ccoc34)[nH]n2)cn1

BDBM734391

N#Cc1cnc(Nc2cc(-c3c(OCCCN)ccc4c3OCC4)[nH]n2)cn1

BDBM734392

N#Cc1cnc(Nc2cc(-c3c(OCC4(CN)CC4)ccc4c3OCC4)[nH]n2)cn1

BDBM734393

CC1(COc2ccc3c(c2-c2cc(Nc4cnc(C#N)cn4)n[nH]2)OCC3)CNC1

BDBM734394

N#Cc1cnc(Nc2cc(-c3c(OCCCN)ccc4ccnn34)[nH]n2)cn1

BDBM734395

N#Cc1cnc(Nc2cc(-c3c(OCCCN)cnc4ccnn34)[nH]n2)cn1

BDBM734396

N#Cc1cnc(Nc2cc(-c3c(OCCCN)cnc4cccnc34)[nH]n2)cn1

BDBM734397

N#Cc1cnc(Nc2cc(-c3c(OCC(F)(F)CN)cnc4cccnc34)[nH]n2)cn1

BDBM734398

N#Cc1cnc(Nc2cc(-c3c(OCC4(CN)CC4)cnc4cccnc34)[nH]n2)cn1

BDBM734399

CC1(COc2cnc3cccnc3c2-c2cc(Nc3cnc(C#N)cn3)n[nH]2)CNC1

BDBM734400

N#Cc1cnc(Nc2cc(-c3c(OC[C@@H]4CNCCO4)cnc4cccnc34)[nH]n2)cn1

BDBM734401

N#Cc1cnc(Nc2cc(-c3c(OCCCN)cnc4c3OCC4)[nH]n2)cn1

BDBM734402

N#Cc1cnc(Nc2cc(-c3c(OCC4(CN)CC4)cnc4c3OCC4)[nH]n2)cn1

BDBM734403

CC1(COc2cnc3c(c2-c2cc(Nc4cnc(C#N)cn4)n[nH]2)OCC3)CNC1

BDBM734404

Cc1nc2ccc(OCCCN)c(-c3cc(Nc4cnc(C#N)cn4)n[nH]3)c2o1

BDBM734405

N#Cc1cnc(Nc2cc(-c3c(OCC4(CN)CC4)ccc4ccnn34)[nH]n2)cn1

BDBM734406

CC1(COc2ccc3ccnn3c2-c2cc(Nc3cnc(C#N)cn3)n[nH]2)CNC1

BDBM734407

N#Cc1cnc(Nc2cc(-c3c(OCC4(CN)CC4)ccc4ccoc34)[nH]n2)cn1

BDBM734408

N#Cc1cnc(Nc2cc(-c3c(OCC4(CN)CC4(F)F)ccc4ccoc34)[nH]n2)cn1

BDBM734409

N#Cc1cnc(Nc2cc(-c3c(O[C@@H]4CC[C@@H](N)C4)cnc4c3OCC4)[nH]n2)cn1

BDBM734410

N#Cc1cnc(Nc2cc(-c3c(OCC4(C(F)F)CNC4)cnc4c3OCC4)[nH]n2)cn1

BDBM734411

N#Cc1cnc(Nc2cc(-c3c(OCC4(F)CNC4)cnc4c3OCC4)[nH]n2)cn1

BDBM734412

N#Cc1cnc(Nc2cc(-c3c(O[C@@H]4CCC[C@H](N)C4)cnc4c3OCC4)[nH]n2)cn1

BDBM734413

C[C@@H](Oc1cnc2c(c1-c1cc(Nc3cnc(C#N)cn3)n[nH]1)OCC2)C1CNC1

BDBM734414

N#Cc1cnc(Nc2cc(-c3c(OC[C@H]4CCNC4)cnc4c3OCC4)[nH]n2)cn1

BDBM734415

CNCCCOc1cnc2c(c1-c1cc(Nc3cnc(C#N)cn3)n[nH]1)OCC2

BDBM734416

C[C@H](CN)COc1cnc2c(c1-c1cc(Nc3cnc(C#N)cn3)n[nH]1)OCC2

BDBM734417

N#Cc1cnc(Nc2cc(-c3c(O[C@H]4C[C@H](N)[C@H]5C[C@H]54)cnc4c3OCC4)[nH]n2)cn1

BDBM734418

C[C@@H](CN)COc1cnc2c(c1-c1cc(Nc3cnc(C#N)cn3)n[nH]1)OCC2

BDBM734419

C=C(CN)COc1cnc2c(c1-c1cc(Nc3cnc(C#N)cn3)n[nH]1)OCC2

BDBM734420

NCCCOc1cnc2c(c1-c1cc(Nc3cnc(Cl)cn3)n[nH]1)OCC2

BDBM734421

COC(=O)c1cnc(Nc2cc(-c3c(OCCCN)cnc4c3OCC4)[nH]n2)cn1

BDBM734422

N#Cc1cnc(Nc2cc(-c3c(O[C@@H]4CCC[C@H]4CN)cnc4cccnc34)[nH]n2)cn1

BDBM734423

N#Cc1cnc(Nc2cc(-c3c(OCC4(F)CNC4)cnc4cccnc34)[nH]n2)cn1

BDBM734424

N#Cc1cnc(Nc2cc(-c3c(O[C@@H]4CCC[C@H](N)C4)cnc4cccnc34)[nH]n2)cn1

BDBM734425

N#Cc1cnc(Nc2cc(-c3c(O[C@@H]4CC[C@@H](N)C4)cnc4cccnc34)[nH]n2)cn1

BDBM734426

N#Cc1cnc(Nc2cc(-c3c(OCC4(CN)CC(F)(F)C4)cnc4cccnc34)[nH]n2)cn1

BDBM748779

Nc3ncc(c2cc(c1cnn(CC(F)(F)F)c1)ncc2F)nc3C(=O)NC4CNC[C@@H](F)C4

BDBM748781

Nc3ncc(c2cc(c1cnn(CC(F)(F)F)c1)ncc2F)nc3C(=O)NC4CNCC(F)(F)C4

BDBM748791

Nc3ncc(c2ccnc(c1cnn(CC(F)(F)F)c1)c2)nc3C(=O)NC4CNCC[C@H]4O

BDBM748792

Nc3ncc(c2ccnc(c1cnn(CC(F)(F)F)c1)c2)nc3C(=O)N[C@@H]4CNC[C@@H](F)C4

BDBM748793

Cn1cc(-c2cccc(-c3cnc(N)c(C(=O)NC4CCCNC4)n3)c2)cn1

BDBM748794

Cn1cc(-c2cccc(-c3cnc(N)c(C(=O)NC4CNC[C@@H](F)C4)n3)c2)cn1

BDBM748795

Cn1cc(-c2ccc(F)c(-c3cnc(N)c(C(=O)NC4CCCNC4)n3)c2)cn1

BDBM748796

Cn1cc(-c2ccc(F)c(-c3cnc(N)c(C(=O)NC4CNC[C@@H](F)C4)n3)c2)cn1

BDBM748797

Nc1ncc(-c2ccnc(-c3cnn(C4CC4)c3)c2)nc1C(=O)NC1CCCNC1

BDBM748798

Nc3ncc(c2ccnc(c1cnn(CC(F)(F)F)c1)c2)nc3C(=O)N[C@H]4CCCNC4

BDBM748802

N#CCn1cc(-c2cccc(-c3cnc(N)c(C(=O)N[C@@H]4CNCC[C@H]4O)n3)c2)cn1

BDBM748803

N#CCn1cc(-c2cccc(-c3cnc(N)c(C(=O)N[C@@H]4CNC[C@@H](F)C4)n3)c2)cn1

BDBM748804

N#CCn1cc(-c2cccc(-c3cnc(N)c(C(=O)N[C@H]4CCCNC4)n3)c2)cn1

BDBM748805

CC(C)(O)Cn1cc(-c2cccc(-c3cnc(N)c(C(=O)N[C@@H]4CNCC[C@H]4O)n3)c2)cn1

BDBM748806

CC(C)(O)Cn1cc(-c2cccc(-c3cnc(N)c(C(=O)N[C@@H]4CNC[C@@H](F)C4)n3)c2)cn1

BDBM748807

CC(C)(O)Cn1cc(-c2cccc(-c3cnc(N)c(C(=O)N[C@H]4CCCNC4)n3)c2)cn1

BDBM748808

Nc1ncc(-c2cc(-c3cnn(C4CC4)c3)ccc2F)nc1C(=O)N[C@H]1CCCNC1

BDBM748809

CC(C)(O)Cn1cc(-c2cc(-c3cnc(N)c(C(=O)NC4CNCC(F)(F)C4)n3)c(F)cn2)cn1

BDBM748810

CC(C)(O)Cn1cc(-c2cc(-c3cnc(N)c(C(=O)NC4CNCC(F)(F)C4)n3)ccn2)cn1

BDBM748811

CC(C)(O)Cn1cc(-c2cc(-c3cnc(N)c(C(=O)NC4CNC[C@@H](F)C4)n3)ccn2)cn1

BDBM748812

CC(C)(O)Cn1cc(-c2ccc(F)c(-c3cnc(N)c(C(=O)NC4CNC[C@@H](F)C4)n3)c2)cn1

BDBM748813

CC(C)(O)Cn1cc(-c2ccc(F)c(-c3cnc(N)c(C(=O)NC4CNCC(F)(F)C4)n3)c2)cn1

BDBM748814

Cc1ccc(-c2cnn(CC(C)(C)O)c2)cc1-c1cnc(N)c(C(=O)NC2CNC[C@@H](F)C2)n1

BDBM748815

Cc1ccc(-c2cnn(CC(C)(C)O)c2)cc1-c1cnc(N)c(C(=O)NC2CNCC(F)(F)C2)n1

BDBM748816

Nc3ncc(c2nccc(c1cnn(CC(F)(F)F)c1)n2)nc3C(=O)N[C@H]4CCCNC4

BDBM748817

Cn1cc(-c2ccc(F)c(-c3cnc(N)c(C(=O)NC4CCC5(CC5)NC4)n3)c2)cn1

BDBM748818

Cn1cc(-c2cccc(-c3cnc(N)c(C(=O)NC4CCC5(CC5)NC4)n3)c2)cn1

BDBM748819

CC1(C)Cc2c(-c3cccc(-c4cnc(N)c(C(=O)N[C@H]5CCCNC5)n4)c3)cnn2C1

BDBM748820

CC1(C)Cc2c(-c3ccc(F)c(-c4cnc(N)c(C(=O)N[C@H]5CCCNC5)n4)c3)cnn2C1

BDBM748821

CC1(C)Cc2c(-c3ccc(F)c(-c4cnc(N)c(C(=O)N[C@@H]5CNC[C@@H](F)C5)n4)c3)cnn2C1

BDBM748822

CC1(C)Cc2c(-c3cccc(-c4cnc(N)c(C(=O)N[C@@H]5CNC[C@@H](F)C5)n4)c3)cnn2C1

BDBM748823

CC1(C)Cc2c(-c3ccc(F)c(-c4cnc(N)c(C(=O)N[C@H]5CCC6(CC6)NC5)n4)c3)cnn2C1

BDBM748836

CC1(C)Cc2c(-c3cccc(-c4cnc(N)c(C(=O)N[C@@H]5CNCC(F)(F)C5)n4)c3)cnn2C1

BDBM748841

CC1(C)Cc2c(-c3nccc(-c4cnc(N)c(C(=O)NC5CNC[C@@H](F)C5)n4)n3)cnn2C1

BDBM748842

CC1(C)Cc2c(-c3cccc(-c4cnc(N)c(C(=O)N[C@H]5CCC6(CC6)NC5)n4)c3)cnn2C1

BDBM748843

CC1(C)Cc2c(-c3ccc(F)c(-c4cnc(N)c(C(=O)N[C@H]5CCC6(CC6)NC5)n4)c3)cnn2C1

BDBM50216157

O=C1NC(=O)c2c1c1cncn1c1[nH]c3ccccc3c21

BDBM6763

c1ccc2c(c1)c3c4c(c5c6ccccc6n7c5c3n2[C@H]8CC[C@@H]7O8)C(=O)NC4=O

BDBM50363645

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]ccc12 |w:7.8,t:1|

BDBM50375669

CN1CCc2[nH]c(=S)c(C#N)c(-c3cccs3)c2C1

BDBM50192379

Cc1cccc(C)c1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12 |(19.86,-2.13,;20.49,-.72,;22.02,-.56,;22.64,.85,;21.72,2.1,;20.2,1.93,;19.29,3.17,;19.58,.52,;18.06,.36,;17.42,-1.06,;15.89,-1.21,;14.98,-2.47,;13.5,-1.99,;12.17,-2.76,;10.84,-1.99,;10.84,-.44,;9.51,.33,;12.17,.33,;13.5,-.44,;14.98,.04,;15.61,1.45,;14.98,2.86,;13.48,3.18,;16.13,3.88,;17.46,3.11,;18.86,3.73,;17.13,1.61,)|

BDBM50192410

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1C(F)(F)F

BDBM50192404

Cc1ccc(C)c(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192401

OCc1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192416

CC(=O)c1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192356

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1F

BDBM50192434

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1O

BDBM50192351

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccc(c1)C#N

BDBM50192372

Oc1ccc2oc3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50192363

CSc1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192430

CCOc1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192361

Oc1ccc2sc3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50192433

Cn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50192443

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1[N+]([O-])=O

BDBM50192342

CS(=O)c1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192427

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Br)cccc1Br |(7.66,-44.93,;8.99,-45.7,;8.99,-47.24,;10.32,-48.02,;11.65,-47.25,;13.13,-47.72,;14.03,-46.47,;15.57,-46.31,;16.2,-44.9,;15.28,-43.65,;15.6,-42.15,;17.01,-41.53,;14.27,-41.38,;13.13,-42.4,;11.63,-42.08,;13.75,-43.81,;13.13,-45.22,;11.65,-45.69,;10.32,-44.93,;17.72,-44.74,;18.63,-45.98,;18.01,-47.39,;20.16,-45.82,;20.78,-44.41,;19.87,-43.16,;18.34,-43.33,;17.43,-42.09,)|

BDBM50192400

CCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50192435

Nc1ccc(c(Br)c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192438

CC(C)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50192420

Nc1ccc(cc1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192419

CS(=O)c1ccc(cc1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192431

Oc1ccc2[nH]c3cc(C4CCCNC4)c4C(=O)NC(=O)c4c3c2c1

BDBM50192406

Cc1ccc(cc1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192403

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(O)cccc1Cl |(7.55,-32.91,;8.88,-33.68,;8.88,-35.22,;10.21,-36,;11.55,-35.22,;13.02,-35.7,;13.92,-34.45,;15.46,-34.29,;16.1,-32.88,;15.17,-31.63,;15.5,-30.13,;16.9,-29.51,;14.17,-29.36,;13.02,-30.38,;11.52,-30.06,;13.65,-31.79,;13.02,-33.19,;11.54,-33.67,;10.21,-32.91,;17.62,-32.71,;18.23,-31.31,;17.32,-30.07,;19.76,-31.14,;20.68,-32.39,;20.05,-33.8,;18.52,-33.96,;17.9,-35.37,)|

BDBM50192382

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)ccc(O)c1Cl |(-8.42,-23.21,;-7.09,-23.98,;-7.09,-25.52,;-5.76,-26.29,;-4.43,-25.52,;-2.95,-26,;-2.05,-24.75,;-.51,-24.59,;.12,-23.18,;-.8,-21.93,;-.48,-20.43,;.93,-19.81,;-1.81,-19.66,;-2.95,-20.68,;-4.45,-20.36,;-2.33,-22.09,;-2.95,-23.49,;-4.43,-23.97,;-5.76,-23.21,;1.64,-23.01,;2.26,-21.61,;1.35,-20.37,;3.79,-21.44,;4.7,-22.69,;4.08,-24.1,;4.99,-25.34,;2.55,-24.26,;1.93,-25.67,)|

BDBM50192377

COc1cccc(Cl)c1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12 |(32.88,-28.65,;32.26,-30.06,;33.17,-31.3,;34.7,-31.13,;35.61,-32.38,;34.99,-33.79,;33.46,-33.95,;32.84,-35.36,;32.55,-32.7,;31.03,-32.87,;30.4,-34.28,;28.86,-34.44,;27.96,-35.69,;26.48,-35.21,;25.15,-35.98,;23.82,-35.21,;23.82,-33.67,;22.49,-32.9,;25.15,-32.9,;26.48,-33.66,;27.96,-33.18,;28.58,-31.78,;27.96,-30.37,;26.46,-30.05,;29.1,-29.35,;30.43,-30.12,;31.84,-29.5,;30.11,-31.62,)|

BDBM50192426

Oc1ccc2[nH]c3ccc4C(=O)NC(=O)c4c3c2c1

BDBM50192417

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccncc1

BDBM50192365

Cc1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192345

Oc1ccc2[nH]c3cc(C4CCNC4)c4C(=O)NC(=O)c4c3c2c1

BDBM50192408

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccc(c1)C(F)(F)F

BDBM50192367

CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50192348

Oc1ccc2[nH]c3cc(c4C(=O)NCc4c3c2c1)-c1ccccc1

BDBM50192354

COC1NC(=O)c2c1c1c(cc2-c2ccccc2)[nH]c2ccc(O)cc12

BDBM50192349

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50192429

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccc(Cl)cc1

BDBM50192425

Oc1ccc2[nH]c3cc(-c4cccs4)c4C(=O)NC(=O)c4c3c2c1

BDBM50192428

Oc1ccc2[nH]c3cc(-c4ccsc4)c4C(=O)NC(=O)c4c3c2c1

BDBM50192373

Cc1c(c2C(=O)NC(=O)c2c2c1[nH]c1ccc(O)cc21)-c1ccccc1

BDBM50192374

COc1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192366

CCc1c(c2C(=O)NC(=O)c2c2c1[nH]c1ccc(O)cc21)-c1ccccc1

BDBM50192398

Oc1ccc2[nH]c3c(cc4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50192421

OC1NC(=O)c2c1c1c(cc2-c2ccccc2)[nH]c2ccc(O)cc12

BDBM50192422

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1I

BDBM50192440

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Br

BDBM50192411

Cn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50192442

COc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50192371

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50192343

Oc1ccc2oc3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50192386

CC(=O)c1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192378

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccc(cc1)C(F)(F)F

BDBM50192413

OCc1ccc(cc1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192437

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccc(Cl)c1Cl

BDBM50192389

Nc1ccc(Cl)c(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192393

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccc(O)c1Cl

BDBM50192439

Cc1cccc(c1C)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192409

CCCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50192387

CC(C)n1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50192360

CCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50192397

Oc1ccc2[nH]c3cc(c4C(=O)OC(=O)c4c3c2c1)-c1ccccc1

BDBM50192405

NN1C(=O)c2c(C1=O)c1c(cc2-c2ccccc2)[nH]c2ccc(O)cc12

BDBM50192412

OCc1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192346

NCc1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192344

COc1cccc(F)c1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12 |(35.24,-13.49,;36.77,-13.32,;37.4,-11.92,;38.93,-11.75,;39.55,-10.34,;38.63,-9.1,;37.11,-9.27,;36.2,-8.03,;36.49,-10.67,;34.97,-10.84,;34.34,-12.25,;32.8,-12.41,;31.89,-13.66,;30.42,-13.18,;29.09,-13.95,;27.75,-13.18,;27.76,-11.64,;26.42,-10.87,;29.08,-10.87,;30.42,-11.63,;31.89,-11.15,;32.52,-9.74,;31.9,-8.34,;30.39,-8.02,;33.04,-7.31,;34.37,-8.08,;35.78,-7.46,;34.05,-9.59,)|

BDBM50192399

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cccc1Cl |(-8.44,-32.87,;-7.11,-33.63,;-7.11,-35.18,;-5.78,-35.95,;-4.44,-35.18,;-2.97,-35.66,;-2.06,-34.4,;-.53,-34.25,;.11,-32.83,;-.82,-31.58,;-.49,-30.08,;.91,-29.46,;-1.82,-29.31,;-2.97,-30.34,;-4.47,-30.01,;-2.34,-31.74,;-2.97,-33.15,;-4.44,-33.63,;-5.78,-32.86,;1.63,-32.67,;2.53,-33.91,;1.91,-35.32,;4.06,-33.75,;4.69,-32.34,;3.77,-31.09,;2.25,-31.27,;1.33,-30.02,)|

BDBM50192394

COc1cccc(OC)c1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12 |(18.36,-14.01,;19.89,-13.84,;20.51,-12.44,;22.04,-12.27,;22.67,-10.86,;21.75,-9.62,;20.22,-9.79,;19.31,-8.55,;19.93,-7.14,;19.61,-11.19,;18.09,-11.36,;17.45,-12.77,;15.92,-12.93,;15.01,-14.18,;13.54,-13.7,;12.2,-14.47,;10.87,-13.7,;10.87,-12.16,;9.54,-11.39,;12.2,-11.39,;13.53,-12.15,;15.01,-11.67,;15.64,-10.26,;15.01,-8.86,;13.51,-8.54,;16.16,-7.83,;17.49,-8.61,;18.89,-7.98,;17.16,-10.11,)|

BDBM50192436

Oc1ccc2[nH]c3cc(-c4ccc[nH]4)c4C(=O)NC(=O)c4c3c2c1

BDBM50192415

Oc1ccc2[nH]c3cc(-c4cc[nH]c4)c4C(=O)NC(=O)c4c3c2c1

BDBM50192364

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccnc1

BDBM50192380

Cc1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192441

CCc1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192423

Oc1ccc(Cl)c(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192402

COc1cc(N)ccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192353

COc1ccc(N)cc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192424

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cc(O)cc1Cl |(7.99,-23.45,;9.33,-24.22,;9.32,-25.76,;10.66,-26.53,;11.99,-25.76,;13.46,-26.24,;14.37,-24.99,;15.91,-24.83,;16.54,-23.42,;15.62,-22.17,;15.94,-20.66,;17.35,-20.04,;14.61,-19.89,;13.47,-20.92,;11.96,-20.6,;14.09,-22.32,;13.46,-23.73,;11.99,-24.21,;10.65,-23.45,;18.06,-23.25,;18.68,-21.85,;17.77,-20.61,;20.21,-21.68,;21.12,-22.92,;22.65,-22.76,;20.5,-24.33,;18.97,-24.5,;18.35,-25.9,)|

BDBM50192396

Oc1ccc2[nH]c3cc(I)c4C(=O)NC(=O)c4c3c2c1

BDBM50192391

CN1C(=O)c2c(C1=O)c1c(cc2-c2ccccc2)n(C)c2ccc(O)cc12

BDBM50192347

Oc1cccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c12)-c1ccccc1

BDBM50192369

OC1NC(=O)c2c1c(cc1[nH]c3ccc(O)cc3c21)-c1ccccc1

BDBM50192341

Oc1ccc2c(c1)[nH]c1cc(c3C(=O)NC(=O)c3c21)-c1ccccc1

BDBM50192414

Nc1cccc(c1Cl)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192383

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1C#N

BDBM50192357

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1-c1ccccc1

BDBM50192381

Oc1ccc(c(Cl)c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192355

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccc(cc1)C#N

BDBM50192392

CC(=O)c1ccc(cc1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192418

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccc(c1)-c1ccccc1

BDBM50192384

Oc1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192370

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cc(Cl)ccc1Cl

BDBM50192385

Oc1ccc(cc1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192352

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccc(c1)[N+]([O-])=O

BDBM50192395

Nc1ccc(c(Cl)c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192359

COc1ccc(cc1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192407

Cc1c2C(=O)NC(=O)c2c2c([nH]c3ccc(O)cc23)c1-c1ccccc1

BDBM50192368

Nc1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192358

COc1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192362

Nc1cccc(c1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192390

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccc(Cl)c1

BDBM50192376

CSc1ccc(cc1)-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192375

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccc(F)cc1

BDBM50192388

NC(=O)c1ccccc1-c1cc2[nH]c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50192350

Oc1ccc2[nH]c3c(-c4ccccc4)c(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50192432

Oc1ccc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1cccc(F)c1

BDBM50256750

Nc1ncc(NC(=O)c2cc(NC(=O)c3cccc(c3)C(F)(F)F)ccc2Cl)cc1Cl

BDBM50315069

CC(C)N1CCN(CC1)C(=O)c1ccc(NC(=O)Nc2ccc(cc2)-c2nc(nc(n2)N2C3CCC2COC3)C2CCOCC2)cc1

BDBM50316252

COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1

BDBM50316253

CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(N)cc1)N1CCOCC1

BDBM50355567

NC(=N)N\N=C\c1c(nc2sccn12)-c1cc(c(Cl)cc1Cl)[N+]([O-])=O

BDBM50355568

CCCc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1cc(c(Cl)cc1Cl)[N+]([O-])=O

BDBM50355566

NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1ccc(Cl)c(c1)[N+]([O-])=O

BDBM50355561

NC(=N)N\N=C\c1c(nc2sccn12)-c1ccc(Cl)c(c1)[N+]([O-])=O

BDBM50355571

NC(=N)N\N=C\c1c(nc2sc3ccccc3n12)-c1ccc(Cl)c(c1)[N+]([O-])=O

BDBM50355560

NC(=N)N\N=C\c1c(nc2sccn12)-c1ccc(N)cc1

BDBM50355570

CCCc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1ccc(Cl)c(c1)[N+]([O-])=O

BDBM50355559

[#7]\[#6](-[#7])=[#7]\[#7]=[#6]-c1c(nc2ccccn12)-c1ccc(Cl)c(c1)-[#7+](-[#8-])=O |w:5.5|

BDBM50355558

Cc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1ccc(cc1)[N+]([O-])=O

BDBM50355551

NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1cc(Cl)sc1Cl

BDBM50355565

NC(=N)N\N=C\c1c(nc2sccn12)-c1ccc(cc1)[N+]([O-])=O

BDBM50355564

Cc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1cc(c(Cl)cc1Cl)[N+]([O-])=O

BDBM50355585

NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1ccc(F)cc1

BDBM50355563

Cc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1ccc(Cl)c(c1)[N+]([O-])=O

BDBM50355583

NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1ccc(F)c(c1)[N+]([O-])=O

BDBM50355562

COc1cc(c(OC)cc1-c1nc2sccn2c1\C=N\NC(N)=N)[N+]([O-])=O

BDBM50355552

NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1ccc(cc1)C#N

BDBM50355576

Cc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1cccc(c1)[N+]([O-])=O

BDBM50355597

Cc1cn2c(\C=N\NC(=N)NN)c(nc2s1)-c1ccc(Cl)c(c1)[N+]([O-])=O

BDBM50355598

NC(=N)N\N=C\c1c(nc2sccn12)-c1cccc(c1)[N+]([O-])=O

BDBM50355572

COc1cc(c(OC)cc1-c1nc2sc(Cl)cn2c1\C=N\NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1cc(OC)c(cc1OC)[N+]([O-])=O)[N+]([O-])=O

BDBM50355573

CCCc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1cccc(c1)[N+]([O-])=O

BDBM50355574

Cc1sc2nc(c(\C=N\NC(N)=N)n2c1C)-c1ccc(Cl)c(c1)[N+]([O-])=O

BDBM50355557

NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1ccc(cc1)[N+]([O-])=O

BDBM50355575

NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1ccc(Cl)cc1

BDBM50355556

COc1cc(c(OC)cc1-c1nc2ccccn2c1C=N[NH+]=C(N)[NH-])[N+]([O-])=O |w:19.21,21.23|

BDBM50355550

NC(=N)N\N=C/c1c(nc2sc(Br)cn12)-c1ccc(cc1)[N+]([O-])=O

BDBM50355554

NC(=N)N\N=C\c1c(nc2sc3ccccc3n12)-c1cc(Cl)sc1Cl

BDBM50355600

CCCc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1ccc(cc1)[N+]([O-])=O

BDBM50355599

Cc1cn2c(\C=N\NC3=[NH+]CC[N-]3)c(nc2s1)-c1ccc(Cl)c(c1)[N+]([O-])=O |t:8|

BDBM50355602

Cc1csc2nc(c(\C=N\NC(N)=N)n12)-c1ccc(Cl)c(c1)[N+]([O-])=O

BDBM50355601

Cc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1cc(Cl)sc1Cl

BDBM50355603

NC(=N)N\N=C\c1c(nc2sccn12)-c1cc(Cl)sc1Cl

BDBM50355604

CCc1cn2c(\C=N\NC(N)=N)c(nc2s1)-c1cc(c(Cl)cc1Cl)[N+]([O-])=O

BDBM50355607

Cc1sc2nc(c(\C=N\NC(N)=N)n2c1C)-c1cccnc1

BDBM50355608

Cc1csc2nc(c(\C=N\NC(N)=N)n12)-c1cccnc1

BDBM50355555

COc1cc(c(OC)cc1-c1nc2sc3ccccc3n2c1\C=N\[NH+]=C(\N)[NH-])[N+]([O-])=O

BDBM50355578

Cc1cn2c(\C=N/NC(N)=N)c(nc2s1)-c1ccc(F)c(c1)[N+]([O-])=O

BDBM50355553

NC(=N)N\N=C/c1c(nc2sc(F)cn12)-c1ccc(cc1)[N+]([O-])=O

BDBM50355609

NC(=N)N\N=C/c1c(nc2sccn12)-c1ccc(Br)c(c1)[N+]([O-])=O

BDBM50355577

Cc1cn2c(\C=N/NC(N)=N)c(nc2s1)-c1ccc(F)cc1

BDBM50355588

NC(=N)N\N=C/c1c(nc2sccn12)-c1ccc(F)cc1

BDBM50355593

NC(=N)N\N=C/c1c(nc2sccn12)-c1ccc(F)c(c1)[N+]([O-])=O

BDBM50355569

NC(=N)N\N=C\c1c(nc2sc(Cl)cn12)-c1cccc(c1)[N+]([O-])=O

BDBM50389320

CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCN(CC1)C1CCNCC1

BDBM50243258

c1ccc(cc1)c2cc(c(s2)NC(=O)N)C(=O)N[C@H]3CCCNC3

BDBM50389820

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1ccccc1F |r|

BDBM50389810

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1ccc(F)cc1F |r|

BDBM50242823

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1cccc(F)c1 |r|

BDBM50389809

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(Cl)c(Cl)c1 |r|

BDBM50389808

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1ccc(Cl)c(Cl)c1 |r|

BDBM50242822

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccccc1F |r|

BDBM50243049

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(cc1)C#N |r|

BDBM50389803

c1cc(cc(c1)F)c2cc(c(s2)C(=O)N[C@H]3CCCNC3)NC(=O)N

BDBM50389812

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1cccc(F)c1F |r|

BDBM50389811

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(F)cc1F |r|

BDBM50389823

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1cccc(F)c1F |r|

BDBM50389814

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1cc(F)cc(F)c1 |r|

BDBM50389813

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1cc(F)cc(F)c1 |r|

BDBM50389806

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1ccc(cc1)C#N |r|

BDBM50242893

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1cccc(Cl)c1 |r|

BDBM50389805

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1cccc(c1)C#N |r|

BDBM50389815

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1cccc(Cl)c1 |r|

BDBM50389804

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1cccc(c1)C#N |r|

BDBM50242824

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(F)cc1 |r|

BDBM50389817

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1ccc(F)cc1 |r|

BDBM50389822

NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1ccccc1 |r|

BDBM50015314

COc1ccc(Oc2cc(C)c(-c3csc(NC(=O)c4ccnc(F)c4)n3)c(C)c2)cc1

BDBM50020310

CN1CCN(CCC(=O)Nc2c(C)[nH]c(\C=C3/C(=O)Nc4ccc(F)cc34)c2C)CC1

BDBM50021626

CC(C)(C)CNC(=O)CC1CNC(=O)c2cc(cn12)-c1ccsc1

BDBM50021618

CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(Cl)c2)C2CCCCC2)CC1 |r|

BDBM50126732

CCN(CC)CC=Cc1[nH]c(=O)c2c3n(C)c(Nc4c(Cl)cccc4Cl)nc3ccc2c1C |w:6.5|

BDBM50311953

CN1CCN(CC1)S(=O)(=O)c1cccc(\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1

BDBM50311954

CN1CCN(CC1)S(=O)(=O)c1cccc(\C=C\c2c(C)ncc(C#N)c2Nc2ccc3[nH]ccc3c2C)c1

BDBM41575

COc1ccc(cc1Nc1ncc2CCc3c(nn(C)c3-c2n1)C(N)=O)N1CCN(C)CC1

BDBM50331277

COc1ccc2cc([nH]c2c1)-c1n[nH]c2cccnc12

BDBM50136008

CC(C)OCc1ccc2n(CCCO)c3c4Cc5ccccc5-c4c4C(=O)NCc4c3c2c1

BDBM50149481

Nc1nc(O)c([nH]1)C1=C2C(=Nc3ccccc23)C(=O)NCC1 |c:10,t:8|

BDBM7491

NC1=NC(=O)C(N1)=C1CCNC(=O)c2[nH]c(Br)cc12 |w:7.19,t:1|

BDBM50183838

COCCN(Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)[C@@H](C)C(N)=O

BDBM50183840

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1(CN(C1)C(C)C)C(N)=O

BDBM50183834

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN[C@H](C)C(N)=O

BDBM50183851

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC[C@@H]1C(=O)N(C)C

BDBM50183845

CNC(=O)[C@H]1CCCN1Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC

BDBM50183855

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(CCN(C)C)[C@@H](C)C(N)=O

BDBM50183844

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@@H](CO)C(N)=O

BDBM50183831

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCOCC1C(N)=O

BDBM50183843

COC[C@H](N(C)Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)C(N)=O

BDBM50183860

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@H](C)C(=O)N(C)C

BDBM50183842

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC[C@H]1C(N)=O

BDBM50183861

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC1C(N)=O

BDBM50183864

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCCC[C@@H]1C(N)=O

BDBM50183836

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CC(C1)C(N)=O

BDBM50183837

COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1CN1CCC[C@@H]1C(N)=O

BDBM50183863

COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1CN1CCC[C@H]1C(N)=O

BDBM50183854

CNC(=O)[C@@H](C)N(C)Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC

BDBM50183835

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@H](C)C(N)=O

BDBM50183862

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@@H](C)C(N)=O

BDBM50183841

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1CCNC1=O

BDBM50183856

COCCN1CC(C1)(N(C)Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)C(N)=O

BDBM50183832

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCCC1

BDBM50183852

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)CC(N)=O

BDBM50183849

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C(C)C)[C@@H](C)C(N)=O

BDBM50183847

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1(CN(C)C1)C(N)=O

BDBM50183846

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1(CCN(CC1)C(C)C)C(N)=O

BDBM50183859

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CC[C@@H](C1)C(N)=O

BDBM50183858

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)C1(CCN(C)CC1)C(N)=O

BDBM50183850

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC[C@@H]1C(N)=O

BDBM50183857

CO[C@@H]1C[C@@H](N(Cc2cc3c(Nc4cccc(Cl)c4F)ncnc3cc2OC)C1)C(N)=O

BDBM50183848

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN(C)[C@@H](CN(C)C)C(N)=O

BDBM50183833

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCC[C@H]1CC(N)=O

BDBM50183839

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1CN1CCN(C)CC1C(N)=O

BDBM50183853

COCC[C@H](N(C)Cc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC)C(N)=O

BDBM50185214

Cc1cccc2c(N[C@@H]3CN4CCC3CC4)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c12 |wU:8.7,TLB:7:8:12.11:14.15,(20.4,-48.62,;20.4,-47.08,;19.07,-46.31,;19.07,-44.77,;20.4,-44,;21.73,-44.76,;23.07,-43.98,;23.06,-42.44,;22.11,-41.23,;21.84,-39.83,;20.48,-39.23,;19.02,-39.87,;19.21,-41.25,;20.75,-40.59,;21,-38.7,;20.55,-37.59,;24.42,-44.75,;25.75,-43.98,;27.15,-44.61,;28.18,-43.47,;29.72,-43.46,;30.49,-42.13,;29.71,-40.79,;28.17,-40.79,;27.4,-42.13,;25.9,-42.45,;24.42,-46.3,;25.76,-47.07,;23.08,-47.08,;21.74,-46.31,)|

BDBM50185218

Clc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N[C@H]3CCNC3)c2c1

BDBM50181305

Nc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ccccc12

BDBM50181317

Oc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ccccc12

BDBM50185224

Cc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(NC3CCCNC3)c2c1

BDBM50185220

Cc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(NC3CCNCC3)c2c1

BDBM50185223

Clc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N[C@@H]3CN4CCC3CC4)c2c1Cl |wU:20.21,TLB:19:20:24.23:26.27,(3.37,-44,;4.71,-44.76,;4.71,-46.31,;6.04,-47.08,;7.37,-46.31,;8.71,-47.08,;10.06,-46.3,;11.39,-47.07,;10.05,-44.75,;11.38,-43.97,;12.78,-44.6,;13.81,-43.46,;15.35,-43.46,;16.12,-42.12,;15.34,-40.78,;13.8,-40.79,;13.04,-42.12,;11.53,-42.45,;8.7,-43.97,;8.69,-42.43,;7.74,-41.22,;7.47,-39.83,;6.12,-39.23,;4.65,-39.87,;4.85,-41.25,;6.38,-40.59,;6.63,-38.7,;6.19,-37.59,;7.37,-44.76,;6.03,-43.99,;6.03,-42.46,)|

BDBM50185216

Clc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(NC3CCNCC3)c2c1

BDBM50185219

Clc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N[C@@H]3CN4CCC3CC4)c2c1 |wU:20.21,TLB:19:20:24.23:26.27,(4.27,-32.71,;5.6,-33.48,;5.6,-35.02,;6.93,-35.79,;8.27,-35.03,;9.61,-35.79,;10.95,-35.01,;12.28,-35.78,;10.94,-33.46,;12.27,-32.69,;13.68,-33.32,;14.7,-32.18,;16.24,-32.18,;17.02,-30.84,;16.23,-29.5,;14.69,-29.51,;13.93,-30.84,;12.43,-31.16,;9.59,-32.69,;9.59,-31.15,;8.64,-29.94,;8.36,-28.54,;7.01,-27.94,;5.55,-28.58,;5.74,-29.96,;7.27,-29.3,;7.53,-27.41,;7.08,-26.31,;8.26,-33.47,;6.93,-32.71,)|

BDBM50185217

Clc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(NC3CCCNC3)c2c1

BDBM50185226

Clc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N[C@@H]3CCNC3)c2c1

BDBM50185215

O=c1[nH]c2ccccc2c(N[C@@H]2CN3CCC2CC3)c1-c1nc2ccccc2[nH]1 |wU:11.11,TLB:10:11:15.14:17.18,(-2.4,-12.59,;-3.74,-11.82,;-5.08,-12.6,;-6.42,-11.83,;-7.76,-12.6,;-9.09,-11.83,;-9.09,-10.28,;-7.76,-9.51,;-6.43,-10.28,;-5.09,-9.49,;-5.1,-7.95,;-6.05,-6.74,;-6.33,-5.35,;-7.68,-4.75,;-9.14,-5.39,;-8.95,-6.77,;-7.42,-6.11,;-7.16,-4.22,;-7.61,-3.11,;-3.75,-10.27,;-2.41,-9.49,;-1.01,-10.12,;.01,-8.98,;1.56,-8.98,;2.33,-7.64,;1.54,-6.3,;0,-6.31,;-.76,-7.64,;-2.26,-7.97,)|

BDBM50185225

CCN(CC)c1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2ccccc12

BDBM50185221

Cc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N[C@@H]3CN4CCC3CC4)c2c1 |wU:20.21,TLB:19:20:24.23:26.27,(17.38,-9.04,;18.71,-9.81,;18.71,-11.36,;20.04,-12.13,;21.38,-11.36,;22.72,-12.13,;24.06,-11.35,;25.39,-12.12,;24.05,-9.8,;25.38,-9.02,;26.79,-9.65,;27.81,-8.51,;29.35,-8.51,;30.13,-7.17,;29.34,-5.83,;27.8,-5.84,;27.04,-7.17,;25.54,-7.5,;22.7,-9.02,;22.7,-7.48,;21.75,-6.27,;21.47,-4.88,;20.12,-4.28,;18.65,-4.92,;18.85,-6.3,;20.38,-5.64,;20.64,-3.75,;20.19,-2.64,;21.37,-9.81,;20.04,-9.04,)|

BDBM50185222

O=c1[nH]c2ccccc2c(N[C@H]2CN3CCC2CC3)c1-c1nc2ccccc2[nH]1 |wD:11.11,TLB:10:11:15.14:17.18,(10.4,-12.01,;9.07,-11.25,;7.73,-12.02,;6.39,-11.26,;5.05,-12.02,;3.72,-11.25,;3.72,-9.71,;5.05,-8.94,;6.38,-9.7,;7.71,-8.92,;7.71,-7.38,;6.76,-6.17,;6.48,-4.78,;5.13,-4.17,;3.67,-4.81,;3.86,-6.19,;5.39,-5.54,;5.65,-3.64,;5.2,-2.54,;9.06,-9.69,;10.39,-8.92,;11.8,-9.55,;12.82,-8.41,;14.36,-8.41,;15.13,-7.07,;14.35,-5.73,;12.81,-5.74,;12.05,-7.07,;10.54,-7.4,)|

BDBM50195215

NCC1CCN(Cc2ccc3[nH]c(cc3c2)-c2n[nH]c3cc(ccc23)C#N)CC1

BDBM50195216

FC1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3cc(ccc3[nH]c2=O)-c2cn[nH]c2)CC1

BDBM50195218

O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCOCC3)ccc2[nH]1)-c1cn[nH]c1

BDBM50195213

O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)-c1cn[nH]c1

BDBM50195197

O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)-c1cnsc1

BDBM50195202

O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)-n1nccn1

BDBM50195211

NC(=O)c1ccc2[nH]c(=O)c(cc2c1)-c1cc2cc(CN3CCCCC3)ccc2[nH]1

BDBM50195201

CC(=O)N1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3cc(ccc3[nH]c2=O)-c2cn[nH]c2)CC1

BDBM50195204

COCC(=O)N1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3cc(ccc3[nH]c2=O)-c2cn[nH]c2)CC1

BDBM50195206

NCC1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3ccccc3[nH]c2=O)CC1

BDBM50195196

NCC1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3cc(ccc3[nH]c2=O)C#N)CC1

BDBM50195199

O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)-n1ccnc1

BDBM50195198

NCC1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3cc(ccc3[nH]c2=O)C(N)=O)CC1

BDBM50195214

O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)-c1cc[nH]n1

BDBM50195217

CC(=O)N1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3cc(ccc3[nH]c2=O)-c2cnn(C)c2)CC1

BDBM50195205

Cn1nnc(n1)-c1ccc2[nH]c(=O)c(cc2c1)-c1cc2cc(CN3CCCCC3)ccc2[nH]1

BDBM50195200

O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)-n1ccnn1

BDBM50195212

Brc1ccc2[nH]c(=O)c(cc2c1)-c1cc2cc(CN3CCCCC3)ccc2[nH]1

BDBM50195207

O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)C#N

BDBM50195209

Cn1cc(cn1)-c1ccc2[nH]c(=O)c(cc2c1)-c1cc2cc(CN3CCCCC3)ccc2[nH]1

BDBM5328

O=c1[nH]c2ccccc2cc1-c1cc2ccccc2[nH]1

BDBM50195208

Oc1cccc(c1)-c1ccc2[nH]c(=O)c(cc2c1)-c1cc2cc(CN3CCCCC3)ccc2[nH]1

BDBM50195219

NCC1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3c(cccc3[nH]c2=O)C#N)CC1

BDBM50195203

NCC1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3ccc(cc3[nH]c2=O)C#N)CC1

BDBM50195210

COc1cc(ccc1O)-c1ccc2[nH]c(=O)c(cc2c1)-c1cc2cc(CN3CCCCC3)ccc2[nH]1

BDBM50204729

C[C@H]1CC[C@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(F)cc2)c1 |wU:4.7,1.0,(-10,-1.04,;-8.66,-.28,;-8.65,1.26,;-7.32,2.02,;-5.99,1.24,;-5.99,-.29,;-7.33,-1.06,;-4.65,2.01,;-3.32,1.24,;-1.99,2.01,;-1.98,3.55,;-.66,4.32,;.68,3.56,;.68,2.01,;2.15,1.53,;3.07,2.78,;4.55,3.26,;4.55,4.81,;3.07,5.3,;2.15,4.04,;5.79,2.36,;5.62,.82,;6.86,-.08,;8.27,.54,;9.52,-.36,;8.43,2.08,;7.19,2.98,;-.65,1.24,)|

BDBM50204724

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccccc2)c1 |wU:4.7,wD:1.0,(-8.47,-11.13,;-7.14,-10.37,;-5.81,-11.14,;-4.47,-10.38,;-4.46,-8.84,;-5.8,-8.07,;-7.13,-8.83,;-3.13,-8.08,;-1.8,-8.85,;-.46,-8.08,;-.46,-6.53,;.87,-5.76,;2.2,-6.53,;2.2,-8.08,;3.67,-8.56,;4.59,-7.31,;6.07,-6.83,;6.07,-5.27,;4.59,-4.79,;3.67,-6.05,;7.31,-7.73,;7.14,-9.26,;8.39,-10.17,;9.79,-9.54,;9.95,-8,;8.71,-7.11,;.87,-8.85,)|

BDBM50204701

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(F)cc2)c1 |wU:4.7,wD:1.0,(13.88,-1.68,;15.21,-.92,;16.54,-1.69,;17.88,-.93,;17.89,.6,;16.55,1.38,;15.22,.62,;19.22,1.37,;20.55,.6,;21.89,1.37,;21.89,2.91,;23.22,3.68,;24.55,2.92,;24.55,1.37,;26.03,.89,;26.94,2.14,;28.42,2.62,;28.42,4.18,;26.94,4.66,;26.03,3.4,;29.66,1.72,;29.5,.19,;30.74,-.72,;32.15,-.1,;33.39,-1,;32.31,1.44,;31.06,2.34,;23.22,.6,)|

BDBM50204714

OCCNCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1

BDBM50204697

O[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(18.83,-48.79,;20.09,-47.9,;21.49,-48.55,;22.76,-47.66,;22.6,-46.13,;21.21,-45.48,;19.96,-46.37,;23.86,-45.24,;25.26,-45.88,;26.51,-44.99,;26.37,-43.45,;27.62,-42.56,;29.02,-43.19,;29.17,-44.74,;30.68,-45.07,;31.48,-43.74,;32.9,-43.12,;32.75,-41.58,;31.23,-41.24,;30.44,-42.57,;34.23,-43.9,;34.22,-45.44,;35.53,-46.23,;36.88,-45.47,;36.89,-43.92,;35.56,-43.15,;38.2,-46.25,;38.19,-47.78,;39.51,-48.56,;40.85,-47.8,;42.18,-48.58,;40.86,-46.25,;39.53,-45.49,;27.92,-45.63,)|

BDBM50204726

C[C@H]1CC[C@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(CC(O)=O)cc2)c1 |wU:4.7,1.0,(-8.65,-36.79,;-7.31,-36.02,;-7.29,-34.48,;-5.97,-33.72,;-4.64,-34.5,;-4.65,-36.03,;-5.98,-36.79,;-3.3,-33.73,;-1.98,-34.5,;-.64,-33.73,;-.63,-32.19,;.69,-31.42,;2.02,-32.18,;2.03,-33.73,;3.5,-34.21,;4.41,-32.97,;5.89,-32.48,;5.89,-30.93,;4.41,-30.45,;3.5,-31.7,;7.14,-33.38,;6.98,-34.92,;8.21,-35.82,;9.62,-35.2,;10.87,-36.09,;12.27,-35.46,;13.52,-36.36,;12.42,-33.93,;9.78,-33.66,;8.53,-32.76,;.7,-34.5,)|

BDBM50204717

C[C@H]1CC[C@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(CC#N)cc2)c1 |wU:4.7,1.0,(20.38,-23.67,;21.71,-22.91,;21.73,-21.37,;23.05,-20.61,;24.39,-21.39,;24.38,-22.92,;23.05,-23.67,;25.72,-20.62,;27.05,-21.39,;28.38,-20.62,;28.39,-19.07,;29.71,-18.31,;31.05,-19.07,;31.05,-20.62,;32.52,-21.1,;33.44,-19.85,;34.91,-19.37,;34.92,-17.82,;33.43,-17.34,;32.52,-18.59,;36.16,-20.27,;36,-21.8,;37.24,-22.71,;38.64,-22.08,;39.89,-22.98,;41.29,-22.35,;42.69,-21.72,;38.8,-20.55,;37.55,-19.65,;29.72,-21.39,)|

BDBM50204695

OC1CCN(Cc2ccc-3c(Cc4c(n[nH]c-34)-c3ccc(cc3)-c3ccc(O)cc3)c2)CC1

BDBM50204728

O[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c-2n[nH]c3-c2ccc(cc2)C(=O)NS(=O)(=O)c2ccccc2)c1 |wU:4.7,wD:1.0,(-8.65,-24.5,;-7.32,-23.73,;-5.99,-24.49,;-4.65,-23.74,;-4.64,-22.2,;-5.98,-21.43,;-7.3,-22.19,;-3.31,-21.44,;-1.98,-22.2,;-.65,-21.44,;-.64,-19.89,;.68,-19.12,;2.02,-19.88,;2.02,-21.44,;3.49,-21.92,;4.41,-20.67,;3.49,-19.41,;4.4,-18.16,;5.88,-18.64,;5.88,-20.19,;7.13,-21.09,;6.97,-22.62,;8.21,-23.52,;9.61,-22.9,;9.77,-21.37,;8.52,-20.47,;10.86,-23.8,;10.7,-25.33,;12.26,-23.17,;13.51,-24.07,;12.61,-25.31,;14.4,-22.83,;14.75,-24.98,;14.58,-26.5,;15.83,-27.4,;17.24,-26.77,;17.39,-25.23,;16.14,-24.34,;.69,-22.21,)|

BDBM50204710

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(CN)cc2)c1 |wU:4.7,wD:1.0,(18.45,-13.78,;19.79,-13.01,;21.12,-13.78,;22.46,-13.02,;22.47,-11.49,;21.12,-10.72,;19.79,-11.48,;23.79,-10.72,;25.13,-11.49,;26.45,-10.72,;26.46,-9.18,;27.79,-8.41,;29.12,-9.17,;29.12,-10.72,;30.59,-11.2,;31.51,-9.96,;32.99,-9.47,;32.99,-7.92,;31.51,-7.44,;30.59,-8.69,;34.23,-10.38,;34.07,-11.91,;35.31,-12.82,;36.71,-12.19,;37.96,-13.09,;39.36,-12.47,;36.87,-10.65,;35.63,-9.76,;27.79,-11.49,)|

BDBM50204716

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)S(N)(=O)=O)c1 |wU:4.7,wD:1.0,(-9.56,-2.9,;-8.22,-2.14,;-6.89,-2.91,;-5.55,-2.14,;-5.54,-.62,;-6.89,.16,;-8.21,-.6,;-4.22,.15,;-2.88,-.62,;-1.55,.15,;-1.55,1.7,;-.22,2.47,;1.11,1.71,;1.11,.15,;2.58,-.32,;3.5,.92,;4.98,1.4,;4.98,2.95,;3.5,3.44,;2.58,2.18,;6.22,.5,;6.06,-1.04,;7.3,-1.94,;8.7,-1.31,;8.86,.22,;7.62,1.12,;9.95,-2.22,;11.19,-3.12,;9.05,-3.47,;10.85,-.98,;-.22,-.62,)|

BDBM50204725

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(NC(C)=O)cc2)c1 |wU:4.7,wD:1.0,(-9.6,-13.62,;-8.27,-12.85,;-6.93,-13.62,;-5.6,-12.86,;-5.59,-11.33,;-6.94,-10.55,;-8.26,-11.31,;-4.26,-10.56,;-2.93,-11.33,;-1.6,-10.56,;-1.6,-9.02,;-.27,-8.25,;1.07,-9.01,;1.07,-10.56,;2.54,-11.04,;3.45,-9.79,;4.94,-9.31,;4.94,-7.76,;3.45,-7.28,;2.54,-8.53,;6.17,-10.21,;6.01,-11.75,;7.25,-12.65,;8.66,-12.03,;9.9,-12.93,;11.31,-12.3,;12.55,-13.21,;11.47,-10.77,;8.82,-10.49,;7.57,-9.6,;-.26,-11.33,)|

BDBM50204713

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c-2n[nH]c3-c2ccc(cc2)S(=O)(=O)NCCO)c1 |wU:4.7,wD:1.0,(16.56,-3.78,;17.89,-3.01,;19.22,-3.78,;20.56,-3.02,;20.57,-1.49,;19.22,-.72,;17.9,-1.48,;21.9,-.72,;23.23,-1.49,;24.56,-.72,;24.56,.82,;25.89,1.59,;27.23,.83,;27.23,-.73,;28.7,-1.2,;29.61,.04,;28.7,1.31,;29.61,2.56,;31.1,2.08,;31.09,.53,;32.33,-.38,;32.17,-1.91,;33.41,-2.82,;34.82,-2.19,;34.98,-.65,;33.73,.24,;36.06,-3.09,;35.16,-4.34,;36.97,-1.85,;37.3,-4,;38.71,-3.37,;39.95,-4.28,;41.36,-3.65,;25.89,-1.5,)|

BDBM50204702

CC(C)(C)CNC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C(O)=O)c1

BDBM50204694

O[C@H]1CC[C@@H](CC1)NC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(19.77,-1.9,;21.02,-1.01,;22.42,-1.66,;23.69,-.77,;23.53,.76,;22.14,1.41,;20.89,.52,;24.79,1.65,;26.19,1.01,;26.33,-.53,;27.44,1.9,;27.3,3.44,;28.55,4.33,;29.95,3.7,;30.1,2.15,;31.61,1.81,;32.4,3.14,;33.83,3.77,;33.68,5.31,;32.16,5.65,;31.37,4.31,;35.16,2.99,;35.15,1.44,;36.46,.66,;37.81,1.42,;37.82,2.96,;36.49,3.74,;39.13,.64,;39.12,-.9,;40.44,-1.67,;41.78,-.91,;43.11,-1.69,;41.78,.63,;40.46,1.4,;28.85,1.26,)|

BDBM50204719

O[C@H]1CC[C@@H](CC1)NC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C(O)=O)c1 |wU:4.7,wD:1.0,(16.94,-33.49,;18.28,-32.72,;19.61,-33.49,;20.95,-32.71,;20.93,-31.18,;19.6,-30.41,;18.28,-31.18,;22.26,-30.4,;23.59,-31.16,;23.6,-32.7,;24.92,-30.39,;24.92,-28.84,;26.24,-28.06,;27.58,-28.82,;27.59,-30.37,;29.07,-30.84,;29.97,-29.59,;31.45,-29.1,;31.44,-27.54,;29.96,-27.06,;29.05,-28.33,;32.7,-29.99,;32.54,-31.52,;33.79,-32.42,;35.2,-31.79,;35.34,-30.25,;34.09,-29.36,;36.45,-32.69,;37.85,-32.05,;36.3,-34.22,;26.26,-31.15,)|

BDBM50204699

NC(=O)c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(CN3CCC(O)CC3)ccc-21

BDBM50204700

NC(=O)c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(CN3CCOCC3)ccc-21

BDBM50204723

CC(C)(C)CNCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C(O)=O)c1

BDBM50204693

Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(ccc-21)C(=O)NCc1ccncc1

BDBM50204698

O[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C(O)=O)c1 |wU:4.7,wD:1.0,(15.95,-23.87,;17.28,-23.1,;18.62,-23.87,;19.95,-23.1,;19.93,-21.56,;18.61,-20.79,;17.28,-21.56,;21.26,-20.78,;22.6,-21.54,;23.93,-20.77,;23.92,-19.22,;25.24,-18.45,;26.58,-19.2,;26.59,-20.75,;28.07,-21.22,;28.98,-19.97,;30.46,-19.48,;30.45,-17.92,;28.96,-17.45,;28.06,-18.71,;31.7,-20.37,;31.55,-21.91,;32.8,-22.8,;34.2,-22.17,;34.35,-20.63,;33.1,-19.74,;35.45,-23.07,;36.85,-22.43,;35.3,-24.6,;25.27,-21.53,)|

BDBM50204696

OC(=O)c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(CN3CCOCC3)ccc-21

BDBM50204706

C[C@H]1CC[C@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C(O)=O)c1 |wU:4.7,1.0,(-9.25,-12.15,;-7.92,-11.38,;-7.91,-9.84,;-6.58,-9.08,;-5.24,-9.86,;-5.24,-11.39,;-6.59,-12.16,;-3.91,-9.09,;-2.57,-9.86,;-1.24,-9.09,;-1.24,-7.55,;.09,-6.78,;1.42,-7.54,;1.42,-9.09,;2.9,-9.57,;3.81,-8.32,;5.29,-7.84,;5.3,-6.29,;3.82,-5.8,;2.9,-7.06,;6.54,-8.74,;6.37,-10.28,;7.61,-11.18,;9.02,-10.56,;9.18,-9.02,;7.94,-8.12,;10.27,-11.46,;11.67,-10.84,;10.11,-12.99,;.09,-9.86,)|

BDBM50204703

OC1CCN(Cc2ccc-3c(Cc4c(n[nH]c-34)-c3ccc(cc3)C(O)=O)c2)CC1

BDBM50204712

COC(=O)c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(CN[C@H]3CC[C@H](C)CC3)ccc-21 |wU:21.22,wD:24.26,(39.09,-50.32,;37.84,-49.42,;36.43,-50.05,;36.27,-51.58,;35.19,-49.14,;33.78,-49.77,;32.54,-48.86,;32.7,-47.33,;34.1,-46.7,;35.35,-47.6,;31.46,-46.43,;31.46,-44.87,;29.98,-44.39,;29.07,-45.64,;29.98,-46.91,;29.07,-48.15,;27.59,-47.67,;26.26,-48.44,;24.93,-47.67,;23.59,-48.44,;22.26,-47.67,;20.93,-48.44,;20.92,-49.98,;19.58,-50.74,;18.25,-49.97,;16.91,-50.73,;18.26,-48.43,;19.59,-47.66,;24.93,-46.13,;26.26,-45.36,;27.59,-46.12,)|

BDBM50204705

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)N(C)C)c1 |wU:4.7,wD:1.0,(-8.72,-50.59,;-7.38,-49.83,;-6.05,-50.6,;-4.71,-49.84,;-4.7,-48.3,;-6.04,-47.53,;-7.37,-48.29,;-3.37,-47.54,;-2.04,-48.31,;-.7,-47.54,;-.7,-45.99,;.63,-45.22,;1.96,-45.99,;1.96,-47.54,;3.44,-48.02,;4.35,-46.77,;5.83,-46.29,;5.83,-44.73,;4.35,-44.25,;3.43,-45.51,;7.07,-47.19,;6.91,-48.72,;8.15,-49.63,;9.56,-49,;9.72,-47.47,;8.47,-46.57,;10.8,-49.91,;10.64,-51.44,;12.21,-49.28,;.63,-48.31,)|

BDBM50204721

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C(O)=O)c1 |wU:4.7,wD:1.0,(16.02,-1.77,;17.35,-1,;18.68,-1.78,;20.03,-1.01,;20.03,.52,;18.69,1.3,;17.36,.53,;21.36,1.29,;22.7,.52,;24.03,1.29,;24.03,2.83,;25.36,3.6,;26.69,2.84,;26.69,1.29,;28.17,.81,;29.08,2.05,;30.56,2.53,;30.57,4.09,;29.08,4.57,;28.17,3.32,;31.8,1.63,;31.64,.1,;32.88,-.81,;34.29,-.18,;34.45,1.36,;33.2,2.26,;35.54,-1.08,;36.94,-.46,;35.38,-2.62,;25.36,.52,)|

BDBM50204711

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(-9.65,-1.94,;-8.31,-1.18,;-6.98,-1.95,;-5.64,-1.18,;-5.64,.35,;-6.97,1.13,;-8.3,.36,;-4.3,1.12,;-2.97,.35,;-1.64,1.11,;-1.63,2.66,;-.31,3.43,;1.03,2.66,;1.03,1.11,;2.5,.64,;3.42,1.88,;4.9,2.36,;4.9,3.92,;3.42,4.4,;2.5,3.14,;6.14,1.46,;5.97,-.07,;7.21,-.98,;8.62,-.35,;9.87,-1.26,;8.78,1.19,;7.54,2.09,;-.3,.34,)|

BDBM50204722

CN(C)CCNC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1

BDBM50204707

OC1CCN(CC1)C(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1

BDBM50204708

CCOc1ccc(cc1)-c1n[nH]c-2c1Cc1cc(CN[C@H]3CC[C@H](C)CC3)ccc-21 |wU:20.21,wD:23.25,(13.23,-40.56,;11.98,-39.65,;10.58,-40.28,;9.33,-39.37,;7.92,-40,;6.68,-39.09,;6.85,-37.56,;8.25,-36.94,;9.49,-37.83,;5.61,-36.66,;5.61,-35.1,;4.13,-34.62,;3.21,-35.88,;4.12,-37.14,;3.21,-38.39,;1.74,-37.91,;.4,-38.68,;-.93,-37.91,;-2.26,-38.67,;-3.6,-37.9,;-4.93,-38.67,;-4.93,-40.21,;-6.27,-40.97,;-7.61,-40.2,;-8.94,-40.96,;-7.6,-38.66,;-6.27,-37.9,;-.93,-36.36,;.4,-35.59,;1.74,-36.36,)|

BDBM50204718

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(C)cc2)c1 |wU:4.7,wD:1.0,(17.31,-30.76,;18.65,-30,;19.98,-30.77,;21.32,-30.01,;21.33,-28.47,;19.99,-27.7,;18.66,-28.46,;22.66,-27.71,;23.99,-28.48,;25.33,-27.71,;25.33,-26.16,;26.66,-25.39,;27.99,-26.16,;27.99,-27.71,;29.47,-28.19,;30.38,-26.94,;31.86,-26.46,;31.86,-24.9,;30.38,-24.42,;29.47,-25.68,;33.1,-27.36,;32.94,-28.89,;34.18,-29.8,;35.59,-29.17,;36.84,-30.08,;35.75,-27.64,;34.5,-26.74,;26.66,-28.48,)|

BDBM50204715

Cc1cnc(CNCc2ccc-3c(Cc4c(n[nH]c-34)-c3ccc(cc3)-c3ccc(O)cc3)c2)cn1

BDBM50204720

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(OC(F)(F)F)cc2)c1 |wU:4.7,wD:1.0,(18.66,-40.79,;20,-40.03,;21.33,-40.8,;22.67,-40.04,;22.67,-38.5,;21.33,-37.72,;20.01,-38.49,;24.01,-37.73,;25.34,-38.5,;26.67,-37.74,;26.68,-36.19,;28,-35.42,;29.34,-36.19,;29.34,-37.74,;30.81,-38.21,;31.73,-36.97,;33.21,-36.49,;33.21,-34.93,;31.73,-34.45,;30.81,-35.71,;34.45,-37.39,;34.28,-38.92,;35.53,-39.83,;36.93,-39.2,;38.18,-40.11,;39.59,-39.48,;40.34,-40.81,;38.8,-38.14,;41,-38.87,;37.09,-37.66,;35.85,-36.76,;28.01,-38.51,)|

BDBM50204709

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(N)cc2)c1 |wU:4.7,wD:1.0,(-9.34,-20.62,;-8.01,-19.86,;-6.68,-20.63,;-5.34,-19.87,;-5.33,-18.33,;-6.67,-17.56,;-8,-18.32,;-4,-17.57,;-2.67,-18.34,;-1.33,-17.57,;-1.33,-16.02,;-0,-15.25,;1.33,-16.02,;1.33,-17.57,;2.81,-18.05,;3.72,-16.8,;5.2,-16.32,;5.2,-14.76,;3.72,-14.28,;2.8,-15.54,;6.44,-17.22,;6.28,-18.75,;7.52,-19.66,;8.93,-19.03,;10.17,-19.94,;9.08,-17.5,;7.84,-16.6,;-0,-18.34,)|

BDBM50204692

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(Cl)cc2)c1 |wU:4.7,wD:1.0,(14.86,-11.88,;16.2,-11.11,;17.53,-11.89,;18.87,-11.12,;18.88,-9.59,;17.54,-8.81,;16.21,-9.58,;20.21,-8.82,;21.54,-9.59,;22.87,-8.82,;22.88,-7.28,;24.2,-6.51,;25.54,-7.27,;25.54,-8.82,;27.01,-9.3,;27.93,-8.06,;29.41,-7.58,;29.41,-6.02,;27.93,-5.54,;27.01,-6.8,;30.65,-8.48,;30.48,-10.01,;31.73,-10.92,;33.13,-10.29,;34.38,-11.2,;33.29,-8.75,;32.05,-7.85,;24.21,-9.6,)|

BDBM50204727

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(CO)cc2)c1 |wU:4.7,wD:1.0,(-8.3,-29.74,;-6.96,-28.97,;-5.63,-29.75,;-4.29,-28.98,;-4.28,-27.45,;-5.62,-26.67,;-6.95,-27.43,;-2.95,-26.68,;-1.62,-27.45,;-.28,-26.68,;-.28,-25.14,;1.05,-24.37,;2.38,-25.13,;2.38,-26.68,;3.86,-27.16,;4.77,-25.91,;6.25,-25.43,;6.25,-23.88,;4.77,-23.39,;3.85,-24.65,;7.49,-26.34,;7.33,-27.87,;8.57,-28.77,;9.98,-28.15,;11.22,-29.05,;12.63,-28.43,;10.14,-26.61,;8.89,-25.71,;1.05,-27.45,)|

BDBM50204704

C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(CC(C)=O)cc2)c1 |wU:4.7,wD:1.0,(-.88,-5.98,;.45,-5.22,;1.78,-5.99,;3.12,-5.23,;3.12,-3.7,;1.79,-2.92,;.46,-3.68,;4.46,-2.93,;5.79,-3.7,;7.13,-2.94,;7.13,-1.39,;8.45,-.62,;9.79,-1.39,;9.79,-2.94,;11.26,-3.41,;12.17,-2.16,;13.65,-1.68,;13.65,-.13,;12.18,.33,;11.26,-.9,;14.99,-2.42,;15.02,-3.96,;16.36,-4.7,;17.68,-3.91,;19.03,-4.65,;20.35,-3.86,;21.69,-4.6,;20.32,-2.32,;17.65,-2.37,;16.31,-1.63,;8.45,-3.71,)|

BDBM50212503

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1C(=O)NCCN1CCCC1

BDBM50212514

O[C@H]1CC[C@@H](CC1)NCC(=O)Nc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(-6.95,-26.22,;-6.96,-27.76,;-8.3,-28.52,;-8.3,-30.07,;-6.97,-30.84,;-5.63,-30.07,;-5.63,-28.54,;-6.97,-32.38,;-5.64,-33.15,;-4.3,-32.38,;-4.3,-30.84,;-2.97,-33.15,;-1.64,-32.38,;-1.64,-30.84,;-.31,-30.07,;1.03,-30.83,;1.03,-32.38,;2.5,-32.86,;3.42,-31.61,;4.9,-31.13,;4.9,-29.57,;3.42,-29.09,;2.5,-30.35,;6.14,-32.04,;5.98,-33.57,;7.22,-34.47,;8.63,-33.85,;8.79,-32.31,;7.54,-31.41,;9.87,-34.75,;9.71,-36.28,;10.95,-37.19,;12.36,-36.56,;13.61,-37.46,;12.52,-35.02,;11.27,-34.12,;-.3,-33.15,)|

BDBM50212520

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1C(=O)N1CCN(C)CC1

BDBM50212497

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1C(=O)N1CCC(O)CC1

BDBM50212490

COc1cc-2c(cc1C(=O)N[C@H]1CC[C@H](O)CC1)C(C)(C)c1c(n[nH]c-21)-c1ccc(cc1)-c1ccc(O)cc1 |wU:11.11,wD:14.15,(-3.5,5.22,;-3.5,3.68,;-2.16,2.91,;-.84,3.68,;.5,2.91,;.5,1.36,;-.83,.59,;-2.17,1.36,;-3.5,.6,;-3.5,-.94,;-4.83,1.37,;-6.17,.6,;-6.17,-.94,;-7.51,-1.7,;-8.84,-.93,;-10.18,-1.69,;-8.84,.61,;-7.51,1.37,;1.97,.89,;3.45,.49,;1.11,-.39,;2.88,2.14,;4.36,2.62,;4.36,4.17,;2.89,4.65,;1.97,3.39,;5.6,1.72,;5.43,.19,;6.67,-.72,;8.08,-.1,;8.24,1.44,;7,2.34,;9.33,-1,;9.16,-2.53,;10.41,-3.43,;11.82,-2.81,;13.06,-3.71,;11.97,-1.27,;10.73,-.37,)|

BDBM50212506

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)c(F)c2)cc1C(=O)NCc1ccccn1

BDBM50212521

Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1c-2cccc1C(=O)NCc1ccccc1

BDBM50212507

CN1CCN(Cc2ccc-3c(Cc4c(n[nH]c-34)-c3ccc(cc3)-c3ccc(O)cc3)c2)CC1

BDBM50212493

O[C@H]1CC[C@@H](CC1)NC(=O)c1cccc-2c1Cc1c(n[nH]c-21)-c1ccc(cc1)-c1ccc(O)cc1 |wU:1.0,wD:4.7,(-10.18,-11.07,;-8.85,-11.84,;-7.51,-11.08,;-6.19,-11.85,;-6.18,-13.38,;-7.52,-14.16,;-8.85,-13.38,;-4.85,-14.15,;-3.52,-13.38,;-2.18,-14.15,;-3.52,-11.84,;-4.85,-11.07,;-4.85,-9.53,;-3.52,-8.76,;-2.18,-9.52,;-2.18,-11.07,;-.71,-11.55,;.21,-10.3,;1.69,-9.82,;1.69,-8.26,;.21,-7.78,;-.71,-9.04,;2.93,-10.73,;2.76,-12.26,;4.01,-13.16,;5.42,-12.54,;5.58,-11,;4.33,-10.1,;6.66,-13.44,;6.5,-14.97,;7.74,-15.88,;9.15,-15.25,;10.4,-16.15,;9.31,-13.71,;8.06,-12.81,)|

BDBM50212513

CC(C)(C)CNCc1cccc-2c1Cc1c-2[nH]nc1-c1ccc(cc1)-c1ccc(O)cc1

BDBM50212502

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1CNCCO

BDBM50212495

OCc1cccc-2c1Cc1c-2[nH]nc1-c1ccc(cc1)-c1ccc(O)cc1

BDBM50212487

CC(=O)Nc1cccc-2c1Cc1c(n[nH]c-21)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50212516

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1C(=O)N1CCOCC1

BDBM50212491

OCCNCC(=O)Nc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1

BDBM50212494

Oc1ccc(cc1)-c1ccc(cc1)-c1[nH]nc-2c1Cc1ccccc-21

BDBM50212501

CCCCNCC(=O)Nc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1

BDBM50212496

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1C(=O)N[C@H]1CC[C@H](O)CC1 |wU:30.34,wD:33.38,(18.38,-1.88,;18.38,-3.42,;19.72,-4.19,;21.04,-3.42,;22.38,-4.18,;22.38,-5.73,;23.86,-6.21,;24.77,-4.97,;26.25,-4.49,;26.25,-2.93,;24.77,-2.45,;23.85,-3.7,;27.5,-5.39,;27.33,-6.92,;28.57,-7.83,;29.98,-7.2,;30.14,-5.66,;28.89,-4.76,;31.22,-8.1,;31.06,-9.64,;32.31,-10.54,;33.71,-9.91,;34.96,-10.82,;33.87,-8.37,;32.62,-7.48,;21.05,-6.51,;19.71,-5.73,;18.38,-6.5,;18.38,-8.04,;17.05,-5.73,;15.71,-6.5,;15.72,-8.03,;14.38,-8.8,;13.05,-8.02,;11.71,-8.79,;13.06,-6.48,;14.39,-5.72,)|

BDBM50212504

COc1cc-2c(Cc3c-2[nH]nc3-c2ccc(cc2)-c2ccc(O)c(c2)C#N)cc1C(=O)NCc1ccccn1

BDBM50212509

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)c(F)c2)cc1CN1CCN(C)CC1

BDBM50212508

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)c(c2)C#N)cc1CN1CCN(C)CC1

BDBM50212486

OCCNCc1ccc2Cc3c(n[nH]c3-c2c1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50212484

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1CN[C@H]1CC[C@H](O)CC1 |wU:29.33,wD:32.37,(19.25,-18.66,;19.25,-20.2,;20.59,-20.97,;21.91,-20.2,;23.25,-20.96,;23.25,-22.51,;24.72,-22.99,;25.64,-21.74,;27.12,-21.26,;27.12,-19.71,;25.64,-19.22,;24.72,-20.48,;28.36,-22.17,;28.19,-23.7,;29.44,-24.6,;30.85,-23.98,;31.01,-22.44,;29.76,-21.54,;32.09,-24.88,;31.93,-26.41,;33.17,-27.32,;34.58,-26.69,;35.83,-27.59,;34.74,-25.15,;33.49,-24.25,;21.92,-23.28,;20.58,-22.51,;19.25,-23.28,;17.92,-22.51,;16.58,-23.28,;16.59,-24.81,;15.25,-25.58,;13.92,-24.8,;12.58,-25.56,;13.93,-23.26,;15.26,-22.5,)|

BDBM50212518

CC(C)(C)NCc1ccc2Cc3c([nH]nc3-c3ccc(cc3)-c3ccc(O)cc3)-c2c1

BDBM50212488

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1CNCCN1CCCC1

BDBM50212505

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1CN1CCN(C)CC1

BDBM50212517

Oc1ccc(cc1)-c1ccc(cc1)-c1[nH]nc-2c1Cc1cccc(O)c-21

BDBM50212515

Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(NC(=O)CNCc3ccncc3)ccc-21

BDBM50212510

Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1ccc(cc-21)C(=O)N1CCOCC1

BDBM50212489

OCc1ccc-2c(Cc3c-2[nH]nc3-c2ccc(cc2)-c2ccc(O)cc2)c1

BDBM50212519

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1CN1CCC(O)CC1

BDBM50212485

CNC(=O)c1ccc2Cc3c(n[nH]c3-c2c1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50212498

OCCNC(=O)c1ccc2Cc3c(n[nH]c3-c2c1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50212500

Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1ccc(CNCCN3CCCC3)cc-21

BDBM50212512

Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(ccc-21)C(=O)NCc1ccccn1

BDBM50212492

CN(C)CCNCc1ccc2Cc3c(n[nH]c3-c2c1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214581

COc1cc2Cc3c(n[nH]c3-c2cc1OCc1cccnc1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214592

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCCN1CCN(CC1)c1cccc(Cl)c1

BDBM50214597

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCCN1CCOCC1

BDBM50214587

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCc1ccccn1

BDBM50214593

COc1cc2Cc3c(n[nH]c3-c2cc1OC(=O)NCCN(C)C)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214579

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCc1cccnc1

BDBM50214588

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCc1ccncc1

BDBM50214583

COc1cc2Cc3c(n[nH]c3-c2cc1OCc1ccncc1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214589

CCN(CC)CC(CN(CC)CC)Oc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC

BDBM50214557

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCN(C)C

BDBM50214584

COc1cc2Cc3c(n[nH]c3-c2cc1OCc1ccccn1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214596

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCCN1CCN(CC1)c1ccccc1OC

BDBM50214566

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCCN1CCCCC1

BDBM50214600

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCN1CCOCC1

BDBM50214560

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCN1CCCC1

BDBM50214568

COc1cc2Cc3c(n[nH]c3-c2cc1OCCn1ccnc1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214576

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCCN(C)C

BDBM50214591

COc1cc2Cc3c(n[nH]c3-c2cc1OCCCN1CCN(CC1)c1cccc(Cl)c1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214603

COc1cc2Cc3c(n[nH]c3-c2cc1OCCC1CCCN1C)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214598

COc1cc2Cc3c(n[nH]c3-c2cc1OCCN1CCCC1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214586

COc1cc2Cc3c(n[nH]c3-c2cc1OCC(C)CN(C)C)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214595

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC[C@@H]1CCC=CC1 |c:37|

BDBM50214602

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC1CCOCC1

BDBM50214574

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC[C@@H](O)CO

BDBM50214563

COc1cc2Cc3c(n[nH]c3-c2cc1OCCN1CCOCC1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214585

CCN1CCCC(C1)Oc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC

BDBM50214582

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCN1CCCCC1

BDBM50214594

COc1cc2Cc3c(n[nH]c3-c2cc1OCCCN1CCN(C)CC1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214605

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCC[C@@H]1CCCN1

BDBM50214570

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC(C)CN(C)C

BDBM50214569

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCn1ccnc1

BDBM50214601

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCc1cccnc1

BDBM50214558

COc1cc2Cc3c([nH]nc3-c3ccc(cc3)-c3ccc(O)cc3)-c2cc1OC(=O)NCCN1CCOCC1

BDBM50214573

COc1cc2Cc3c(n[nH]c3-c2cc1OC(=O)NCCN1CCCC1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214564

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCc1ccccn1

BDBM50214578

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCCc1ccncc1

BDBM50214575

COc1cc2Cc3c(n[nH]c3-c2cc1OC(C)CN(C)C)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214590

COc1cc2Cc3c(n[nH]c3-c2cc1OCCN(C)C)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214571

COc1cc2Cc3c([nH]nc3-c3ccc(cc3)-c3ccc(O)cc3)-c2cc1OC(F)(F)F

BDBM50214599

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1O

BDBM50024779

COc1cc-2c(Cc3c-2n[nH]c3-c2ccc(cc2)-c2ccc(O)cc2)cc1OC(CO)CO

BDBM50214580

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC1CCOC1

BDBM50214565

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OCC1CCOC1

BDBM50214604

COc1cc2Cc3c(n[nH]c3-c2cc1OC(=O)NCc1ccccn1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50214561

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC[C@H](O)CO

BDBM50214572

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1CCOCCCc1cccc(C)n1

BDBM50216162

O=C1NC(=O)c2c1c1c3cccnc3[nH]c1c1cccn21

BDBM50216163

Clc1ccc2[nH]c3c4cccn4c4C(=O)NC(=O)c4c3c2c1

BDBM50216165

O=C1NC(=O)c2c1c1[nH]cnc1c1[nH]c3ccccc3c21

BDBM50216159

Oc1ccc2[nH]c3c4cccn4c4C(=O)NC(=O)c4c3c2c1

BDBM50216161

Brc1ccc2[nH]c3c4cccn4c4C(=O)NC(=O)c4c3c2c1

BDBM50216171

O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1cccn21

BDBM50216158

O=C1NC(=O)c2c1c1c3cc(OCc4ccccc4)ccc3[nH]c1c1cccn21

BDBM50218718

COC(=O)Cc1ccc2Oc3cc(ccc3C(=O)Nc2c1)-c1ccc(N)c(OC)c1

BDBM50218702

COc1cc(ccc1N)-c1ccc2c(c1)N(C)c1ccccc1NC2=O

BDBM50218720

COc1cc(ccc1N)-c1ccc2c(Nc3cc(CC(=O)N(C)C)ccc3NC2=O)c1

BDBM50218727

COc1cc(ccc1N)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218703

COc1cc(ccc1N)-c1ccc2c(Nc3cc(ccc3NC2=O)C(C)(C)C(=O)Nc2ccc(cc2)N2CCOCC2)c1

BDBM50218722

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218712

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(CCC(=O)Nc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1

BDBM50218707

CC(=O)c1ccc(cc1)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218738

COc1cc(ccc1O)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218725

CC(=O)c1ccccc1-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218736

CC(=O)c1cccc(c1)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218731

O=C1Nc2ccccc2Nc2cc(ccc12)-c1cccc(c1)C#N

BDBM50218708

O=C1Nc2ccccc2Nc2cc(ccc12)-c1ccc(cc1)C#N

BDBM50218737

CCOc1cccc(c1)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218733

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(CCC(=O)N(C)C)cc3NC2=O)c1

BDBM50218700

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(CC(=O)Nc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1

BDBM50218709

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(cc3NC2=O)C(C)(C)C(=O)Nc2ccc(cc2)N2CCOCC2)c1

BDBM50218715

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(CC(=O)N(C)C)cc3NC2=O)c1

BDBM50218704

COc1cc(ccc1N)-c1ccc2c(Nc3cc(ccc3NC2=O)N2CCOCC2)c1

BDBM50218706

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1ccc(N)c(OC)c1

BDBM50218716

COc1ccccc1-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218723

COc1cc(ccc1N)-c1ccc2c(Nc3cc(N)ccc3NC2=O)c1

BDBM50218735

COc1cccc(c1)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218714

O=C1Nc2ccccc2Nc2cc(ccc12)-c1ccccc1

BDBM50218726

OC1c2ccccc2NC(=O)c2ccccc12 |w:1.0|

BDBM50218730

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(cc3NC2=O)N2CCCC2=O)c1

BDBM50218701

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(cc3NC2=O)N2CCCS2(=O)=O)c1

BDBM50218728

COc1cc(ccc1N)-c1ccc2c(Nc3c(NC2=O)cccc3OCc2ccncc2)c1

BDBM50218741

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(N)cc3NC2=O)c1

BDBM50218710

COc1cc(ccc1N)-c1ccc2c(Nc3c(NC2=O)cccc3OC)c1

BDBM50218739

O=C1Nc2ccccc2S(=O)(=O)c2ccccc12

BDBM50218705

O=c1[nH]c2ccccc2c(=O)c2ccccc12

BDBM50218719

COc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1ccc(N)c(OC)c1

BDBM50218711

COc1cc(ccc1N)-c1ccc2c(Nc3ccc(O)cc3NC2=O)c1

BDBM50218713

COc1cc(ccc1N)-c1ccc2c(Nc3cccc(O)c3NC2=O)c1

BDBM50218740

COc1cc(ccc1C(N)=O)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218729

COc1cc(ccc1O)-c1ccc2Nc3ccccc3NC(=O)c2c1

BDBM50218717

COc1cc(ccc1C(C)=O)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218724

COC(=O)c1ccc(cc1OC)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218721

COc1cc(ccc1Cl)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50218732

COc1cc(ccc1C#N)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50220067

O=c1[nH]c(=O)c2c1c1[nH]c3ccccc3c1c1c2c(=O)[nH]c1=O

BDBM50220066

O=C1CCc2c1c1C(=O)NC(=O)c1c1c2[nH]c2ccccc12

BDBM50220075

Cc1ccc2nc3c(c2c1)c1c(c2c3c(O)ccc2=O)c(=O)[nH]c1=O

BDBM50220072

Oc1ccc2nc3c(c2c1)c1c(c2c3c(O)ccc2=O)c(=O)[nH]c1=O

BDBM50220074

Oc1ccc(=O)c2c3c(c4c5ccccc5nc4c12)c(=O)[nH]c3=O

BDBM50220063

Cc1ccc2[nH]c3c(c4C(=O)NC(=O)c4c4c(O)ccc(OS(O)(=O)=O)c34)c2c1

BDBM50220073

Oc1cccc2c3[nH]c4ccccc4c3c3C(=O)NC(=O)c3c12

BDBM50220070

CC(C)(C)C(=O)Oc1ccc(O)c2c3C(=O)NC(=O)c3c3c4ccccc4[nH]c3c12

BDBM50220069

Oc1ccc(OS(O)(=O)=O)c2c3[nH]c4ccccc4c3c3C(=O)NC(=O)c3c12

BDBM50220065

Cc1ccc2[nH]c3c(c4C(=O)NC(=O)c4c4c(O)ccc(O)c34)c2c1

BDBM50220064

Oc1ccc2[nH]c3c(c4C(=O)NC(=O)c4c4c(O)ccc(O)c34)c2c1

BDBM50220068

Oc1ccc(O)c2c3[nH]c4ccccc4c3c3C(=O)NC(=O)c3c12

BDBM50220768

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCCn3ccnc3)cc-21

BDBM50220759

Cc1ncsc1CCOc1ccc2Cc3c(n[nH]c3-c2c1)-c1ccc(nc1)C#N

BDBM50220754

CN1CCN(CCCOc2ccc3Cc4c(n[nH]c4-c3c2)-c2ccc(nc2)C#N)CC1

BDBM50220763

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCCc3cccs3)cc-21

BDBM50220756

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCOCCN3CCOCC3)cc-21

BDBM50220777

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCN3CCOCC3)cc-21

BDBM50220752

CC(=O)N1CCN(CCCCOc2ccc3Cc4c(n[nH]c4-c3c2)-c2ccc(nc2)C#N)CC1

BDBM50220751

C[C@H]1CN(CCCOc2ccc3Cc4c(n[nH]c4-c3c2)-c2ccc(nc2)C#N)C[C@@H](C)O1

BDBM50220762

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCCN3CCCOCC3)cc-21

BDBM50220771

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCCN3CCCCC3)cc-21

BDBM50220776

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(nc2)C#N)cc1OCc1ccccn1

BDBM50220775

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(nc2)C#N)cc1OCCN1CCOCC1

BDBM50220764

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(nc2)C#N)cc1OCCO

BDBM50220761

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(nc2)C#N)cc1OCCc1scnc1C

BDBM50220755

COc1cc2Cc3c(n[nH]c3-c2cc1OCCc1scnc1C)-c1ccc(nc1)C#N

BDBM50220772

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCCN3CCOCC3)cc-21

BDBM50220770

COc1cc2Cc3c(n[nH]c3-c2cc1OCCN1CCOCC1)-c1ccc(nc1)C#N

BDBM50220757

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCCC3CCNCC3)cc-21

BDBM50220765

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCCCCN3CCOCC3)cc-21

BDBM50220778

COc1cc2Cc3c(n[nH]c3-c2cc1OCCO)-c1ccc(nc1)C#N

BDBM50220766

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(OCCCCN3CCOCC3)cc-21

BDBM50220758

O=C(CCN1CCOCC1)Nc1ccc2Cc3c(n[nH]c3-c2c1)-c1ccc(nc1)C#N

BDBM50220767

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(NCCN3CCOCC3)cc-21

BDBM50220760

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1cc(OCCN3CCOCC3)ccc-21

BDBM50220774

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1ccc(CCCCN3CCOCC3)cc-21

BDBM50220769

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1cc(OCCCN3CCOCC3)ccc-21

BDBM50220887

Cc1[nH]nc2c1c(=O)n(CCN)c1ccc(Cl)cc21

BDBM50220901

Cc1[nH]nc2c1c(=O)[nH]c1cc3CCCCc3cc21

BDBM50220896

Cc1[nH]nc2c1c(=O)[nH]c1cc3ccccc3cc21

BDBM50220908

Cc1[nH]nc2c1c(=O)[nH]c1c(CCCN)c(C3CCCCC3)c(cc21)C1CCCCC1

BDBM50220884

Cc1[nH]nc2c1c(=O)n(C[C@@H](F)CN)c1cc(C3CCCCC3)c(cc21)C1CCCCC1

BDBM50220899

Cc1[nH]nc2c1c(NCCCN)nc1ccc(Cl)cc21

BDBM50220906

Cc1[nH]nc2c1c(=O)[nH]c1cccc(Cl)c21

BDBM50220898

Cc1[nH]nc2c1c(=O)n(C[C@H](F)CN)c1cc(C3CCCCC3)c(cc21)C1CCCCC1

BDBM50220905

Cc1[nH]nc2c1c(=O)[nH]c1c(C=CCN)c(C3CCCCC3)c(cc21)C1CCCCC1 |w:11.11|

BDBM50220894

Cc1[nH]nc2c1c(NCCN)nc1ccc(Cl)cc21

BDBM50220904

Cc1[nH]nc2c1c(=O)[nH]c1c(C)cccc21

BDBM50220891

Cc1[nH]nc2c1c(=O)[nH]c1ccccc21

BDBM50220888

Cc1[nH]nc2c1c(=O)n(CC(F)(F)CN)c1cc(C3CCCCC3)c(cc21)C1CCCCC1

BDBM50220907

Cc1[nH]nc2c1c(OCCN)nc1ccc(Cl)cc21

BDBM50220902

CC(=O)Nc1ccc2[nH]c(=O)c3c(C)[nH]nc3c2c1

BDBM50220900

Cc1[nH]nc2c1c(OCCCN)nc1ccc(Cl)cc21

BDBM50220890

CCn1c2cc3CN(CCc3cc2c2n[nH]c(C)c2c1=O)S(=O)(=O)CCN

BDBM50220889

Cc1[nH]nc2c1c(=O)[nH]c1ccc(Cl)cc21

BDBM50220885

Cc1[nH]nc2c1c(=O)[nH]c1cc(Cl)ccc21

BDBM50220903

Cc1[nH]nc2c1c(=O)[nH]c1ccc(C)cc21

BDBM50220886

Cc1[nH]nc2c1c(=O)n(CCCN)c1cc(C3CCCCC3)c(cc21)C1CCCCC1

BDBM50220895

CCn1c2cc3CN(CCc3cc2c2n[nH]c(C)c2c1=O)C(=O)NCCN

BDBM50220909

Cc1[nH]nc2c1c(=O)[nH]c1cccc(C)c21

BDBM50220892

CCn1c2cc3CN(CCc3cc2c2n[nH]c(C)c2c1=O)C(=O)CN

BDBM50220893

Cc1[nH]nc2c1c(=O)n(CCCCN)c1ccc(Cl)cc21

BDBM92404

Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(Cl)cc21

BDBM50223486

NCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1

BDBM50223479

NCCCc1cc2cc[nH]c(=O)c2c2cc(Cl)ccc12

BDBM50223466

NCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)-c1ccn[nH]1

BDBM50223461

NCCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1

BDBM50223449

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1cccc(F)c1

BDBM50223482

Brc1ccc2c(cc3cc[nH]c(=O)c3c2c1)C#N

BDBM50223490

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1ccccc1F

BDBM50223459

Fc1ccc2c3[nH]cnc3c3cc[nH]c(=O)c3c2c1

BDBM50223488

NCCc1cc2cc[nH]c(=O)c2c2cc(Br)ccc12

BDBM50223469

NCCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)-c1ccc(CN)cc1

BDBM50223464

NCCc1cc2cc[nH]c(=O)c2c2cc(Cl)ccc12

BDBM50223481

Cn1cc(cn1)-c1ccc2c(CCCN)cc3cc[nH]c(=O)c3c2c1

BDBM50223484

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1cccc(O)c1

BDBM50223475

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1ccc(Cl)cc1Cl

BDBM50223460

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1ccc(O)cc1

BDBM50223450

OCc1cc2cc[nH]c(=O)c2c2cc(Br)ccc12

BDBM50223480

NCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)-c1ccc(CN2CCOCC2)cc1

BDBM50223491

Clc1ccc2c(cc3cc[nH]c(=O)c3c2c1)C#N

BDBM50223489

NCCCc1cc2cc[nH]c(=O)c2c2cc(Br)ccc12

BDBM50223463

NCCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)-c1ccn[nH]1

BDBM50223473

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1ccc(Cl)cc1

BDBM50223457

NCCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)-c1ccc[nH]1

BDBM50223471

Clc1ccc2ccc3cc[nH]c(=O)c3c2c1

BDBM50223478

NCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)-c1ccc[nH]1

BDBM50223477

CNCCc1cc2cc[nH]c(=O)c2c2cc(Br)ccc12

BDBM50223476

OCCc1cc2cc[nH]c(=O)c2c2cc(Br)ccc12

BDBM50223470

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1ccccc1

BDBM50223474

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1cccc(Cl)c1

BDBM50223452

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1ccccc1O

BDBM50223448

Fc1ccc2c3[nH]c(nc3c3cc[nH]c(=O)c3c2c1)-c1cccnc1

BDBM50223462

NCCCc1cc2c(Br)c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1

BDBM50223454

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1ccccc1Cl

BDBM50223465

Brc1ccc2c(CCC#N)cc3cc[nH]c(=O)c3c2c1

BDBM50223458

NCCCc1cc2c(C=C)c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1

BDBM50223472

NCCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)C#N

BDBM50223487

Fc1ccc2c3[nH]c(nc3c3cc[nH]c(=O)c3c2c1)-c1ccccc1

BDBM50223483

NCCCc1cc2c(c[nH]c(=O)c2c2cc(ccc12)-c1cn[nH]c1)-c1ccc(F)cc1

BDBM50223455

NCCCc1cc2cc[nH]c(=O)c2c2cc(ccc12)C(N)=O

BDBM50223485

CN(C)CCNC(=O)c1ccc2c(CCCN)cc3cc[nH]c(=O)c3c2c1

BDBM50223467

Clc1ccc2c(CCC#N)cc3cc[nH]c(=O)c3c2c1

BDBM50223468

CN(C)CCc1cc2cc[nH]c(=O)c2c2cc(Br)ccc12

BDBM50223451

COC(=O)c1cc2cc[nH]c(=O)c2c2cc(Cl)ccc12

BDBM50223456

COC(=O)c1cc2cc[nH]c(=O)c2c2cc(Br)ccc12

BDBM50223453

NCCCc1cc2cc[nH]c(=O)c2c2ccccc12

BDBM50224623

O=C1Nc2cnc(C#N)c(OCCCCCOc3ccc(OCCCCN4CCOCC4)cc3N1)n2

BDBM50224605

O=C1Nc2cnc(C#N)c(OCC\C=C/COc3ccc(CCCOC4CCCCO4)cc3N1)n2 |w:25.24,c:13|

BDBM50224624

O=C1Nc2cnc(C#N)c(OCC\C=C/COc3ccc(OCCCCN4CCOCC4)cc3N1)n2 |c:13|

BDBM50224625

CCOc1ccc(OCC)c(NC(=O)Nc2cnc(cn2)C#N)c1

BDBM50224612

Clc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:7|

BDBM50224593

Cc1ccc2OCCCCCOc3nc(NC(=O)Nc2c1)cnc3C#N

BDBM50224608

O=C1Nc2cnc(C#N)c(OC\C=C/COc3ccc(OCCCN4CCOCC4)cc3N1)n2 |c:12|

BDBM50224620

O=C1Nc2cnc(C#N)c(OCC\C=C/COc3ccc(OCCCCCN4CCOCC4)cc3N1)n2 |c:13|

BDBM50224615

Cc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:7|

BDBM50224609

OCCCc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:10|

BDBM50224598

O=C1Nc2cnc(C#N)c(OCCCCCOc3ccc(OCCCN4CCOCC4)cc3N1)n2

BDBM50224607

OCCc1ccc2OCCCCCOc3nc(NC(=O)Nc2c1)cnc3C#N

BDBM50224610

O=C1Nc2cnc(C#N)c(OC\C=C/COc3ccc(OCCCCN4CCOCC4)cc3N1)n2 |c:12|

BDBM50224614

OCCCc1ccc2OCCCCCOc3nc(NC(=O)Nc2c1)cnc3C#N

BDBM50224618

O=C1Nc2cnc(C#N)c(OCC\C=C/COc3ccc(CCOC4CCCCO4)cc3N1)n2 |w:24.23,c:13|

BDBM50224602

O=C1Nc2cnc(C#N)c(OC\C=C/COc3ccc(OCCCCCN4CCCOC4)cc3N1)n2 |c:12|

BDBM50224599

CC(=O)Nc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:10|

BDBM50224594

OCCOc1ccc2OCCCCCOc3nc(NC(=O)Nc2c1)cnc3C#N

BDBM50224592

CCOc1ccc2OCCCCCOc3nc(NC(=O)Nc2c1)cnc3C#N

BDBM50224621

COc1ccc(NC(C)=O)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM50224588

O=C1Nc2cnc(C#N)c(OCC\C=C/COc3ccc(OCCOC4CCCCO4)cc3N1)n2 |w:25.24,c:13|

BDBM50224595

Clc1ccc2OC\C=C/COc3nc(NC(=O)Nc2c1)cnc3C#N |c:7|

BDBM50224596

O=C1Nc2cnc(C#N)c(OCCCCOc3ccc(OCCCN4CCOCC4)cc3N1)n2

BDBM50224606

Oc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:7|

BDBM50224590

Brc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:7|

BDBM50224619

O=C1Nc2cnc(C#N)c(OCCCCOc3ccc(OCCCCN4CCOCC4)cc3N1)n2

BDBM50224589

OCCOc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:10|

BDBM50224604

CN(C)CCOc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:12|

BDBM50224591

O=C1Nc2cnc(C#N)c(OCCCCOc3ccc(OCCCCCN4CCCOC4)cc3N1)n2

BDBM50224600

O=C1Nc2cnc(C#N)c(OCCCCCOc3ccc(OCCCCCN4CCOCC4)cc3N1)n2

BDBM50224603

COc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:8|

BDBM50224587

OCCc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:9|

BDBM50224601

COc1ccc2OCCCCCOc3nc(NC(=O)Nc2c1)cnc3C#N

BDBM50224626

CC(=O)Nc1ccc2OCCCCCOc3nc(NC(=O)Nc2c1)cnc3C#N

BDBM50224622

CCOc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N |c:9|

BDBM50224611

O=C1Nc2cnc(C#N)c(OCC\C=C/COc3ccccc3N1)n2 |c:13|

BDBM50224597

Brc1ccc2OCCCCCOc3nc(NC(=O)Nc2c1)cnc3C#N

BDBM50224613

O=C1Nc2cnc(C#N)c(OCC\C=C/COc3ccc(OCCCN4CCOCC4)cc3N1)n2 |c:13|

BDBM50224617

O=C1Nc2cnc(C#N)c(OCCCCCOc3ccccc3N1)n2

BDBM50224616

CC(C)(C)[Si](Oc1ccc2OC\C=C/CCOc3nc(NC(=O)Nc2c1)cnc3C#N)(c1ccccc1)c1ccccc1 |c:12|

BDBM50251213

CCOC(=O)c1cc2C(=O)N(CO)C(=O)c2c2c3ccccc3[nH]c12

BDBM50251206

CCOC(=O)c1cc2C(=O)NC(=O)c2c2c3ccccc3[nH]c12

BDBM50236805

O=C1NCc2c3C(=O)NC(=O)c3c3[nH]c4ccccc4c3c12

BDBM50251201

O=C1NCc2c1c1C(=O)NC(=O)c1c1[nH]c3ccccc3c21

BDBM50245178

Oc1ccc2n(CCCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cccc1Cl |(17.41,2.71,;18.74,1.94,;18.74,.39,;20.07,-.38,;21.42,.39,;22.89,-.08,;23.38,-1.54,;22.36,-2.69,;22.84,-4.15,;21.82,-5.3,;22.15,-6.81,;20.82,-7.59,;19.67,-6.57,;20.29,-5.15,;23.79,1.18,;25.33,1.35,;25.95,2.77,;25.02,4.01,;25.33,5.52,;26.73,6.15,;24,6.28,;22.86,5.24,;21.35,5.55,;23.49,3.84,;22.88,2.43,;21.41,1.94,;20.07,2.71,;27.48,2.95,;28.39,1.7,;27.78,.29,;29.92,1.88,;30.53,3.29,;29.61,4.53,;28.08,4.35,;28.07,5.9,)|

BDBM50245386

CS(=O)(=O)NC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245301

Oc1ccc2n(CCCNc3ccccc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245385

OC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(7.04,-32.43,;8.06,-31.27,;9.57,-31.59,;7.57,-29.81,;8.59,-28.66,;8.11,-27.2,;6.63,-26.73,;5.29,-27.5,;3.95,-26.73,;3.96,-25.18,;2.62,-24.41,;5.29,-24.41,;6.62,-25.18,;8.09,-24.69,;8.71,-23.28,;8.07,-21.88,;6.57,-21.57,;9.21,-20.84,;10.55,-21.6,;11.95,-20.97,;10.24,-23.11,;11.16,-24.35,;10.54,-25.77,;9.01,-25.94,;12.69,-24.18,;13.61,-25.42,;12.99,-26.83,;15.13,-25.24,;15.75,-23.83,;14.82,-22.59,;13.3,-22.77,;13.28,-21.23,)|

BDBM50245622

Oc1ccc2n(CCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50245623

Oc1ccc2n(CCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245620

Oc1ccc2n(CCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245303

CN(C)CCNC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50245692

CNCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245495

OCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50245621

Oc1ccc2n(CCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cccc1Cl |(19.14,-37.63,;20.47,-38.4,;20.47,-39.95,;21.8,-40.72,;23.13,-39.95,;24.61,-40.42,;25.09,-41.89,;24.06,-43.03,;24.53,-44.5,;23.51,-45.64,;23.98,-47.1,;25.49,-47.42,;26.52,-46.28,;26.05,-44.81,;25.51,-39.17,;27.05,-39.01,;27.68,-37.6,;26.76,-36.35,;27.08,-34.85,;28.49,-34.23,;25.76,-34.08,;24.61,-35.1,;23.11,-34.78,;25.23,-36.51,;24.61,-37.91,;23.13,-38.39,;21.8,-37.63,;29.21,-37.44,;30.11,-38.69,;29.48,-40.1,;31.64,-38.53,;32.27,-37.12,;31.36,-35.88,;29.83,-36.04,;29.82,-34.5,)|

BDBM50245387

Oc1ccc2n(CCC(=O)NS(=O)(=O)c3ccccc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245302

Oc1ccc2n(CCCNc3ccccc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cccc1Cl |(17.36,-29.28,;18.7,-30.05,;18.69,-31.6,;20.03,-32.37,;21.37,-31.6,;22.85,-32.07,;23.33,-33.53,;22.31,-34.68,;22.8,-36.14,;21.78,-37.29,;22.26,-38.76,;21.24,-39.9,;21.72,-41.36,;23.23,-41.67,;24.26,-40.51,;23.77,-39.05,;23.75,-30.81,;25.28,-30.64,;25.9,-29.22,;24.97,-27.98,;25.28,-26.47,;26.69,-25.84,;23.95,-25.71,;22.81,-26.75,;21.31,-26.44,;23.45,-28.15,;22.83,-29.56,;21.36,-30.05,;20.02,-29.28,;27.43,-29.04,;28.34,-30.29,;27.73,-31.7,;29.87,-30.11,;30.49,-28.7,;29.56,-27.46,;28.04,-27.64,;28.02,-26.09,)|

BDBM50245693

CNCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(17.83,-19.63,;19.34,-19.93,;20.36,-18.78,;19.88,-17.32,;20.9,-16.17,;20.41,-14.71,;18.93,-14.24,;17.59,-15.01,;16.26,-14.24,;16.26,-12.69,;14.93,-11.92,;17.59,-11.92,;18.92,-12.69,;20.4,-12.2,;21.01,-10.79,;20.38,-9.39,;18.87,-9.08,;21.51,-8.35,;22.85,-9.11,;24.25,-8.48,;22.54,-10.62,;23.47,-11.86,;22.85,-13.28,;21.31,-13.45,;24.99,-11.68,;25.91,-12.93,;25.3,-14.34,;27.44,-12.75,;28.05,-11.34,;27.13,-10.1,;25.6,-10.28,;25.59,-8.73,)|

BDBM50245690

Oc1ccc2n(CCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cccc1Cl |(18.24,2.81,;19.57,2.04,;19.57,.49,;20.91,-.28,;22.25,.49,;23.73,.02,;24.21,-1.44,;23.19,-2.59,;23.68,-4.05,;25.14,-4.52,;25.16,-6.06,;23.69,-6.54,;22.78,-5.3,;24.63,1.28,;26.16,1.45,;26.78,2.87,;25.85,4.11,;26.16,5.62,;27.57,6.25,;24.83,6.38,;23.69,5.34,;22.18,5.65,;24.33,3.94,;23.71,2.53,;22.24,2.04,;20.9,2.81,;28.31,3.05,;29.22,1.81,;28.61,.39,;30.75,1.98,;31.37,3.39,;30.44,4.64,;28.92,4.45,;28.9,6,)|

BDBM50245497

COc1ccccc1-c1cc2n(CCCO)c3ccc(O)cc3c2c2C(=O)NC(=O)c12

BDBM50245304

CN(C)CCNC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245691

CNCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50245496

OCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(23.53,-35.27,;24.56,-34.12,;24.08,-32.66,;25.11,-31.51,;24.63,-30.05,;23.16,-29.57,;21.82,-30.34,;20.49,-29.57,;20.49,-28.02,;19.16,-27.25,;21.82,-27.25,;23.16,-28.02,;24.63,-27.54,;25.26,-26.13,;24.64,-24.72,;23.13,-24.4,;25.78,-23.7,;27.11,-24.47,;28.52,-23.85,;26.79,-25.97,;27.71,-27.22,;27.08,-28.64,;25.54,-28.79,;29.23,-27.06,;30.14,-28.31,;29.51,-29.72,;31.67,-28.15,;32.3,-26.75,;31.38,-25.5,;29.86,-25.66,;29.84,-24.12,)|

BDBM50245576

Oc1ccc2n(CCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50245384

OC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245573

CN(C)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50245575

CN(C)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(24.43,-31.38,;22.93,-31.06,;21.9,-32.21,;22.45,-29.6,;23.48,-28.45,;23,-26.99,;21.52,-26.51,;20.19,-27.28,;18.86,-26.51,;18.86,-24.97,;17.52,-24.2,;20.19,-24.2,;21.52,-24.96,;23,-24.48,;23.63,-23.07,;23,-21.67,;21.5,-21.34,;24.15,-20.64,;25.48,-21.41,;26.88,-20.79,;25.15,-22.91,;26.08,-24.17,;25.44,-25.58,;23.9,-25.74,;27.6,-24.01,;28.5,-25.26,;27.88,-26.66,;30.03,-25.1,;30.66,-23.69,;29.75,-22.44,;28.22,-22.61,;28.21,-21.06,)|

BDBM50245574

CN(C)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245523

NC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245522

NC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50245426

Oc1ccc2n(CCS(=O)(=O)c3nnc[nH]3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245525

Oc1ccc2n(CCC#N)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245524

NC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(-7.22,-5.81,;-6.19,-4.67,;-4.68,-4.98,;-6.66,-3.2,;-5.64,-2.06,;-6.11,-.59,;-7.59,-.11,;-8.92,-.88,;-10.26,-.11,;-10.25,1.43,;-11.59,2.2,;-8.92,2.2,;-7.59,1.44,;-6.11,1.92,;-5.49,3.33,;-6.11,4.73,;-7.61,5.05,;-4.97,5.76,;-3.64,4.99,;-2.23,5.61,;-3.96,3.48,;-3.04,2.23,;-3.67,.82,;-5.21,.66,;-1.51,2.39,;-.61,1.14,;-1.24,-.26,;.92,1.3,;1.55,2.71,;.64,3.96,;-.89,3.79,;-.9,5.34,)|

BDBM50245259

Oc1ccc2n(CCCNc3ccccc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50245423

Oc1ccc2n(CCc3nnn[nH]3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245425

Oc1ccc2n(CCS(=O)c3nnc[nH]3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245424

Oc1ccc2n(CCSc3nnc[nH]3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245344

OC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50245549

OCC(O)Cn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245343

CN(C)CC(O)Cn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245459

Oc1ccc2n(CCCc3nnn[nH]3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245546

COC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245458

OC(=O)CCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245548

COCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245342

CNCC(O)Cn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245547

Oc1ccc2n(CCCC#N)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245341

CN(C)CCNC(=O)CCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(18.95,-7.42,;19.98,-6.27,;19.49,-4.8,;21.48,-6.57,;22.51,-5.42,;24.02,-5.73,;25.04,-4.58,;26.55,-4.89,;24.55,-3.12,;25.57,-1.97,;25.09,-.51,;23.61,-.04,;22.27,-.81,;20.93,-.04,;20.94,1.51,;19.6,2.28,;22.26,2.28,;23.6,1.52,;25.07,2,;25.69,3.41,;25.05,4.81,;23.55,5.13,;26.19,5.85,;27.52,5.09,;28.93,5.72,;27.21,3.58,;28.14,2.34,;27.52,.93,;25.99,.76,;29.67,2.52,;30.58,1.28,;29.97,-.13,;32.11,1.45,;32.73,2.87,;31.8,4.11,;30.28,3.93,;30.26,5.47,)|

BDBM50245144

Oc1ccc2n(CCCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245731

CN(C)CCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50245732

CN(C)CCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245146

Oc1ccc2n(CCCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50245145

Oc1ccc2n(CCCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1c(Cl)cccc1Cl |(17.89,-39.21,;19.22,-39.98,;19.22,-41.52,;20.56,-42.29,;21.9,-41.52,;23.38,-41.99,;23.86,-43.45,;22.84,-44.61,;23.33,-46.07,;22.3,-47.22,;20.79,-46.91,;19.77,-48.05,;20.25,-49.52,;21.76,-49.83,;22.79,-48.68,;24.28,-40.73,;25.81,-40.56,;26.43,-39.14,;25.5,-37.9,;25.81,-36.4,;27.22,-35.76,;24.48,-35.64,;23.34,-36.67,;21.83,-36.36,;23.98,-38.07,;23.36,-39.48,;21.89,-39.97,;20.55,-39.21,;27.96,-38.97,;28.87,-40.21,;28.26,-41.62,;30.4,-40.04,;31.02,-38.62,;30.09,-37.38,;28.57,-37.56,;28.55,-36.02,)|

BDBM50245258

CN1CCN(CCCn2c3ccc(O)cc3c3c4C(=O)NC(=O)c4c(cc23)-c2c(Cl)cccc2Cl)CC1 |(20.56,-23.44,;21.58,-22.29,;21.1,-20.83,;22.12,-19.69,;23.63,-20,;24.66,-18.84,;24.17,-17.38,;25.19,-16.23,;24.71,-14.77,;23.23,-14.3,;21.89,-15.07,;20.55,-14.3,;20.55,-12.76,;19.22,-11.99,;21.88,-11.98,;23.22,-12.75,;24.69,-12.26,;25.31,-10.85,;24.67,-9.45,;23.16,-9.14,;25.81,-8.41,;27.14,-9.17,;28.55,-8.54,;26.83,-10.68,;27.76,-11.92,;27.14,-13.34,;25.61,-13.51,;29.29,-11.75,;30.2,-12.99,;29.59,-14.4,;31.73,-12.81,;32.35,-11.4,;31.42,-10.16,;29.9,-10.34,;29.88,-8.8,;24.12,-21.46,;23.09,-22.61,)|

BDBM50245457

OCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(20.53,-24.9,;20.05,-23.43,;21.08,-22.29,;20.6,-20.82,;19.13,-20.34,;17.8,-21.11,;16.46,-20.34,;16.46,-18.8,;15.13,-18.03,;17.79,-18.03,;19.13,-18.79,;20.6,-18.31,;21.23,-16.9,;20.61,-15.5,;19.1,-15.18,;21.75,-14.47,;23.08,-15.24,;24.49,-14.62,;22.76,-16.75,;23.68,-18,;23.05,-19.41,;21.51,-19.57,;25.2,-17.84,;26.11,-19.09,;25.48,-20.49,;27.64,-18.93,;28.27,-17.52,;27.35,-16.27,;25.83,-16.44,;25.81,-14.89,)|

BDBM50245147

Oc1ccc2n(CCCn3ccnc3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1Cl

BDBM50245257

CN1CCN(CCCn2c3ccc(O)cc3c3c4C(=O)NC(=O)c4c(cc23)-c2ccccc2Cl)CC1

BDBM50245733

CN(C)CCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1c(Cl)cccc1Cl |(21.79,-32.39,;23.3,-32.7,;23.79,-34.16,;24.32,-31.55,;23.84,-30.08,;24.86,-28.93,;24.37,-27.47,;22.89,-27,;21.55,-27.77,;20.22,-27,;20.22,-25.46,;18.89,-24.69,;21.55,-24.69,;22.88,-25.45,;24.36,-24.96,;24.97,-23.55,;24.34,-22.15,;22.83,-21.84,;25.47,-21.12,;26.81,-21.88,;28.21,-21.24,;26.5,-23.38,;27.43,-24.62,;26.81,-26.04,;25.27,-26.21,;28.95,-24.45,;29.87,-25.69,;29.25,-27.1,;31.4,-25.51,;32.01,-24.1,;31.09,-22.86,;29.56,-23.04,;29.55,-21.5,)|

BDBM50245256

CN1CCN(CCCn2c3ccc(O)cc3c3c4C(=O)NC(=O)c4c(cc23)-c2ccccc2)CC1

BDBM50245734

Oc1ccc2n(CCCN3CCOCC3)c3cc(c4C(=O)NC(=O)c4c3c2c1)-c1ccccc1

BDBM50232241

OCCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245456

OCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50245455

OCCn1c2ccc(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1

BDBM50260339

O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1[nH]c3ccncc3c21

BDBM50260340

O=C1NC(=O)c2c1c1c3cnccc3[nH]c1c1[nH]c3ccc(OCc4ccccc4)cc3c21

BDBM50260341

O=C1NC(=O)c2c1c1c3ccc(OCc4ccccc4)cc3[nH]c1c1[nH]c3ccncc3c21

BDBM50260343

Oc1ccc2c(c1)[nH]c1c3[nH]c4ccncc4c3c3C(=O)NC(=O)c3c21

BDBM50260334

CN1C(=O)c2c(C1=O)c1c3cnccc3[nH]c1c1[nH]c3cc(O)ccc3c21

BDBM50260358

Oc1ccc2[nH]c3c4[nH]c5ccncc5c4c4C(=O)NC(=O)c4c3c2c1

BDBM50243623

NC(=O)Nc1sc(cc1C(=O)NCC1CNCCO1)-c1ccccc1

BDBM50243624

NC(=O)Nc1sc(cc1C(=O)N[C@@H]1CCCCNC1)-c1ccccc1 |r|

BDBM50243050

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(cc1)C(F)(F)F |r|

BDBM50243621

NC(=O)Nc1sc(cc1C(=O)NC[C@H]1CCCNC1)-c1ccccc1 |r|

BDBM50243622

NC(=O)Nc1sc(cc1C(=O)NC[C@@H]1CCCNC1)-c1ccccc1 |r|

BDBM50243530

CCN(CC)CCOc1ccc(cc1)-c1cc(C(=O)NC2CCNCC2)c(NC(N)=O)s1

BDBM50243620

CN(CCN)C(=O)c1cc(sc1NC(N)=O)-c1ccccc1

BDBM50243330

CNCc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243666

CCN(CC)CCOc1cccc(c1)-c1cc(C(=O)NC2CCCNC2)c(NC(N)=O)s1

BDBM50243331

NC(=O)Nc1sc(cc1C(N)=O)-c1ccc(CN2CCCCC2)cc1

BDBM50243665

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CN2CCC1CC2)-c1ccccc1 |r,wU:12.12,TLB:11:12:16.15:18.19,(19.15,-4.42,;17.82,-3.65,;17.83,-2.11,;16.48,-4.42,;15.16,-3.65,;13.92,-4.55,;12.67,-3.65,;13.15,-2.18,;14.69,-2.18,;15.44,-.84,;16.98,-.82,;14.65,.48,;15.31,1.88,;14.59,2.71,;16.2,2.41,;16.49,.96,;17.79,.37,;17.48,1.85,;18.46,3.2,;17.16,3.7,;11.33,-4.41,;10.01,-3.62,;8.67,-4.38,;8.66,-5.92,;10,-6.7,;11.33,-5.94,)|

BDBM50243334

CNCCOc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243332

CCN(CC)CCOc1ccc(cc1)-c1cc(C(=O)Nc2cccc(CO)c2)c(NC(N)=O)s1

BDBM50243333

CN(C)CCOc1ccc(cc1)c2cc(c(s2)NC(=O)N)C(=O)N

BDBM50243424

COc1ccc(CNCc2ccc(cc2)-c2cc(C(N)=O)c(NC(N)=O)s2)cc1

BDBM50243423

NC(=O)Nc1sc(cc1C(N)=O)-c1ccc(CNC2CCCC2)cc1

BDBM50243581

NC(=O)Nc1sc(cc1C(=O)NC1CCCCC1)-c1ccccc1

BDBM50242820

CCN(CC)CCOc1cccc(c1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243582

NC(=O)Nc1sc(cc1C(=O)NCCO)-c1ccccc1

BDBM50243585

CNCCNC(=O)c1cc(sc1NC(N)=O)-c1ccccc1

BDBM50242821

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(O)cc1 |r|

BDBM50243583

CN1CCN(CC1)C(=O)c1cc(sc1NC(N)=O)-c1ccccc1

BDBM50243584

NCCNC(=O)c1cc(sc1NC(N)=O)-c1ccccc1

BDBM50243531

CCN(CC)CCOc1ccc(cc1)-c1cc(C(=O)NC2CCCNC2)c(NC(N)=O)s1

BDBM50243532

NC(=O)Nc1sc(cc1C(=O)Nc1ccccc1)-c1ccccc1

BDBM50243533

NC(=O)Nc1sc(cc1C(=O)NCc1ccccc1)-c1ccccc1

BDBM50243534

NC(=O)Nc1sc(cc1C(=O)NC1CCOCC1)-c1ccccc1

BDBM50243263

COc1ccc(Nc2cc(n[nH]2)-c2cccnc2)cc1OC

BDBM50243473

CCN(CC)CCOc1ccc(cc1)-c1cc(C(=O)NC2CCNC2)c(NC(N)=O)s1

BDBM50243261

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(cc1)C(=O)N1CCCCC1 |r|

BDBM50243262

CC1=CC2=NNC(=O)N2c3c1cccc3

BDBM50243202

CNC(=O)c1ccc(cc1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243255

CNC(=O)c1cc(sc1NC(N)=O)-c1ccccc1

BDBM50243203

CN(C)C(=O)c1ccc(cc1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243256

NC(=O)Nc1sc(cc1C(=O)N1CCOCC1)-c1ccccc1

BDBM50243201

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(cc1)C(N)=O |r|

BDBM50243471

CC1(C)CCCC(C)(C)N1Cc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243259

NC(=O)Nc1sc(cc1C(=O)N[C@@H]1CCCNC1)-c1ccccc1 |r|

BDBM50243472

CCN(CC)CCOc1ccc(cc1)-c1cc(C(=O)Nc2cccnc2)c(NC(N)=O)s1

BDBM50243260

CN1CCC[C@H](C1)NC(=O)c1cc(sc1NC(N)=O)-c1ccccc1 |r|

BDBM50243204

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(cc1)C(=O)N1CCOCC1 |r|

BDBM50243257

NC(=O)Nc1sc(cc1C(=O)NC1CCNCC1)-c1ccccc1

BDBM50243586

CN(C)CCNC(=O)c1cc(sc1NC(N)=O)-c1ccccc1

BDBM50243470

CN1CCN(Cc2ccc(cc2)-c2cc(C(N)=O)c(NC(N)=O)s2)CC1

BDBM50243047

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1cccc(c1)C(N)=O |r|

BDBM50243048

Cc1ccc(cc1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243046

c1cc(ccc1c2cc(c(s2)NC(=O)N)C(=O)N[C@H]3CCCNC3)Cl

BDBM50243100

CC(=O)Nc1cccc(c1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243150

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1cccnc1 |r|

BDBM50243368

CN(C)CCCOc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243663

NC(=O)Nc1sc(cc1C(=O)NC1CNCCNC1=O)-c1ccccc1

BDBM50243101

CS(=O)(=O)Nc1ccc(cc1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243151

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccncc1 |r|

BDBM50243369

NC(=O)Nc1sc(cc1C(N)=O)-c1ccc(OCCN2CCCCC2)cc1

BDBM50243664

NC(=O)Nc1sc(cc1C(=O)N[C@@H]1CN2CCC1CC2)-c1ccccc1 |r,wD:12.12,TLB:11:12:16.15:18.19,(-.7,-3.12,;-2.03,-2.35,;-2.02,-.81,;-3.36,-3.12,;-4.69,-2.35,;-5.93,-3.25,;-7.18,-2.35,;-6.7,-.88,;-5.16,-.88,;-4.41,.46,;-2.87,.48,;-5.2,1.79,;-4.54,3.18,;-5.26,4.01,;-3.65,3.71,;-3.36,2.26,;-2.06,1.67,;-2.37,3.15,;-1.39,4.5,;-2.69,5,;-8.52,-3.11,;-9.84,-2.32,;-11.18,-3.08,;-11.19,-4.62,;-9.85,-5.4,;-8.52,-4.64,)|

BDBM50243098

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccc(N)cc1 |r|

BDBM50243148

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1cccs1 |r|

BDBM50243099

CN(C)c1ccc(cc1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243149

NC(=O)Nc1sc(cc1C(=O)N[C@H]1CCCNC1)-c1ccsc1 |r|

BDBM50243662

NC(=O)Nc1sc(cc1C(=O)NC1CCCCNC1=O)-c1ccccc1

BDBM50243372

COCCOc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243102

CS(=O)(=O)c1ccc(cc1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243370

NC(=O)Nc1sc(cc1C(N)=O)-c1ccc(OCCOCC2CC2)cc1

BDBM50243371

COCCOCCOc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243421

COCCNCc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243147

CC(=O)c1ccc(cc1)-c1cc(C(=O)N[C@H]2CCCNC2)c(NC(N)=O)s1 |r|

BDBM50243422

CN(CCO)Cc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243419

COc1ccc(cc1)-c1cc(C(N)=O)c(NC(N)=O)s1

BDBM50243420

NC(=O)Nc1sc(cc1C(N)=O)-c1ccc(OC(F)(F)F)cc1

BDBM50268249

CO[C@@H]1[C@@H](CN)O[C@@H]2[C@H]([C@H]1O)n1c3ccccc3c3c4C(=O)NC(=O)c4c4c5ccccc5n2c4c13 |r|

BDBM50263132

Cc1c(Nc2c(cnc3sc(\C=C\C(=O)N4CCCC4)cc23)C#N)ccc2[nH]ccc12

BDBM50256001

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3c(Cl)c(Cl)sc3c12 |w:3.2,t:1|

BDBM50256002

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3cc(Br)sc3c12 |w:3.2,t:1|

BDBM50256003

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3c(Br)csc3c12 |w:3.2,t:1|

BDBM50256004

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3c(csc3c12)C#N |w:3.2,t:1|

BDBM50256006

NC1=NC(=O)C(S1)=C1CCNC(=O)c2[nH]c3c(csc3c12)-c1ccccc1 |w:5.4,t:1|

BDBM50256007

NC1=NC(=O)C(S1)=C1CCNC(=O)c2[nH]c3c4ccccc4sc3c12 |w:5.5,t:1|

BDBM50025098

Nc1nc(c(O)[nH]1)C1=C2C(=Nc3ccccc23)C(=O)NCC1 |c:10,t:8|

BDBM50256045

Cn1c2c(C(CCNC2=O)=C2N=C(N)NC2=O)c2sccc12 |w:10.11,t:12|

BDBM50256046

COc1ccc(Cn2c3c(C(CCNC3=O)=C3N=C(N)NC3=O)c3scc(Br)c23)cc1 |w:16.22,t:18|

BDBM50256047

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3ccsc3c12 |w:3.2,t:1|

BDBM50256048

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3cc(Cl)sc3c12 |w:3.2,t:1|

BDBM50256025

NC(=O)c1csc2c3c([nH]c12)C(=O)NCCC3=C1N=C(N)NC1=O |w:17.20,t:21|

BDBM50256026

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3c(csc3c12)-c1ccccc1 |w:3.3,t:1|

BDBM50256027

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3c4ccccc4sc3c12 |w:3.2,t:1|

BDBM50256028

NC1=NC(=O)C(S1)=C1CCNC(=O)c2[nH]c3ccsc3c12 |w:5.5,t:1|

BDBM50256029

NC1=NC(=O)C(S1)=C1CCNC(=O)c2[nH]c3c(Br)csc3c12 |w:5.5,t:1|

BDBM50256008

OC(=O)CNC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3c(Br)csc3c12 |w:7.7,t:5|

BDBM50256043

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c(Br)c(Br)c12 |w:3.2,t:1|

BDBM50256009

OCCNC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3ccsc3c12 |w:6.5,t:4|

BDBM50256030

OCCNC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3c(Br)csc3c12 |w:6.5,t:4|

BDBM50256000

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3c(Cl)csc3c12 |w:3.2,t:1|

BDBM50277025

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1)C(=O)NC1CCCCC1

BDBM50277026

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1)C(=O)N1CCN(CC1)c1ccccc1

BDBM50277034

CCCCC(Sc1nc2cc(C)ccc2c(=O)n1-c1cccc(Cl)c1)C(=O)N1CCC(CC1)C(N)=O

BDBM50277001

CCCC[C@@H](Sc1nc2ccccc2c(=O)n1-c1cccc(Cl)c1)C(=O)N1CCC[C@]2(CCCNC2)C1 |r|

BDBM50277024

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1)C(=O)N1CCC(CC1)C(N)=O

BDBM50277032

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1)C(=O)N1CCC(CC1)C(N)=O

BDBM50277033

CCCCC(Sc1nc2cccc(C)c2c(=O)n1-c1cccc(Cl)c1)C(=O)N1CCC(CC1)C(N)=O

BDBM50277029

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1)C(=O)N1CCC(CC1)(c1ccccc1)c1ccccc1

BDBM50277030

CC(C)C(Sc1nc2ccccc2c(=O)n1-c1cccc(Cl)c1)C(=O)N1CCC(CC1)C(N)=O

BDBM50277027

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1)C(=O)N1CCS(=O)(=O)CC1

BDBM50276995

NC(=O)C1CCN(CC1)C(=O)C(Sc1nc2ccccc2c(=O)n1-c1cccc(Cl)c1)c1ccccc1

BDBM50277035

CCCCC(Sc1nc2c(C)cccc2c(=O)n1-c1cccc(Cl)c1)C(=O)N1CCC(CC1)C(N)=O

BDBM50277028

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1)C(=O)N1CCCC2(CCCNC2)C1

BDBM50276996

CC(C)CC(Sc1nc2ccccc2c(=O)n1-c1cccc(Cl)c1)C(=O)N1CCC(CC1)C(N)=O

BDBM50277031

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1Cl)C(=O)N1CCC(CC1)C(N)=O |(24.79,-25.5,;26.12,-26.28,;27.45,-25.51,;28.78,-26.28,;30.12,-25.51,;30.12,-23.97,;28.78,-23.19,;27.46,-23.97,;26.11,-23.2,;24.78,-23.96,;23.44,-23.2,;23.44,-21.65,;24.78,-20.87,;26.11,-21.65,;27.44,-20.88,;27.43,-19.33,;28.78,-21.65,;30.11,-20.88,;31.44,-21.65,;32.77,-20.88,;32.77,-19.34,;31.42,-18.57,;30.1,-19.35,;28.76,-18.59,;31.46,-26.28,;31.46,-27.83,;32.8,-25.52,;34.13,-26.3,;35.46,-25.53,;35.47,-23.99,;34.14,-23.21,;32.79,-23.97,;36.81,-23.23,;38.14,-24.01,;36.82,-21.69,)|

BDBM50276993

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:25:26:29.28.33:31,THB:27:28:31:35.26.34,27:26:29.28.33:31,34:26:29:33.32.31,34:32:29:35.27.26|

BDBM50276994

CCCCC(Sc1nc2ccccc2c(=O)n1-c1ccccc1)C(=O)NC(C)(C)C

BDBM50276999

CCCCC(Sc1nc2c(O)cccc2c(=O)n1-c1cccc(Cl)c1)C(=O)N1CCC(CC1)C(N)=O

BDBM50277000

CCCCC(Sc1nc2c(OC)cccc2c(=O)n1-c1cccc(Cl)c1)C(=O)N1CCC(CC1)C(N)=O

BDBM50267521

Cn1cc(c2c1cc(c(c2)F)I)C3=C(C(=O)NC3=O)c4coc5c4cccc5OC

BDBM50299083

CC[S@](=O)c1ccc(cc1)-c1coc2ccc(cc12)-c1ccc(C)o1 |r|

BDBM50299081

Cc1ccc(o1)-c1ccc2occ(-c3ccc(cc3)[S@](C)=O)c2c1 |r|

BDBM50305006

NCCn1cc(-c2cc(-c3cc4ccccc4s3)c3[nH]ncc3c2)c2nc(N)ncc12

BDBM50307535

CC(=O)N1CCC(CC1)Nc1ncc2CCc3c(nn(C)c3-c2n1)C(N)=O

BDBM50307506

Cn1nc(C(N)=O)c2CCc3cnc(NC4CCN(CC4)C(=O)c4ccccc4)nc3-c12

BDBM50307507

CNC(=O)c1nn(C)c-2c1CCc1cnc(NC3CCN(CC3)C(=O)C3CCN(CC3)S(C)(=O)=O)nc-21

BDBM50311985

CN1C[C@@H]2C[C@H]1CN2c1ccc(cc1)-c1ccnc2c(c(nn12)-c1ccncc1)-c1cccc(O)c1 |r|

BDBM50314051

FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ccnc2cc(nn12)-c1ccncc1

BDBM50315888

O=C(Cc1ccccc1)Nc1cccc(c1)-c1nc2sccn2c1-c1ccnc(Nc2cccc(c2)N2CCOCC2)n1

BDBM50280450

CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13 |r|

BDBM50325167

COCc1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325149

COc1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325144

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cc[nH]c1

BDBM50026043

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(O)cc1

BDBM50325177

CC1=CC2=NNC(=O)N2c3c1ccc(c3)c4ccc[nH]4

BDBM50325176

Cc1csc(c1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325175

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cccs1

BDBM50325166

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(CC#N)cc1

BDBM50325165

CNCc1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325151

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(OCCN2CCOCC2)cc1

BDBM50325146

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1c[nH]cn1

BDBM50325164

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(CN2CCOCC2)cc1

BDBM50325150

CCN(CC)CCOc1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325145

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cn[nH]c1

BDBM50325163

CN1CCN(Cc2ccc(cc2)-c2ccc3c(C)cc4n[nH]c(=O)n4c3c2)CC1

BDBM50325156

Cc1cc(ccc1O)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325154

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(cc1)C(=O)N1CCOCC1

BDBM50325155

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(cc1)C(N)=O

BDBM50325174

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1nccs1

BDBM50325148

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccoc1

BDBM50325157

CC(=O)Nc1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325171

CC1=CC2=NNC(=O)N2c3c1ccc(c3)c4ccncc4

BDBM50325170

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccccc1CO

BDBM50325169

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(CO)cc1

BDBM50325147

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccco1

BDBM50325168

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cccc(CO)c1

BDBM50325173

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cnccn1

BDBM50325143

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cccc(O)c1

BDBM50325172

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cccnc1

BDBM50325152

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(cc1)S(C)=O

BDBM50325161

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(CN2CCNCC2)cc1

BDBM50325160

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccccc1N

BDBM50325159

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc(cc1)C#N

BDBM50325158

CCNC(=O)c1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325153

CNC(=O)c1ccc(cc1)-c1ccc2c(C)cc3n[nH]c(=O)n3c2c1

BDBM50325162

Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cccc(CN2CCNCC2)c1

BDBM50325305

Oc1ccc(cc1)-c1ccc2\C(=C\c3ccc([se]3)C(=O)NCCCn3ccnc3)C(=O)Nc2c1

BDBM50325299

OC(=O)c1ccc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)[se]1

BDBM50325307

CCN(CC)CCNC(=O)c1cc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)[se]c1C

BDBM50325314

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2cccc(O)c2)cc1C(=O)NCCN1CCCC1

BDBM50325298

Cc1ccc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)[se]1

BDBM50325306

CN(C)CCNC(=O)c1cc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)[se]c1C

BDBM50325313

CCN(CC)CCNC(=O)c1cc(\C=C2/C(=O)Nc3cc(ccc23)-c2cccc(O)c2)[se]c1C

BDBM50325276

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2cccc(O)c2)cc1C(=O)NCCCn1ccnc1

BDBM50325281

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2O)cc1C(=O)NCCN1CCCCO1

BDBM50325289

COc1cc(ccc1O)-c1ccc2\C(=C\c3ccc([se]3)C(=O)NCCN3CCCC3)C(=O)Nc2c1

BDBM50325288

CCN(CC)CCNC(=O)c1ccc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)c(OC)c2)[se]1

BDBM50325300

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)cc1C(O)=O

BDBM50325308

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)cc1C(=O)NCCN1CCCC1

BDBM50325275

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2cccc(O)c2)cc1C(=O)NCCN1CCCCO1

BDBM50325282

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2O)cc1C(=O)NCCCn1ccnc1

BDBM50325278

CN(C)CCNC(=O)c1cc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2O)[se]c1C

BDBM50325277

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2O)cc1C(O)=O

BDBM50325280

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2O)cc1C(=O)NCCN1CCCC1

BDBM50325279

CCN(CC)CCNC(=O)c1cc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccccc2O)[se]c1C

BDBM50325286

COc1cc(ccc1O)-c1ccc2\C(=C\c3cc(C(O)=O)c(C)[se]3)C(=O)Nc2c1

BDBM50325301

CN(C)CCNC(=O)c1ccc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)[se]1

BDBM50325285

COc1cc(ccc1O)-c1ccc2\C(=C\c3ccc([se]3)C(O)=O)C(=O)Nc2c1

BDBM50325291

COc1cc(ccc1O)-c1ccc2\C(=C\c3ccc([se]3)C(=O)NCCCn3ccnc3)C(=O)Nc2c1

BDBM50325303

Oc1ccc(cc1)-c1ccc2\C(=C\c3ccc([se]3)C(=O)NCCN3CCCC3)C(=O)Nc2c1

BDBM50325287

COc1cc(ccc1O)-c1ccc2\C(=C\c3ccc([se]3)C(=O)NCCN(C)C)C(=O)Nc2c1

BDBM50325302

CCN(CC)CCNC(=O)c1ccc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)[se]1

BDBM50325304

Oc1ccc(cc1)-c1ccc2\C(=C\c3ccc([se]3)C(=O)NCCN3CCCCO3)C(=O)Nc2c1

BDBM50325284

COc1cc(ccc1O)-c1ccc2\C(=C\c3ccc(C)[se]3)C(=O)Nc2c1

BDBM50325290

COc1cc(ccc1O)-c1ccc2\C(=C\c3ccc([se]3)C(=O)NCCN3CCOCC3)C(=O)Nc2c1

BDBM50325283

COc1cc(ccc1O)-c1ccc2\C(=C\c3ccc[se]3)C(=O)Nc2c1

BDBM50325297

Oc1ccc(cc1)-c1ccc2\C(=C\c3ccc[se]3)C(=O)Nc2c1

BDBM50325293

CCN(CC)CCNC(=O)c1cc(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)c(OC)c2)[se]c1C

BDBM50325309

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)cc1C(=O)NCCN1CCCCO1

BDBM50325292

COc1cc(ccc1O)-c1ccc2\C(=C\c3cc(C(=O)NCCN(C)C)c(C)[se]3)C(=O)Nc2c1

BDBM50325295

COc1cc(ccc1O)-c1ccc2\C(=C\c3cc(C(=O)NCCN4CCOCC4)c(C)[se]3)C(=O)Nc2c1

BDBM50325311

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2cccc(O)c2)cc1C(O)=O

BDBM50325294

COc1cc(ccc1O)-c1ccc2\C(=C\c3cc(C(=O)NCCN4CCCC4)c(C)[se]3)C(=O)Nc2c1

BDBM50325310

Cc1[se]c(\C=C2/C(=O)Nc3cc(ccc23)-c2ccc(O)cc2)cc1C(=O)NCCCn1ccnc1

BDBM50325296

COc1cc(ccc1O)-c1ccc2\C(=C\c3cc(C(=O)NCCCn4ccnc4)c(C)[se]3)C(=O)Nc2c1

BDBM50325312

CN(C)CCNC(=O)c1cc(\C=C2/C(=O)Nc3cc(ccc23)-c2cccc(O)c2)[se]c1C

BDBM50308060

C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O

BDBM50300690

CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1

BDBM50326054

CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|

BDBM50326053

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC

BDBM16673

CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl

BDBM13535

COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1

BDBM50327912

O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cc2n[nH]c(NC(=O)c3ccc(cc3)N3CCOCC3)c2s1 |r|

BDBM50329198

CC[N@](Cc1cc(sn1)Nc2c3ncc(n3cc(n2)C)c4c[nH]nc4)C(C)(C)CO

BDBM50329197

C[C@@H](N1C[C@H](C)O[C@H](C)C1)c1cc(Nc2nc(C)cn3c(cnc23)-c2cn[nH]c2)sn1 |r|

BDBM50330578

COc1cc(cc(OC)c1OC)-c1cnc(N)c(n1)N1CCC(CC1)C(O)=O

BDBM50330575

COc1cc(cc(OC)c1OC)-c1cnc(N)c(n1)N1CC[C@H]([C@@H](C)[C@H]1C)C(O)=O |r|

BDBM50330574

CCc1ccsc1-c1cnc(N)c(n1)N1CCC(CC1)C(O)=O

BDBM50330775

NC(N)=NCCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4cc(O)ccc4[nH]c23)c1 |(47.46,-28,;45.93,-28,;45.16,-29.33,;45.16,-26.67,;43.63,-26.67,;42.86,-25.35,;41.33,-25.35,;40.56,-24.03,;39.02,-24.03,;38.25,-25.37,;38.26,-22.71,;39.02,-21.38,;38.23,-20.05,;36.7,-20.07,;35.95,-21.42,;34.41,-21.42,;33.65,-20.1,;32.12,-20.1,;31.35,-21.43,;31.35,-18.77,;32.11,-17.43,;31.32,-16.11,;31.79,-14.64,;33.24,-14.16,;30.54,-13.74,;29.3,-14.65,;27.84,-14.19,;29.78,-16.12,;29.03,-17.45,;27.52,-17.78,;26.27,-16.88,;24.87,-17.51,;23.63,-16.61,;24.71,-19.04,;25.95,-19.94,;27.36,-19.32,;28.78,-19.94,;29.8,-18.78,;36.72,-22.73,)|

BDBM50330783

O=C(NCc1ccccc1)c1cc2C(=O)NC(=O)c2c2c1[nH]c1ccccc21

BDBM50330774

NC(N)=NCCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4ccccc4[nH]c23)c1 |(18.17,-28.3,;16.64,-28.3,;15.87,-29.63,;15.87,-26.97,;14.34,-26.97,;13.58,-25.65,;12.04,-25.65,;11.27,-24.33,;9.73,-24.33,;8.96,-25.66,;8.97,-23.01,;9.73,-21.68,;8.94,-20.35,;7.41,-20.36,;6.66,-21.71,;5.12,-21.71,;4.36,-20.4,;2.83,-20.4,;2.06,-21.72,;2.06,-19.07,;2.82,-17.73,;2.03,-16.4,;2.5,-14.93,;3.96,-14.45,;1.25,-14.04,;.01,-14.95,;-1.45,-14.49,;.49,-16.41,;-.26,-17.75,;-1.77,-18.08,;-3.02,-17.18,;-4.42,-17.81,;-4.58,-19.34,;-3.34,-20.24,;-1.93,-19.62,;-.51,-20.24,;.51,-19.08,;7.43,-23.02,)|

BDBM50330778

NCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4ccccc4[nH]c23)c1

BDBM50330779

NCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4cc(O)ccc4[nH]c23)c1

BDBM50330776

NC(N)=NCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4cc(O)ccc4[nH]c23)c1 |(42.85,-6.31,;42.23,-7.72,;43.14,-8.96,;40.7,-7.89,;39.79,-6.65,;38.26,-6.82,;37.35,-5.58,;35.82,-5.74,;35.2,-7.15,;34.91,-4.5,;35.53,-3.09,;34.61,-1.85,;33.08,-2.03,;32.48,-3.43,;30.95,-3.6,;30.04,-2.36,;28.51,-2.53,;27.89,-3.94,;27.59,-1.29,;28.21,.13,;27.3,1.37,;27.61,2.88,;29.01,3.51,;26.27,3.64,;25.12,2.6,;23.62,2.91,;25.76,1.2,;25.15,-.21,;23.68,-.7,;22.34,.06,;21.01,-.71,;19.68,.06,;21.01,-2.25,;22.35,-3.02,;23.68,-2.25,;25.16,-2.72,;26.06,-1.46,;33.38,-4.67,)|

BDBM50330777

NC(N)=NCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4ccccc4[nH]c23)c1 |(13.06,-5.78,;12.45,-7.19,;13.36,-8.43,;10.92,-7.36,;10.01,-6.12,;8.48,-6.29,;7.57,-5.05,;6.04,-5.22,;5.42,-6.62,;5.13,-3.98,;5.75,-2.57,;4.83,-1.32,;3.3,-1.5,;2.7,-2.91,;1.17,-3.07,;.26,-1.83,;-1.27,-2,;-1.89,-3.41,;-2.19,-.76,;-1.57,.65,;-2.49,1.9,;-2.17,3.41,;-.77,4.04,;-3.52,4.17,;-4.66,3.13,;-6.16,3.44,;-4.02,1.72,;-4.63,.32,;-6.11,-.17,;-7.44,.59,;-8.77,-.18,;-8.77,-1.72,;-7.44,-2.49,;-6.1,-1.72,;-4.62,-2.19,;-3.72,-.93,;3.6,-4.14,)|

BDBM50330780

NCCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4ccccc4[nH]c23)c1

BDBM50330782

NC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4ccccc4[nH]c23)c1

BDBM50330781

NCCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4cc(O)ccc4[nH]c23)c1

BDBM50332171

NC(=O)c1nnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(Cl)cc1 |r|

BDBM50332144

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(Oc2ccccc2)cc1 |r|

BDBM50332151

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccc(c1)C#N |r|

BDBM50332152

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(F)cc1 |r|

BDBM50332176

N[C@H]1CCCCN(C1)C(=O)c1cc(sc1NC(N)=O)-c1ccc(Cl)cc1 |r|

BDBM50332169

NC(=O)c1cnc(N[C@H]2CCCNC2)c2sc(cc12)-c1ccc(Cl)cc1 |r|

BDBM50332177

NC(=O)c1cnc(N[C@H]2CCCCNC2)c2cc(sc12)-c1ccc(Cl)cc1 |r|

BDBM50332143

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc2sccc2c1 |r|

BDBM50332170

NC(=O)c1cnc(N[C@H]2CCCNC2)c2nc(sc12)-c1ccc(Cl)cc1 |r|

BDBM50332135

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccnc1 |r|

BDBM50332160

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc2ncccc2c1 |r|

BDBM50332136

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccccc1 |r|

BDBM50332128

COc1ccc(F)cc1-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332159

NC(=O)c1ccc(cc1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332127

N[C@@H]1CCCC[C@H]1Nc1ncc(C(N)=O)c2sc(cc12)-c1ccc(Cl)cc1 |r|

BDBM50332167

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(Br)sc12 |r|

BDBM50332168

NC(=O)c1cnc(N[C@H]2CCCNC2)c2ccsc12 |r|

BDBM50332154

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ncccn1 |r|

BDBM50332122

NC(=O)c1cnc(NCC2CCCCN2)c2cc(sc12)-c1ccc(Cl)cc1

BDBM50332145

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc2[nH]ccc2c1 |r|

BDBM50332146

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc2cc[nH]c2c1 |r|

BDBM50332153

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(OC(F)(F)F)cc1 |r|

BDBM50332121

CNCCNc1ncc(C(N)=O)c2sc(cc12)-c1ccc(Cl)cc1

BDBM50332138

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccc2[nH]ccc12 |r|

BDBM50332155

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(F)c(Cl)c1 |r|

BDBM50332156

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cc2ccccc2o1 |r|

BDBM50332123

NC(=O)c1cnc(NC[C@@H]2CCCN2)c2cc(sc12)-c1ccc(Cl)cc1 |r|

BDBM50332124

NC(=O)c1cnc(NC[C@@H]2CSCN2)c2cc(sc12)-c1ccc(Cl)cc1 |r|

BDBM50332137

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccccc1Cl |r|

BDBM50332162

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccc(c1)N1CCCC1 |r|

BDBM50332130

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccc(Cl)c1 |r|

BDBM50332161

Cn1ccc2cc(ccc12)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332164

COc1ccc(cn1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332129

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cc(F)cc(F)c1 |r|

BDBM50332132

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccc(N)c1 |r|

BDBM50332148

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(Cl)c(F)c1 |r|

BDBM50332163

CN(C)C(=O)c1ccc(cc1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332172

NC(=O)Nc1sc(cc1C(=O)NC1CCCCC1)-c1ccc(Cl)cc1

BDBM50332131

CC(=O)Nc1cccc(c1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332147

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(F)cc1F |r|

BDBM50332140

COc1cccc(c1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332149

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(cc1)C(F)(F)F |r|

BDBM50332150

CS(=O)(=O)c1ccc(cc1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332174

NC(=O)c1cnc(N[C@H]2CCNC2)c2cc(sc12)-c1ccc(Cl)cc1 |r|

BDBM50332139

COc1ccccc1-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332142

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccc(CO)c1 |r|

BDBM50332157

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)C#Cc1cccnc1 |r|

BDBM50332175

NC(=O)c1cnc(NC2CNC2)c2cc(sc12)-c1ccc(Cl)cc1

BDBM50332158

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cnc2ccccc2c1 |r|

BDBM50332125

N[C@@H]1CCCN(C1)c1ncc(C(N)=O)c2sc(cc12)-c1ccc(Cl)cc1 |r|

BDBM50332126

NC(=O)c1cnc(N[C@@H]2CCCNC2)c2cc(sc12)-c1ccc(Cl)cc1 |r|

BDBM50332141

COc1ccc(cc1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332166

CN(C)S(=O)(=O)c1ccc(cc1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332134

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(F)c(F)c1 |r|

BDBM50332165

CN(C)S(=O)(=O)c1cccc(c1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50332133

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccncc1 |r|

BDBM50332173

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccc(Cl)cc1 |r|

BDBM50334855

Cn1cc(cn1)-c1cnn2c(N)c(I)c(nc12)C1CCCNC1

BDBM50334856

CCc1c(N)n2ncc(-c3cnn(C)c3)c2nc1C1CCCNC1

BDBM50334854

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)C1CCCNC1

BDBM50334863

Cn1cc(cn1)-c1cnn2c(N)c(-c3cccs3)c(nc12)C1CCCNC1

BDBM50334861

Cn1cc(cn1)-c1cnn2c(N)c(C#N)c(nc12)C1CCCNC1

BDBM50334862

Cn1cc(cn1)-c1cnn2c(N)c(-c3ccccc3)c(nc12)C1CCCNC1

BDBM50334859

Cn1cc(cn1)-c1cnn2c(N)c(CCO)c(nc12)C1CCCNC1

BDBM50334860

COC\C=C\c1c(N)n2ncc(-c3cnn(C)c3)c2nc1C1CCCNC1

BDBM50334857

CC#Cc1c(N)n2ncc(-c3cnn(C)c3)c2nc1C1CCCNC1

BDBM50334858

Cn1cc(cn1)-c1cnn2c(N)c(C3CC3)c(nc12)C1CCCNC1

BDBM50334866

Cn1cc(cn1)-c1cnn2c(N)c(-c3cccnc3)c(nc12)C1CCCNC1

BDBM50334867

Cn1cc(cn1)-c1cnn2c(N)c(-c3ccncc3)c(nc12)C1CCCNC1

BDBM50334864

Cn1cc(cn1)-c1cnn2c(N)c(-c3ccsc3)c(nc12)C1CCCNC1

BDBM50334865

Cn1cc(cn1)-c1cnn2c(N)c(-c3ccoc3)c(nc12)C1CCCNC1

BDBM50334872

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)-c1cccnc1

BDBM50334873

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)C1CCCCN1

BDBM50334870

Nc1c(Br)c(nc2c(cnn12)-c1ccoc1)C1CCCNC1

BDBM50334871

Cc1ncc(s1)-c1cnn2c(N)c(Br)c(nc12)C1CCCNC1

BDBM50334868

Cn1cc(cn1)-c1cnn2c(N)c(-c3cnn(C)c3)c(nc12)C1CCCNC1

BDBM50334869

Nc1c(Br)c(nc2c(cnn12)-c1cccnc1)C1CCCNC1

BDBM50334877

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)C1CCNC1

BDBM50334878

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(CCN)nc12

BDBM50334875

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)C1CNCCO1

BDBM50334876

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)C1CNCCS1

BDBM50334874

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)C1CCNCC1

BDBM50334848

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(CC3CCCNC3)nc12

BDBM50334849

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(C[C@H]3CCC[C@@H](N)C3)nc12 |r|

BDBM50334846

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(CC3CCNCC3)nc12

BDBM50334847

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(CC3CCNC3)nc12

BDBM50334852

Cc1cc(sn1)Nc2cc(nc3n2ncc3c4cnn(c4)C)[C@@H]5CCCNC5

BDBM50334853

Cn1cc(cn1)-c1cnn2c(N)c(Cl)c(nc12)C1CCCNC1

BDBM50334850

Nc1cc(nc2c(Br)cnn12)C1CCCNC1

BDBM50334851

Cn1cc(cn1)-c1cnn2c(N)cc(nc12)C1CCCNC1

BDBM50334891

Nc1cc(nc2c(cnn12)-c1cccs1)C1CCCNC1

BDBM50334890

Nc1cc(nc2c(cnn12)-c1ccsc1)C1CCCNC1

BDBM50334902

Cn1cc(cn1)-c1cnn2c(NCCO)cc(nc12)C1CCCNC1

BDBM50334901

Cn1cc(cn1)-c1cnn2c(NCc3ccccc3)cc(nc12)C1CCCNC1

BDBM50334900

Cn1cc(cn1)-c1cnn2c(NC3CCNCC3)cc(nc12)C1CCCNC1

BDBM50334913

Nc1cc(nc2c(Br)cnn12)-c1ccccc1

BDBM50334899

Cn1cc(cn1)-c1cnn2c(NC(C)(C)C)cc(nc12)C1CCCNC1

BDBM50334898

Cn1cc(cn1)-c1cnn2c(NC3CCCCC3)cc(nc12)C1CCCNC1

BDBM50334897

CCNc1cc(nc2c(cnn12)-c1cnn(C)c1)C1CCCNC1

BDBM50334896

CNc1cc(nc2c(cnn12)-c1cnn(C)c1)C1CCCNC1

BDBM50334895

Nc1cc(nc2c(cnn12)-c1ccns1)C1CCCNC1

BDBM50334894

Nc1cc(nc2c(cnn12)-c1cscn1)C1CCCNC1

BDBM50334893

Nc1cc(nc2c(cnn12)-c1cc[nH]n1)C1CCCNC1

BDBM50334892

Nc1cc(nc2c(cnn12)-c1ccoc1)C1CCCNC1

BDBM50334879

Nc1cc(nc2ccnn12)C1CCCNC1

BDBM50334910

Cn1cc(cn1)-c1cnn2c(Nc3ccccn3)cc(nc12)C1CCCNC1

BDBM50334909

Cn1cc(cn1)-c1cnn2c(Nc3nncs3)cc(nc12)C1CCCNC1

BDBM50334908

CCn1nccc1Nc1cc(nc2c(cnn12)-c1cnn(C)c1)C1CCCNC1

BDBM50334907

Cc1nc2cc(Nc3cc(nc4c(cnn34)-c3cnn(C)c3)C3CCCNC3)ccc2s1

BDBM50334906

Cn1cc(cn1)-c1cnn2c(Nc3ccc4OCOc4c3)cc(nc12)C1CCCNC1

BDBM50334905

CCOC(=O)c1ccc(Nc2cc(nc3c(cnn23)-c2cnn(C)c2)C2CCCNC2)cc1

BDBM50334904

Cn1cc(cn1)-c1cnn2c(Nc3ccccc3)cc(nc12)C1CCCNC1

BDBM50334903

Cn1cc(cn1)-c1cnn2c(NCc3cccnc3)cc(nc12)C1CCCNC1

BDBM50334889

Nc1cc(nc2c(cnn12)-c1cccnc1)C1CCCNC1

BDBM50334888

Nc1cc(nc2c(cnn12)-c1cnccn1)C1CCCNC1

BDBM50334887

Nc1cc(nc2c(cnn12)-c1cncnc1)C1CCCNC1

BDBM50334886

Nc1cc(nc2c(cnn12)-c1cccc(O)c1)C1CCCNC1

BDBM50334885

Nc1cc(nc2c(cnn12)-c1ccccc1)C1CCCNC1

BDBM50334884

C\C=C\c1cnn2c(N)cc(nc12)C1CCCNC1

BDBM50334883

CCc1cnn2c(N)cc(nc12)C1CCCNC1

BDBM50334882

Nc1cc(nc2c(cnn12)C#N)C1CCCNC1

BDBM50334881

CCOC(=O)c1cnn2c(N)cc(nc12)C1CCCNC1

BDBM50334880

CC#Cc1cnn2c(N)cc(nc12)C1CCCNC1

BDBM50334914

[O-][n+]1cccc(CNc2cc(nc3c(Br)cnn23)-c2ccccc2F)c1

BDBM50334912

Cc1cc(Nc2cc(nc3c(cnn23)-c2cnn(C)c2)C2CCCNC2)no1

BDBM50334911

Cn1cc(cn1)-c1cnn2c(Nc3nccs3)cc(nc12)C1CCCNC1

BDBM50335676

OCCCc1ccc2nc(nc(N[C@H]3CCNC3)c2c1)-c1ccccc1O |r|

BDBM50335669

CCOC(=O)[C@@H]1CNC[C@H]1Nc1nc(nc2ccccc12)-c1cc(F)ccc1O |r|

BDBM50335683

COCCOc1cc2nc(nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC)-c1cc(F)ccc1O |r|

BDBM50335660

Oc1ccc(cc1-c1nc(N[C@H]2CCNC2)c2ccccc2n1)C(F)(F)F |r|

BDBM50335685

COc1cc2nc(nc(N[C@@H]3CNC[C@H]3CO)c2cc1OC)-c1cc(F)ccc1O |r|

BDBM50335661

Oc1ccc(cc1-c1nc(N[C@H]2CCNC2)c2ccccc2n1)-c1cn[nH]c1 |r|

BDBM50335686

CC(C)(O)[C@@H]1CNC[C@H]1Nc1nc(nc2ccccc12)-c1cc(ccc1O)-c1cn[nH]c1 |r|

BDBM50335684

COc1cc2nc(nc(N[C@@H]3CNC[C@H]3C(C)(C)O)c2cc1OC)-c1cc(F)ccc1O |r|

BDBM50335687

CC(C)(O)[C@@H]1CNC[C@H]1Nc1nc(nc2ccccc12)-c1cc(ccc1O)-c1cc[nH]n1 |r|

BDBM50335677

OCCCc1ccc2c(N[C@H]3CCNC3)nc(nc2c1)-c1ccccc1O |r|

BDBM50335678

COc1cc2nc(nc(N[C@H]3CCNC3)c2cc1OC)-c1ccccc1O |r|

BDBM50335679

COCCOc1cc2nc(nc(N[C@H]3CCNC3)c2cc1OC)-c1ccccc1O |r|

BDBM50335680

COc1cc2nc(nc(N[C@H]3CCNC3)c2cc1OC)-c1cc(F)ccc1O |r|

BDBM50335656

Oc1ccc(F)cc1-c1nc(N[C@H]2CCNC2)c2ccccc2n1 |r|

BDBM50335662

Oc1ccc(cc1-c1nc(N[C@H]2CCNC2)c2ccccc2n1)-c1cc[nH]n1 |r|

BDBM50335681

COCCOc1ccc2c(N[C@H]3CCNC3)nc(nc2c1)-c1cc(F)ccc1O |r|

BDBM50335682

COCCOc1cc2nc(nc(N[C@H]3CCNC3)c2cc1OC)-c1cc(F)ccc1O |r|

BDBM50335648

Oc1ccccc1-c1nc(N[C@H]2CCNC2)c2ccccc2n1 |r|

BDBM50335673

COc1ccc2c(N[C@H]3CCNC3)nc(nc2c1)-c1ccccc1O |r|

BDBM50335674

COCCOc1ccc2nc(nc(N[C@H]3CCNC3)c2c1)-c1ccccc1O |r|

BDBM50335675

COCCOc1ccc2c(N[C@H]3CCNC3)nc(nc2c1)-c1ccccc1O |r|

BDBM50335664

COC(=O)[C@H]1C[C@@H](CN1)Nc1nc(nc2ccccc12)-c1ccccc1C |r|

BDBM50335665

CN(C)C(=O)[C@H]1C[C@@H](CN1)Nc1nc(nc2ccccc12)-c1ccccc1O |r|

BDBM50335666

CC(C)(O)[C@H]1C[C@@H](CN1)Nc1nc(nc2ccccc12)-c1cc(F)ccc1O |r|

BDBM50335667

OC[C@H]1C[C@@H](CN1)Nc1nc(nc2ccccc12)-c1cc(F)ccc1O |r|

BDBM50335668

CCOC(=O)[C@H]1CNC[C@@H]1Nc1nc(nc2ccccc12)-c1cc(F)ccc1O |r|

BDBM50335671

CC(C)(O)[C@@H]1CNC[C@H]1Nc1nc(nc2ccccc12)-c1cc(F)ccc1O |r|

BDBM50339006

Nc1n[nH]c2cc(ccc12)-c1ccnc(N)n1

BDBM50341519

CNc1cncc(n1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCC[C@H]2CN2CCCC2)c1 |r|

BDBM50343559

CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2ncc3CCc4c(nn(CCO)c4-c3n2)C(N)=O)c1

BDBM50346243

Oc1ccccc1C1CC(=NN1C(=O)c1ccco1)c1cccnc1 |c:10|

BDBM50348621

CSc1cn2c(cnc2c(Nc2cc(C)ns2)n1)-c1cn[nH]c1

BDBM50349877

CN1CCN(CC1)c1ccc(cc1)-c1cc2n(C)nc(N)c2c(=O)[nH]1

BDBM13530

CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1

BDBM25028

CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1

BDBM25617

CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F

BDBM25084

Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1

BDBM15138

Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|

BDBM21

CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br

BDBM50332294

Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4

BDBM4552

CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC

BDBM25013

CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|

BDBM12621

COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F

BDBM5446

COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C

BDBM26474

CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1

BDBM25628

OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O

BDBM4779

C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F

BDBM31093

OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|

BDBM50026612

CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5

BDBM5447

COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F

BDBM50184807

C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C

BDBM50132260

Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F

BDBM31085

CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1

BDBM24773

CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C

BDBM5655

CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|

BDBM32362

COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N

BDBM482158

CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl

BDBM50242737

Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|

BDBM50355494

COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1

BDBM50355496

O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1

BDBM50355500

C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|

BDBM50355499

CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|

BDBM50355504

COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|

BDBM50355495

Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C

BDBM25045

Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1

BDBM31088

Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12

BDBM5931

CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3

BDBM50355497

Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO

BDBM25919

Cc1cnc2c(NCCN)nc3ccc(C)cc3n12

BDBM26300

CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO

BDBM13336

CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1

BDBM13533

Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C

BDBM60665

CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C

BDBM50355501

c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4

BDBM50306682

C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|

BDBM50331096

COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1

BDBM4851

Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1

BDBM25117

CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4

BDBM15244

c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl

BDBM50128285

Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|

BDBM13534

CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1

BDBM27817

CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12

BDBM50322823

CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F

BDBM21079

Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1

BDBM25121

CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|

BDBM36409

CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12

BDBM24654

Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1

BDBM5445

CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1

BDBM50193995

C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|

BDBM50237710

Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F

BDBM50161957

CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C

BDBM60589

Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1

BDBM13216

Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl

BDBM6568

CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl

BDBM50309910

COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C

BDBM50357884

[O-][n+]1ccc2c(ccnc2c1-c1c(Cl)cccc1Cl)-c1ccc(F)cc1Cl |(12.75,-22.82,;14.08,-22.05,;14.08,-20.51,;15.41,-19.74,;16.75,-20.5,;18.08,-19.73,;19.42,-20.51,;19.42,-22.05,;18.08,-22.82,;16.74,-22.05,;15.42,-22.83,;15.42,-24.36,;14.08,-25.13,;12.75,-24.36,;14.09,-26.67,;15.42,-27.44,;16.76,-26.66,;16.75,-25.12,;18.08,-24.34,;18.08,-18.2,;19.42,-17.43,;19.42,-15.89,;18.08,-15.12,;18.08,-13.58,;16.75,-15.89,;16.75,-17.43,;15.42,-18.2,)|

BDBM50359359

CC(C)(C)c1cc(c(s1)NC(=O)Nc2cccc(c2Cl)Cl)C(=O)N3CCC(=O)N(CC3)CCN(C)C

BDBM50359798

NCCCNc1ncnc2[nH]c3cnccc3c12

BDBM50359799

NCCNc1ncnc2[nH]c3cnccc3c12

BDBM50359822

c1c(ncnc1Nc2cnc(cn2)C#N)NCC3CCNCC3

BDBM50359823

NCCCNc1cc(Nc2cnc(cn2)C#N)ncn1

BDBM50359824

NCCNc1cc(Nc2cnc(cn2)C#N)ncn1

BDBM50359825

NC1CCN(CC1)c1cc(Nc2cnc(cn2)C#N)ncn1

BDBM50359826

NCC1CCN(CC1)c1cc(Nc2cnc(cn2)C#N)ncn1

BDBM50359806

C[C@@H](CN(C)C)Oc1nc(Nc2cc3cccc(Cl)c3cn2)cnc1C#N |r|

BDBM50359827

NCC1CCN(CC1)c1cc(Nc2cnccn2)ncn1

BDBM50359807

C[C@H](CN(C)C)Oc1c(ncc(n1)Nc2cc3cccc(c3cn2)Cl)C#N

BDBM50359828

C(Nc1cc(Nc2cccnc2)ncn1)C1CCNCC1

BDBM50359796

NCC1CCN(CC1)c1ncnc2[nH]c3cnccc3c12

BDBM50359808

CC(CN(C)C)Oc1nc(Nc2cc3ccccc3cn2)cnc1C#N

BDBM50359797

NC1CCN(CC1)c1ncnc2[nH]c3cnccc3c12

BDBM50359809

CN(C)CCOc1nc(Nc2cc3cccc(Cl)c3cn2)cnc1C#N

BDBM50359810

Clc1cccc2cc(Nc3cnc(C#N)c(OC4CCCNC4)n3)ncc12

BDBM50359821

OCCCNc1cc(Nc2cnc(cn2)C#N)ncn1

BDBM50359800

NCC1CN(CCO1)c1ncnc2[nH]c3cc(ccc3c12)C#N

BDBM50359811

N#Cc1ncc(Nc2cc3ccccc3cn2)nc1OC1CCCNC1

BDBM50359801

c1cncc2c1c3c([nH]2)ncnc3N4CCO[C@@H](C4)CN

BDBM50359812

Clc1cccc2cc(Nc3cnc(C#N)c(OCC4CCNCC4)n3)ncc12

BDBM50359802

NC[C@H]1CN(CCO1)c1ncnc2[nH]c3ccccc3c12 |r|

BDBM50359813

Clc1cccc2cc(Nc3cnc(cn3)C#N)ncc12

BDBM50359803

NC[C@@H]1CN(CCO1)c1ncnc2[nH]c3ccccc3c12 |r|

BDBM50359814

N#Cc1ncc(Nc2cc3ccccc3cn2)nc1OCC1CCNCC1

BDBM50359815

N#Cc1cnc(Nc2cc3ccccc3cn2)cn1

BDBM50359804

c1cc(cc(c1)c2c[nH]c3c2c(ncn3)N4CCO[C@H](C4)CN)CO

BDBM50359816

N#Cc1ncc(Nc2cc3nc[nH]c3cn2)nc1OCC1CCNCC1

BDBM50359805

NCC1CN(CCO1)c1ncnc2[nH]cc(-c3cccc(c3)C#N)c12

BDBM50359817

N#Cc1cnc(Nc2cc3n(CC4CCNCC4)cnc3cn2)cn1

BDBM50359829

CCOC(=O)c1cnc2c(c1N3CCO[C@@H](C3)CN)c(n[nH]2)c4cccc(c4)C#N

BDBM50359818

N#Cc1cnc(Nc2cc3nc[nH]c3cn2)cn1

BDBM50359819

COC(=O)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50359820

N#Cc1cnc(Nc2cc(NCC3CCOCC3)ncn2)cn1

BDBM50360605

Fc1ccc2[nH]c(cc2c1)C(=O)N1C[C@]2(CCN(C2)C2CCCNC2)c2ccccc12 |r|

BDBM50360610

C[C@@H]1CCC(CN1)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccc(F)cc3[nH]1)c1ccccc21 |r|

BDBM50360609

C[C@@H]1CCC(CN1)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccccc3[nH]1)c1ccccc21 |r|

BDBM50360611

Fc1ccc2cc([nH]c2c1)C(=O)N1C[C@]2(CCN(C2)C2CCNC2)c2ccccc12 |r|

BDBM50361089

CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2nccc(n2)-c2cc(cn2C)C(N)=O)c1

BDBM50361088

CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2nccc(n2)-c2cc3c(CCNC3=O)n2C)c1

BDBM50363646

NC1=NC(=O)C(N1)=C1CCNC(=O)c2[nH]c(cc12)-c1ccccc1 |w:7.8,t:1|

BDBM50363647

COc1ccc(cc1)-c1cc2c([nH]1)C(=O)NCCC2=C1NC(N)=NC1=O |w:18.19,c:25|

BDBM50363650

COc1ccc(CNC2=NC(=O)C(N2)=C2CCNC(=O)c3[nH]c(cc23)-c2ccccc2)cc1 |w:14.15,t:8|

BDBM50363651

O=C1N=C(NC2CCCCC2)NC1=C1CCNC(=O)c2[nH]c(cc12)-c1ccccc1 |w:13.25,t:2|

BDBM50363648

COc1ccc(cc1OC)-c1cc2c([nH]1)C(=O)NCCC2=C1NC(N)=NC1=O |w:20.21,c:27|

BDBM50363653

CCCNC1=NC(=O)C(N1)=C1CCNC(=O)c2[nH]c(cc12)-c1ccccc1 |w:10.21,t:4|

BDBM50363649

O=C1N=C(NCc2ccccc2)NC1=C1CCNC(=O)c2[nH]c(cc12)-c1ccccc1 |w:14.16,t:2|

BDBM50363652

CCOC(=O)CCNC1=NC(=O)C(N1)=C1CCNC(=O)c2[nH]c(cc12)-c1ccccc1 |w:14.25,t:8|

BDBM50363654

CNC1=NC(=O)C(N1)=C1CCNC(=O)c2[nH]c(cc12)-c1ccccc1 |w:8.19,t:2|

BDBM50169959

c1ccc2c(c1)nc(s2)C(C#N)c3ccnc(n3)NCCc4cccnc4

BDBM50192071

C[C@@H]1C[C@H]2CN1CCn1[nH]c3c(cccc3c1=O)-c1nc3c(O2)cccc3[nH]c1=O

BDBM50222916

CN(C)Cc1ccc(Nc2cc(n[nH]2)-c2ccc(cc2)-c2ccc(O)cc2O)cc1

BDBM50222917

Oc1ccc(c(O)c1)-c1ccc(cc1)-c1cc(Nc2ccc(CN3CCCCC3)nc2)[nH]n1

BDBM50222914

Oc1ccc(c(O)c1)-c1ccc(cc1)-c1cc(Nc2ccc(CNC3CC3)cc2)[nH]n1

BDBM50222919

Oc1ccc(c(O)c1)-c1ccc(cc1)-c1cc(Nc2ccc(CNCC3CC3)nc2)[nH]n1

BDBM50222921

Oc1ccc(NC(=O)c2ccc3c(n[nH]c3c2)-c2nc3ccccc3[nH]2)c(O)c1

BDBM50222920

CCC(C)NCc1ccc(Nc2cc(n[nH]2)-c2ccc(cc2)-c2ccc(O)cc2O)cn1

BDBM50222918

Oc1ccc(c(O)c1)-c1ccc(cc1)-c1cc(Nc2ccccc2)[nH]n1

BDBM50222915

Oc1ccc(c(O)c1)-c1ccc(cc1)-c1cc(Nc2ccc(CN3CCCC3)cc2)[nH]n1

BDBM50222913

CC(C)NCc1ccc(Nc2cc(n[nH]2)-c2ccc(cc2)-c2ccc(O)cc2O)cc1

BDBM50222922

Oc1ccc(NC(=O)c2ccc3c(n[nH]c3c2)-c2nc3ccccc3[nH]2)cc1

BDBM50221581

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1CN[C@H]1CC[C@H](O)CC1 |wU:24.27,wD:27.31,(27.98,-42.37,;29.31,-41.61,;30.64,-42.38,;31.98,-41.61,;33.31,-42.37,;33.31,-43.91,;34.77,-44.38,;35.67,-43.15,;37.14,-42.68,;37.15,-41.14,;35.68,-40.65,;34.77,-41.9,;38.41,-43.59,;38.25,-45.14,;39.51,-46.05,;40.94,-45.41,;41.09,-43.85,;39.82,-42.94,;42.19,-46.3,;43.44,-47.2,;31.98,-44.68,;30.64,-43.91,;29.31,-44.68,;29.31,-46.22,;27.98,-46.99,;27.99,-48.52,;26.65,-49.29,;25.32,-48.52,;23.99,-49.28,;25.33,-46.98,;26.66,-46.22,)|

BDBM50221598

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OCc1cccnc1

BDBM50221575

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1O

BDBM50221606

O[C@H]1CC[C@@H](CC1)NC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)c1 |wU:4.7,wD:1.0,(5.03,-47.3,;6.37,-46.54,;7.7,-47.31,;9.04,-46.55,;9.02,-45.01,;7.7,-44.24,;6.37,-45,;10.36,-44.24,;10.36,-42.7,;9.02,-41.94,;11.69,-41.93,;11.69,-40.4,;13.02,-39.63,;14.35,-40.39,;14.35,-41.93,;15.82,-42.4,;16.72,-41.17,;18.19,-40.7,;18.2,-39.16,;16.73,-38.67,;15.82,-39.92,;19.46,-41.61,;19.29,-43.16,;20.56,-44.07,;21.98,-43.43,;22.14,-41.87,;20.87,-40.96,;23.23,-44.32,;24.48,-45.22,;13.03,-42.7,)|

BDBM50221577

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OC[C@H](O)CO

BDBM50221593

COc1cc2Cc3c([nH]nc3-c3ccc(cc3)C#N)-c2cc1OC

BDBM50221591

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OC(CO)CO

BDBM50221570

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OCCCN1CCOCC1

BDBM50221582

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OCCCN(C)C

BDBM50221576

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1cncnc1

BDBM50221572

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1cnccn1

BDBM50221602

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cn1)C#N

BDBM50221613

COc1cc-2c(Cc3c-2[nH]nc3-c2ccc(cc2)C#N)cc1C(=O)N[C@H]1CC[C@H](O)CC1 |wU:25.28,wD:28.32,(7.28,-42.32,;8.61,-41.55,;9.94,-42.32,;11.28,-41.55,;12.6,-42.31,;12.6,-43.85,;14.07,-44.32,;14.97,-43.09,;14.07,-41.84,;14.98,-40.59,;16.45,-41.08,;16.44,-42.62,;17.71,-43.53,;17.54,-45.08,;18.81,-45.99,;20.23,-45.35,;20.39,-43.79,;19.12,-42.88,;21.49,-46.24,;22.73,-47.14,;11.28,-44.62,;9.94,-43.85,;8.61,-44.62,;7.28,-43.85,;8.61,-46.16,;7.28,-46.93,;7.29,-48.47,;5.95,-49.23,;4.62,-48.46,;3.28,-49.22,;4.62,-46.92,;5.95,-46.16,)|

BDBM50221610

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(Cl)nc1Cl

BDBM50221614

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1cnc(Cl)c(Cl)c1

BDBM50221587

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OC1CCOCC1

BDBM50221617

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(nc1)C(F)(F)F

BDBM50221616

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(Br)nc1

BDBM50221574

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(F)nc1

BDBM50221609

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(Cl)nc1

BDBM50221580

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1cccnc1

BDBM50221611

COc1cc2Cc3c([nH]nc3-c2cc1OC)C#Cc1ccc(cc1)C(N)=O

BDBM50221599

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OCCc1ncsc1C

BDBM50221590

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1ccc(N)cc1

BDBM50221615

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1ccncc1

BDBM50221579

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(Br)cc1

BDBM50221603

COc1cc2Cc3c(n[nH]c3C#Cc3ccc(NC(N)=O)cc3)-c2cc1OC

BDBM50221600

COc1cc2Cc3c(n[nH]c3C#Cc3ccc(cc3)C#N)-c2cc1OC

BDBM50221583

COc1cc2Cc3c(n[nH]c3C#Cc3ccc(O)cc3)-c2cc1OC

BDBM50221612

COc1cc2Cc3c(n[nH]c3C#C)-c2cc1OC

BDBM50221592

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OC1CCOC1

BDBM50221596

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1ccc(o1)C(O)=O

BDBM50221601

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1cncn1C

BDBM50221619

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1cn(C)cn1

BDBM50221569

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OCC1CCOC1

BDBM50221605

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1c[nH]cn1

BDBM50221588

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1ccc[nH]1

BDBM50221571

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1Cn1ccnc1

BDBM50221608

COc1cc2Cc3c([nH]nc3-c3ccc(CN)cc3)-c2cc1OC

BDBM50221586

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)-c1cn[nH]c1

BDBM50221568

COc1cc2Cc3c([nH]nc3-c3ccc(CO)cc3)-c2cc1OC

BDBM50221604

COc1cc2Cc3c(n[nH]c3-c3ccc(cc3)N3CCC(O)CC3)-c2cc1OC

BDBM50221584

COc1cc2Cc3c(n[nH]c3-c2cc1OC)-c1ccc(cc1)C(O)=O

BDBM50221573

COc1cc2Cc3c(n[nH]c3-c3ccc(cc3)N3CCOCC3)-c2cc1OC

BDBM50221618

COc1cc2Cc3c(n[nH]c3-c3ccc(Nc4ccncc4)cc3)-c2cc1OC

BDBM50221597

CCc1ccc(CCOc2cc3Cc4c(n[nH]c4-c3cc2OC)-c2ccc(cc2)C#N)nc1

BDBM50221595

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OCc1ccccn1

BDBM50221620

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C#N)cc1OCc1ccncc1

BDBM50224894

Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1OCCN1CCOCC1)n3 |c:17|

BDBM50224916

OCCCOc1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:10|

BDBM50224891

Nc1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:6|

BDBM50224907

Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1OC(=O)N1CCC(CC1)N1CCCCC1)n3 |c:17|

BDBM50224905

Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1OCCCN1CCOCC1)n3 |c:17|

BDBM50224902

CN(C)c1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224901

Nc1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224912

Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1NC(=O)OCCN1CCOCC1)n3 |c:17|

BDBM50224889

CCN(CC)c1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224898

CN(C)c1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:8|

BDBM50224909

CNc1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224886

Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1OC(=O)N1CCC(CC1)N1CCCCC1)n3

BDBM50224884

Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1OCCCN1CCOCC1)n3

BDBM50224908

CCNc1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224899

OCCN(CCO)c1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:12|

BDBM50224903

Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1NC(=O)c1ccncc1)n3

BDBM50224885

CNc1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:7|

BDBM50224883

Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1NCc1cncs1)n3

BDBM50224896

Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1NCc1cncs1)n3 |c:17|

BDBM50224906

Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1NC(=O)OCCN1CCOCC1)n3

BDBM50224895

OCCNc1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:9|

BDBM50224900

Clc1cc(ccn1)C(=O)Nc1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224904

Clc1cc(ccn1)C(=O)Nc1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:16|

BDBM50224893

Oc1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224897

Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1NC(=O)c1ccncc1)n3 |c:17|

BDBM50224890

Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1N1CCOC1=O)n3

BDBM50224888

OCCOc1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224914

OP(O)(=O)c1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224915

COCCCOc1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224887

Oc1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:6|

BDBM50224910

C[C@H](N)C(=O)Nc1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:11|

BDBM50224911

OCCCOc1cc2OCCCCOc3nc(NC(=O)Nc2cc1Cl)cnc3C#N

BDBM50224913

Clc1cc2NC(=O)Nc3cnc(C#N)c(OC\C=C/COc2cc1N1CCOC1=O)n3 |c:17|

BDBM50224892

OCCOc1cc2OC\C=C/COc3nc(NC(=O)Nc2cc1Cl)cnc3C#N |c:9|

BDBM50232237

Cn1c2cc(CCCCN3CCOCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50374063

Cn1c2cc(c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl)S(=O)CCCN1CCCC1

BDBM50374067

Cn1c2cc(OCCCN3CCCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50374071

Oc1cc2c(cc1CCCCN1CCCC1)[nH]c1cc(c3C(=O)NC(=O)c3c21)-c1ccccc1Cl

BDBM50374070

Cn1c2cc(CCCCN3CCCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50232238

CN(C)CCCCc1cc2n(C)c3cc(c4C(=O)NC(=O)c4c3c2cc1O)-c1ccccc1Cl

BDBM50374065

OCCn1c2cc(OCCCN3CCCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50374066

CN(C)CCCOc1cc2n(CCO)c3cc(c4C(=O)NC(=O)c4c3c2cc1O)-c1ccccc1Cl

BDBM50232227

OCCn1c2cc(OCCCN3CCOCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50374062

Cn1c2cc(c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl)S(=O)(=O)CCCN1CCCC1

BDBM50232240

CN(C)CCCCc1cc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2cc1O)-c1ccccc1Cl

BDBM50374061

Cn1c2cc(c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl)S(=O)(=O)NCCN1CCCC1

BDBM50374064

Cn1c2cc(SCCCN3CCCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50374069

OCCn1c2cc(CCCCN3CCCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50232235

OCCn1c2cc(CCCCN3CCOCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50374068

Oc1cc2c(cc1OCCCN1CCCC1)[nH]c1cc(c3C(=O)NC(=O)c3c21)-c1ccccc1Cl

BDBM50374060

Cn1c2cc(C(=O)NCCN3CCCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50232233

Oc1cc2c(cc1OCCCN1CCOCC1)[nH]c1cc(c3C(=O)NC(=O)c3c21)-c1ccccc1Cl

BDBM50232232

CN(C)CCCOc1cc2n(C)c3cc(c4C(=O)NC(=O)c4c3c2cc1O)-c1ccccc1Cl

BDBM50232242

CN(C)CCCOc1cc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2cc1O)-c1ccccc1Cl

BDBM50232239

Oc1cc2c(cc1CCCCN1CCOCC1)[nH]c1cc(c3C(=O)NC(=O)c3c21)-c1ccccc1Cl

BDBM50232230

Cn1c2cc(OCCCN3CCOCC3)c(O)cc2c2c3C(=O)NC(=O)c3c(cc12)-c1ccccc1Cl

BDBM50375284

COc1cc2NC(=O)c3ccc(cc3Nc2cc1OCCN1CCOCC1)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375279

COc1cc2NC(=O)c3ccc(cc3Nc2cc1OCCO)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375269

COc1cc2Nc3cc(ccc3C(=O)Nc2cc1C(=O)N(C)C)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375273

COc1cc2NC(=O)c3ccc(cc3Nc2cc1CCCO)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375268

CCc1cc2NC(=O)c3ccc(cc3Nc2cc1OC)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375272

COc1cc2NC(=O)c3ccc(cc3Nc2cc1CCC(C)(C)O)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375274

COc1cc2NC(=O)c3ccc(cc3Nc2cc1CCc1ccncc1)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375275

COc1cc2NC(=O)c3ccc(cc3Nc2cc1OCC1CCCCO1)-c1ccc(c(OC)c1)[N+]([O-])=O |w:20.22|

BDBM50375276

COc1cc2NC(=O)c3ccc(cc3Nc2cc1OCc1ccccc1C(F)(F)F)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375278

COc1cc2NC(=O)c3ccc(cc3Nc2cc1OCCCN)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375277

COCCOCCOc1cc2Nc3cc(ccc3C(=O)Nc2cc1OC)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375282

COC(=O)c1cc2NC(=O)c3ccc(cc3Nc2cc1OC)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375267

COc1cc2NC(=O)c3ccc(cc3Nc2cc1O)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375271

COc1cc2NC(=O)c3ccc(cc3Nc2cc1CCC(=O)N(C)C)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375281

COc1cc2Nc3cc(ccc3C(=O)Nc2cc1CCCO)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375283

COC(=O)CCc1cc2Nc3cc(ccc3C(=O)Nc2cc1OC)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375270

COc1cc2NC(=O)c3ccc(cc3Nc2cc1CCO)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM91872

COc1cc2NC(=O)c3ccc(cc3Nc2cc1CC(C)(C)O)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375286

COc1cc2NC(=O)c3ccc(cc3Nc2cc1OCCCCO)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375280

COc1cc2Nc3cc(ccc3C(=O)Nc2cc1OC)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50375285

COc1cc2NC(=O)c3ccc(cc3Nc2cc1OCc1csc(C)n1)-c1ccc(c(OC)c1)[N+]([O-])=O

BDBM50376169

OC[C@H]1O[C@]2(Oc3ccc(O)c4c5C(=O)NC(=O)c5c5c6ccccc6n2c5c34)[C@H](O)[C@@H](O)[C@@H]1O

BDBM50376171

CC1(C)C(=O)c2c3C(=O)NC(=O)c3c3c([nH]c4ccccc34)c2C1=O

BDBM50376170

O=C1NCc2c1c1C(=O)NC(=O)c1c1c2[nH]c2ccccc12

BDBM50250137

COc1ccc(NC(=S)NN=C2C(=O)Nc3ccccc23)cc1 |w:10.9|

BDBM50307987

CC(C)(C)C(=O)N1Cc2c(NC(=O)c3cc(F)cc(F)c3)[nH]nc2C1(C)C

BDBM50378657

CC(C)CC(=O)Nc1[nH]nc2c1CN(C(=O)C1CCN(C)CC1)C2(C)C

BDBM50309194

COc1ccc(cc1OC)-c1cnc(N)c(c1)-c1ccc(cc1)C(N)=O

BDBM50309206

COc1cc(ccc1O)-c1cnc(N)c(c1)-c1ccc(cc1)C(N)=O

BDBM50309208

NC(=O)c1ccc(cc1)-c1cc(cnc1N)-c1ccc2OCCOc2c1

BDBM50309186

COCCOc1cccc(c1)-c1cnc(N)c(c1)-c1ccc(cc1)C(N)=O

BDBM50309187

NC(=O)CCNC(=O)c1cc(cnc1N)-c1ccsc1

BDBM50309184

NC(=O)c1ccc(cc1)-c1cc(cnc1N)-c1cccs1

BDBM50309209

NCCNC(=O)c1cc(cnc1N)-c1ccsc1

BDBM50309211

NC(=O)c1ccc(cc1)-c1cc(cnc1N)-c1ccsc1

BDBM50309178

NC(=O)c1ccc(cc1)-c1cc(cnc1N)-c1cccc2OCOc12

BDBM50309191

NCCNC(=O)c1cc(cnc1N)-c1scc2OCCOc12

BDBM50309190

CN(C)CCNC(=O)c1cc(cnc1N)-c1scc2OCCOc12

BDBM50309199

NC(=O)c1ccc(cc1)-c1cc(cnc1N)-c1cncs1

BDBM50309182

NC(=O)c1ccc(cc1)-c1cc(cnc1N)-c1scc2OCCOc12

BDBM50321672

Nc1cccc(c1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50321678

Cc1[nH]ncc1-c1cn2c(cnc2cn1)-c1cn[nH]c1

BDBM50321679

Nc1ccc(cc1)-c1cn2c(cnc2cn1)-c1cn[nH]c1

BDBM50321650

NCc1ccc(cc1)-c1cn2c(cnc2cn1)-c1cn[nH]c1

BDBM50321656

OCc1cccc(c1)-c1cn2c(cnc2cn1)-c1cn[nH]c1

BDBM50321676

c1n[nH]cc1-c1cnc2cnc(cn12)-c1ccncc1

BDBM50321651

OCc1ccc(cc1)-c1cn2c(cnc2cn1)-c1cn[nH]c1

BDBM50321671

NC(=O)c1cccc(c1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50321677

c1n[nH]cc1-c1cnc2cnc(cn12)-c1ccccc1

BDBM50321665

c1n[nH]cc1-c1cnc2ncc(-c3cccnc3)n2c1

BDBM50321649

c1n[nH]cc1-c1cnc2ncc(cn12)-c1cn[nH]c1

BDBM50321653

Cn1cc(cn1)-c1cnc2ncc(cn12)-c1cn[nH]c1

BDBM50321680

Nc1cccc(c1)-c1cn2c(cnc2cn1)-c1cn[nH]c1

BDBM50321654

c1cc(n[nH]1)-c1cnc2ncc(cn12)-c1cn[nH]c1

BDBM50321681

NCc1cccc(c1)-c1cn2c(cnc2cn1)-c1cn[nH]c1

BDBM50321664

c1nc2cnc(cn2c1-c1ccccc1)-c1cccnc1

BDBM50321657

c1nc2cnc(cn2c1-c1ccccc1)-c1ccncc1

BDBM50321659

Cn1cc(cn1)-c1cn2c(cnc2cn1)-c1ccccc1

BDBM50321667

OCc1cccc(c1)-c1cnc2ncc(cn12)-c1cn[nH]c1

BDBM50321660

C(c1ccccc1)n1cc(cn1)-c1cn2c(cnc2cn1)-c1ccccc1

BDBM50321668

C(N1CCOCC1)c1cccc(c1)-c1cnc2ncc(cn12)-c1cn[nH]c1

BDBM50321661

c1c[nH]c(c1)-c1cn2c(cnc2cn1)-c1ccccc1

BDBM50321669

C(N1CCOCC1)c1ccc(cc1)-c1cnc2ncc(cn12)-c1cn[nH]c1

BDBM50321662

c1nc2cnc(cn2c1-c1ccccc1)-c1c[nH]c2ccccc12

BDBM50321670

NC(=O)c1ccc(cc1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50321652

c1n[nH]cc1-c1cn2c(cnc2cn1)-c1ccccc1

BDBM50321666

O(c1ccccc1)c1ccc(cc1)-c1cnc2ncc(cn12)-c1cn[nH]c1

BDBM50321663

c1nc2cnc(cn2c1-c1ccccc1)-c1ccccn1

BDBM50321675

c1c[nH]c(c1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50321655

c1n[nH]cc1-c1cn2c(cnc2cn1)-c1c[nH]c2ccccc12

BDBM50321658

c1cc(n[nH]1)-c1cn2c(cnc2cn1)-c1ccccc1

BDBM50321673

Nc1ccc(cc1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50321674

OCc1ccc(cc1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM27344

O=C1NCCc2[nH]c(cc12)-c1ccncc1

BDBM50335188

Cc1cn2c(cnc2c(Nc2cc(CN3CCC(F)(F)C3)ns2)n1)-c1cn[nH]c1

BDBM50379575

Nc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccncc1

BDBM50379564

NCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379558

Nc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cn[nH]c1

BDBM50379563

Nc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379569

Nc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccoc1

BDBM50379551

Nc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccco1

BDBM50379584

NCCNCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379570

CN(C)CCNCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379580

CN(C)CCCNCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379565

OCCNCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379573

CN(C)Cc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379557

CN(C)CCNC(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1csc(CN2CCN(C)CC2)c1

BDBM50379583

Nc1cc2n[nH]c(=O)n2c2cc(Br)ccc12

BDBM50379568

CN(C)CCC(=O)Nc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379590

O=C(NCCN1CCOCC1)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379556

NC1CN(C1)C(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379589

OCCCNC(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379550

CNCc1cc(cs1)-c1ccc2c(cc3n[nH]c(=O)n3c2c1)C(=O)NCCN(C)C

BDBM50379578

Nc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cccs1

BDBM50379549

Nc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379548

CNCc1cc(cs1)-c1ccc2c(N)cc3n[nH]c(=O)n3c2c1

BDBM50379547

CN1CCN(Cc2cc(cs2)-c2ccc3c(N)cc4n[nH]c(=O)n4c3c2)CC1

BDBM50379555

CN(C)CCNC(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379574

OCCNC(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379545

OCCCNC(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379587

O[C@H]1CCN(C1)C(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1 |r|

BDBM50379561

OCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccco1

BDBM50379576

O=C(N[C@H]1CCCNC1)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1 |r|

BDBM50379579

OCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccoc1

BDBM50379586

O=C(N[C@H]1CCCNC1)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1 |r|

BDBM50379571

OCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccncc1

BDBM50379554

CNCCNC(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379588

NCC1CN(C1)C(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379567

CNCCNC(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379562

CN(C)CCNC(=O)c1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379581

OCCN1CCN(Cc2cc3n[nH]c(=O)n3c3cc(ccc23)-c2ccc[nH]2)CC1

BDBM50379572

OCCCNCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379566

O[C@H]1CCN(Cc2cc3n[nH]c(=O)n3c3cc(ccc23)-c2ccc[nH]2)C1 |r|

BDBM50379582

CN1CCN(Cc2cc3n[nH]c(=O)n3c3cc(ccc23)-c2ccc[nH]2)CC1

BDBM50379577

O=c1[nH]nc2cc(CN[C@@H]3CCCNC3)c3ccc(cc3n12)-c1ccc[nH]1 |r|

BDBM50379553

OCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379546

COCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccsc1

BDBM50379559

OCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cn[nH]c1

BDBM50379560

OCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1ccc[nH]1

BDBM50379585

O=c1[nH]nc2cc(Cn3ccnc3)c3ccc(cc3n12)-c1ccc[nH]1

BDBM50379552

OCc1cc2n[nH]c(=O)n2c2cc(ccc12)-c1cccs1

BDBM50379628

Cc1ccc(cn1)-c1cnc(Nc2cc(ccn2)N2CCNCC2)s1

BDBM50379652

NCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCC(F)(F)CC2)s1

BDBM50379626

Cc1ccc(cn1)-c1cnc(Nc2cccc(NCCCN)n2)s1

BDBM50379627

C1CN(CCN1)c1cccc(Nc2ncc(s2)-c2ccccc2)n1

BDBM50379639

Cc1ccc(NC(=O)c2cncc(c2)-c2cnc(Nc3cc(ccn3)N3CCOCC3)s2)s1

BDBM50379643

CC(=O)N1CCN(CC1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)C(=O)NCCN)c1

BDBM50379642

CS(=O)(=O)N1CCN(CC1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)C(=O)NCCN)c1

BDBM50379641

NCCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379640

CNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379621

Cc1ccc(cn1)-c1cnc(Nc2cccc(n2)N2CCNCC2)s1

BDBM50379644

NCCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(Cl)ccn2)s1

BDBM50379629

C1CN(CCN1)c1ccnc(Nc2ncc(s2)-c2cncnc2)c1

BDBM50379622

NCCNC(=O)c1cncc(c1)-c1cnc(Nc2ncccc2Cl)s1

BDBM50379630

C1CN(CCN1)c1cccc(Nc2ncc(s2)-c2cncnc2)n1

BDBM50379645

Cc1cccnc1Nc1ncc(s1)-c1cncc(c1)C(=O)NCCN

BDBM50379649

OCCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379637

OC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCNCC2)s1

BDBM50379624

FC(F)(F)CNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379633

C1CN(CCO1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)-c2cncnc2)c1

BDBM50379638

NC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379650

CS(=O)(=O)N1CCN(CC1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)C(=O)NCC(F)(F)F)c1

BDBM50379651

NCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCC(F)CC2)s1

BDBM50379623

C1CN(CCO1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)-c2cccnc2)c1

BDBM50379631

Brc1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCNCC2)s1

BDBM50379625

O=C(CN1CCN(CC1)c1ccnc(Nc2ncc(s2)-c2cccnc2)c1)N1CCOCC1

BDBM50379646

NCCNC(=O)c1cccc(c1)-c1cnc(Nc2cc(ccn2)N2CCC(F)(F)CC2)s1

BDBM50379634

C1CN(CCO1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)-n2ccnn2)c1

BDBM50379647

NCCCCc1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379632

C1CN(CCN1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)-c2cn[nH]c2)c1

BDBM50379635

Cn1cc(cn1)-c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCNCC2)s1

BDBM50379648

NCCNC(=O)c1cncc(c1)-c1cnc(Nc2ccccc2Cl)s1

BDBM50379636

C1CN(CCN1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)-c2cccnc2)c1

BDBM50379750

C1CN(CCN1)c1ccnc(Nc2ncc(s2)-c2ccccc2)c1

BDBM50379749

Cc1ccc(cn1)-c1cnc(Nc2cc(ccn2)N2CCN(CC2)S(C)(=O)=O)s1

BDBM50379754

Cc1ncc(cn1)-c1cnc(Nc2cc(ccn2)N2CCNCC2)s1

BDBM50379753

CS(=O)(=O)N1CCN(CC1)c1ccnc(Nc2ncc(s2)-c2cncnc2)c1

BDBM50379752

OCCNc1ccnc(Nc2ncc(s2)-c2cncnc2)c1

BDBM50379751

Brc1cccc(c1)-c1cnc(Nc2cc(ccn2)N2CCNCC2)s1

BDBM50379758

N#Cc1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCNCC2)s1

BDBM50379757

Cc1ncc(cn1)-c1cnc(Nc2cccc(NCCCN)n2)s1

BDBM50379756

Cc1ncc(cn1)-c1cnc(Nc2cccc(n2)N2CCNCC2)s1

BDBM50379755

Cc1ncc(cn1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379766

CNCCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379765

NCCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCC(F)(F)CC2)s1

BDBM50379770

NCCC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379769

NCCCc1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379768

NC\C=C\c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379767

NCCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(CN3CCOCC3)ccn2)s1

BDBM50379760

OCC#Cc1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379759

N#Cc1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379762

C1CN(CCO1)c1ccnc(Nc2ncc(s2)-c2cncc(c2)-c2cn[nH]c2)c1

BDBM50379746

COc1ncc(cn1)-c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379761

COc1ncccc1-c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379747

OCC1CN(CCO1)c1ccnc(Nc2ncc(s2)-c2cccnc2)c1

BDBM50379764

NCCCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCOCC2)s1

BDBM50379763

NCCNC(=O)c1cncc(c1)-c1cnc(Nc2cc(ccn2)N2CCNCC2)s1

BDBM50379748

CC(=O)N1CCN(CC1)c1ccnc(Nc2ncc(s2)-c2ccc(C)nc2)c1

BDBM50380246

CSc1ccccc1Nc2c3c(c(ncn3)NCC4CC4)nc(n2)N5CCNCC5

BDBM50362169

Clc1ccc(cc1)-c1ccc(o1)C(=O)Nc1ccc(cc1)N1CCNCC1

BDBM50335179

Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cn[nH]c1

BDBM50381995

CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)NCc4cccs4)c3)sn2)C1

BDBM50381996

Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)Nc2cccc(F)c2F)c1

BDBM50381997

CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4ccncc4)c3)sn2)C1

BDBM50381998

CC1CCCN(Cc2cc(Nc3nc(C)cn4c(cnc34)-c3cnn(CC(=O)Nc4ccncc4F)c3)sn2)C1

BDBM50384674

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccccc1

BDBM50384675

COc1ccc(cc1)-c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50384649

c1ccc(c(c1)NC(=O)c2csc(n2)c3ccc4c(c3)CCO4)N5CCNCC5

BDBM50384678

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc2OCOc2c1

BDBM50384661

O=C(Nc1ccccc1C1CCNCC1)c1csc(n1)-c1ccc2OCCc2c1

BDBM50384660

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc2OCCCOc2c1

BDBM50384671

Cc1nc(sc1C(=O)Nc1ccccc1N1CCNCC1)-c1ccc2OCCc2c1

BDBM50384672

O=C(Nc1ccccc1N1CCNCC1)c1nc(cs1)-c1ccc2OCCc2c1

BDBM50384673

O=C(Nc1ccccc1N1CCNCC1)c1cc(on1)-c1ccc2OCOc2c1

BDBM50384650

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc(Oc2ccccc2)cc1

BDBM50384677

COc1ccc(cc1OC)-c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50384668

CN1CCN(CC1)c1ccccc1NC(=O)c1csc(n1)-c1ccc2OCCc2c1

BDBM50384669

CC(=O)N1CCN(CC1)c1ccccc1NC(=O)c1csc(n1)-c1ccc2OCCc2c1

BDBM50384670

O=C(Nc1ccccc1N1CCOCC1)c1csc(n1)-c1ccc2OCCc2c1

BDBM50384685

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc(s1)-c1cccs1

BDBM50384686

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc(s1)-c1ccccc1

BDBM50384687

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1cc[nH]n1

BDBM50384688

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1cn[nH]c1

BDBM50384665

O=C(Nc1ccccc1N1CCNC(=O)C1)c1csc(n1)-c1ccc2OCCc2c1

BDBM50384681

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1cc[nH]c1

BDBM50384666

C[C@@H]1CN(CCN1)c1ccccc1NC(=O)c1csc(n1)-c1ccc2OCCc2c1 |r|

BDBM50384682

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc[nH]1

BDBM50384667

C[C@H]1CN(CCN1)c1ccccc1NC(=O)c1csc(n1)-c1ccc2OCCc2c1 |r|

BDBM50384683

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccsc1

BDBM50384684

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1cccs1

BDBM50384662

O=C(Nc1ccccc1C1=CCNCC1)c1csc(n1)-c1ccc2OCCc2c1 |t:10|

BDBM50384663

CC1CNCCN1c1ccccc1NC(=O)c1csc(n1)-c1ccc2OCCc2c1

BDBM50384664

O=C(Nc1ccccc1N1CCNCC1=O)c1csc(n1)-c1ccc2OCCc2c1

BDBM50384651

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc2occc2c1

BDBM50384652

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc2[nH]ccc2c1

BDBM50384653

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc2sccc2c1

BDBM50384648

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1cc2ccccc2s1

BDBM50384679

CN(C)c1ccc(cc1)-c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50384680

CN(C)Cc1ccc(cc1)-c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50384657

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1csc2ccccc12

BDBM50384658

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)C#Cc1ccccc1

BDBM50384659

CC#Cc1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50384656

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1cncnc1

BDBM50384655

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccc(nc1)C#N

BDBM50384654

Cc1cc(Nc2nc(cn3c(cnc23)-c2cnn(C)c2)C2=CCCNC2)sn1 |t:23|

BDBM50384689

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1ccncc1

BDBM50384690

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-c1cccnc1

BDBM50384676

COc1ccc(cc1C)-c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50389241

Nc1ncnn2ccc(C(=O)Nc3ccc(NC(=O)Nc4cccc(F)c4)cc3)c12

BDBM50393329

CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1C

BDBM50393342

CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1F

BDBM50401285

CC(C)(C#N)Oc1cccc(c1Cl)C(=O)Nc2cc(ccc2F)N(C)c3ccc4c(n3)sc(n4)NC(=O)C5CC5

BDBM50401616

CNc1cc(Nc2cnc(C#N)c(O[C@@H]3CCN(C)C3)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401629

CNc1cc(Nc2cnc(C#N)c(O[C@@H]3CCNC3)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401628

CNc1cc(Nc2cnc(C#N)c(O[C@H]3CCNC3)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401630

CNc1cc(Nc2cnc(C#N)c(O[C@@H](C)CN(C)C)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401634

COC(=O)c1cnc(Nc2cnc(C#N)c(O[C@@H]3CCNC3)n2)cc1SC |r|

BDBM50401633

CNc1ccnc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)c1 |r|

BDBM50401632

CNc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1C#CC(C)(C)O |r|

BDBM50401631

CNc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1-c1cccc(F)c1 |r|

BDBM50401619

CNc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1C1CC1 |r|

BDBM50401618

CNc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1C#C |r|

BDBM50401621

CNc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1Cl |r|

BDBM50401620

CNc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1C(F)(F)F |r|

BDBM50401622

COC(=O)c1cnc(Nc2cnc(C#N)c(O[C@@H]3CCNC3)n2)cc1N(C)C |r|

BDBM50401635

COC(=O)c1cnc(Nc2cnc(C#N)c(O[C@@H]3CCNC3)n2)cc1OC |r|

BDBM50401627

COc1cc(Nc2cnc(C#N)c(O[C@@H]3CCNC3)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401626

COc1cc(Nc2cnc(C#N)c(O[C@@H]3CCN(C)C3)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401615

CNc1cc(Nc2cnc(C#N)c(O[C@H]3CCN(C)C3)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401623

CNc1cc(Nc2cnc(C#N)c(O[C@@H]3CCNC3)n2)ncc1C(=O)OC |r|

BDBM50401625

CSc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1-c1cnn(C)c1 |r|

BDBM50401624

CNc1cc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)n2)ncc1C(=O)OC |r|

BDBM50402020

CC(C)(C)Nc1c(Nc2ccnc(Nc3ccc(cc3)-c3ccncc3)n2)c(=O)c1=O

BDBM50414207

OC1CCN(C1)c1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM50414084

Clc1ccc2[nH]c(=O)c(-c3nc4ccccc4[nH]3)c(N[C@H]3C[N@@]4CC[C@H]3CC4)c2c1 |r,wU:22.23,wD:20.21,25.26,THB:19:20:23.24:27.26,(-3.27,-4.6,;-3.27,-3.06,;-4.61,-2.29,;-4.61,-.75,;-3.27,.02,;-3.27,1.56,;-1.94,2.33,;-1.94,3.87,;-.61,1.56,;.73,2.33,;.89,3.86,;2.4,4.18,;3.17,5.51,;4.71,5.51,;5.48,4.18,;4.71,2.84,;3.17,2.84,;2.13,1.7,;-.61,.02,;.73,-.75,;.73,-2.29,;-.56,-2.96,;.81,-3.65,;1.27,-5.29,;2.49,-4.57,;2.07,-2.99,;3.34,-1.89,;2.17,-2.24,;-1.94,-.75,;-1.94,-2.29,)|

BDBM50414211

OC(=O)c1ccc2C(=O)c3ccccc3S(=O)(=O)c2c1

BDBM50414087

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(cc3NC2=O)C(C)(C)C(O)=O)c1

BDBM91861

COc1cc2Cc3c(n[nH]c3-c2cc1OCC[NH+]1CCCCC1)-c1ccc(OCCC2CCC[NH+]2C)cc1

BDBM50414117

Cc1[nH]c(C=C2C(=O)NN=C2N)c(C)c1CCO |w:4.3,c:9|

BDBM91824

COc1cc(c(cc1NC(=O)Nc2cnccn2)Cl)OC

BDBM50414227

COc1cc(ccc1O)-c1ccc2c(Nc3ccc(cc3NC2=O)C(=O)NCCCN2CCCC2)c1

BDBM50414201

COc1ccc(Cl)cc1NC(=O)Nc1cnc(cn1)C#N

BDBM50414228

O=C1c2ccccc2S(=O)(=O)c2cc(ccc12)-c1nnn[nH]1

BDBM50414248

CC(C)(O)c1ccc2Nc3cc(Nc4ccnc(Nc5ccnc(Cl)c5)c4)ccc3C(=O)Nc2c1

BDBM50414076

NC(=O)c1cc2c(n[nH]c2s1)-c1cncc(c1)-c1cccnc1

BDBM91867

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cccc2cnccc12

BDBM50414219

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccccc2)cc1OCCCN1CCOCC1

BDBM50414205

COC(=O)CC=c1[nH][nH]c(=O)c1=Cc1c[nH]c2ncccc12 |w:5.4,12.13|

BDBM50414080

N#CC(=Cc1c[nH]c2ncccc12)c1cccnc1 |w:3.3|

BDBM50414073

OC1COc2cncc(NC(=O)Nc3cc(Cl)ccc3OCC1O)n2

BDBM50414075

N#Cc1ccc(cn1)-c1n[nH]c-2c1Cc1cc(OC3CCOCC3)ccc-21

BDBM50414081

Cc1cc(O)ccc1-c1ccc2\C(=C\c3ccc[nH]3)C(=O)Nc2c1

BDBM50414088

O=C1Nc2ccccc2C1=Cc1c[nH]c2ncccc12 |w:10.12|

BDBM50414086

CCc1cc-2c(Cc3c(n[nH]c-23)-c2cccnc2)cc1OC1CCOC1

BDBM50414150

COc1cccc(c1)-c1ccc2c(Nc3cc(OCc4ccncc4)c(OC)cc3NC2=O)c1

BDBM50414089

CCCCC(N)C(=O)Nc1ccc2C(=O)NC(=O)c2c1

BDBM50414206

COc1cc(ccc1C(=O)NCc1ccc(O)c(O)c1)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM15088

N[C@H](COc1cnc(Cl)c(\C=C\c2ccncc2)c1)Cc1c[nH]c2ccccc12 |r|

BDBM50414215

CC(C)(O)c1ccc2Nc3cc(Nc4ccncc4)ccc3C(=O)Nc2c1

BDBM50214562

COc1cc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)cc1OC(CO)CO

BDBM50414214

Cc1n[nH]c(C)c1-c1ccccc1

BDBM91857

COc1cc2Cc3c(n[nH]c3-c2cc1OCC[NH+]1CCCCC1)-c1ccc(cc1)-c1ccc(O)cc1

BDBM50414208

COc1cc2Cc3c(n[nH]c3-c2cc1OCCN1CCCCC1)-c1ccc(OCC(C)=O)cc1

BDBM91916

NC(=O)c1ccccc1-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50414095

Nc1cc2OC\C=C\CCOc3cncc(NC(=O)Nc2cc1Cl)n3 |t:6|

BDBM50414212

OCCCOc1cc(ccn1)-c1ccc2c(Nc3ccccc3NC2=O)c1

BDBM50414218

Brc1ccc2nc[nH]c(=O)c2c1

BDBM91877

Fc1cc(F)cc(Cn2cc(-c3ccc4c(Nc5ccc(CCOc6ccc(cc6)N6CCOCC6)cc5NC4=O)c3)c3ccncc23)c1

BDBM50414119

Oc1ccc(Nc2ccc3c(Nc4ccccc4NC3=O)c2)cc1

BDBM50414083

Nc1cc2cn[nH]c2cc1N

BDBM50414085

COc1cc2Cc3c(n[nH]c3-c3cccc(c3)-c3cccnc3)-c2cc1OC

BDBM50414093

Cc1n[nH]c2nccc(-c3ccccc3)c12

BDBM50414090

CSc1ncnc2[nH]ccc12

BDBM50414200

Clc1cccc(c1)-c1cc2cc(Cl)ncc2[nH]c1=O

BDBM50414094

O=c1[nH]cnc2scc(-c3cccs3)c12

BDBM50414204

COc1cc2NC(=O)c3ccc(Nc4cc(F)nc(F)c4)cc3Nc2cc1OCCCCO

BDBM15067

N[C@H](COc1cncc(c1)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12 |r|

BDBM50414213

Cc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2ccccc2[nH]1

BDBM50414202

Oc1ccc(CN=Nc2ccc3nnc(n3n2)C(F)(F)F)c(O)c1 |w:6.5|

BDBM50414096

COc1cc-2c(cc1OCCCN1CCOCC1)C(=O)c1c(n[nH]c-21)-c1ccccc1

BDBM50414092

CN(C1CCC(O)CC1)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccoc2)c1

BDBM50414151

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(CCOc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1

BDBM50414074

COc1cccc(c1)-c1ccc2c(Nc3ccc(CCC(=O)N(C)C)cc3NC2=O)c1

BDBM50414153

COC(=O)Cc1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1ccc(s1)S(N)(=O)=O

BDBM91878

COc1cc(ccc1C(O)c1nccs1)-c1ccc2c(Nc3ccc(CCOc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1

BDBM50414091

Cn1cc(-c2ccc3c(Nc4ccc(CCOc5ccc(cc5)N5CCOCC5)cc4NC3=O)c2)c2ccncc12

BDBM50414210

Oc1ccc(cc1)-c1ccc2Nc3ccsc3C(=O)Nc2c1

BDBM50414222

CN1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(F)cc2)c1

BDBM50414209

COc1cc(ccc1O)-c1ccc2c(n[nH]c2n1)-c1nc2ccccc2[nH]1

BDBM50414152

Clc1ncnc2[nH]cc(I)c12

BDBM50414221

Oc1ccc(cc1)-c1ccc2c(Nc3ccc(CCOc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1

BDBM50414225

OC1CC(COc2ccc(Cl)cc2NC(=O)Nc2cnc(cn2)C#N)CC1O

BDBM50402022

CC(Nc1c(Nc2ccncc2)c(=O)c1=O)C(C)(C)C

BDBM91879

Nc1nc2cccc(-c3ccc4c(Nc5ccc(CCOc6ccc(cc6)N6CCOCC6)cc5NC4=O)c3)c2o1

BDBM50414220

COc1cccc(c1)-c1ccc2c(Nc3cc(OCc4csc(C)n4)c(OC)cc3NC2=O)c1

BDBM50414118

O=c1[nH][nH]c2[nH]c(=O)cc(-c3ccccn3)c12

BDBM50414217

OCc1ccc2C(=O)c3ccccc3S(=O)(=O)c2c1

BDBM50414226

COc1cc(ccc1[N+]([O-])=O)-c1ccc2c(Nc3ccc(cc3NC2=O)C(C)(C)CO)c1

BDBM50414154

C=CCN1C(=O)NC(=O)C1=Cc1c[nH]c2ncccc12 |w:10.11|

BDBM50414216

COc1cc(ccc1O)-c1ccc2c(n[nH]c2c1)-c1nc2ccc(N)cc2[nH]1

BDBM50414079

O=C(NCCCN1CCCC1)c1ccc2Nc3cc(ccc3C(=O)Nc2c1)-c1cc[nH]c(=O)c1

BDBM50414078

CC1CCC(CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2cccc(NC(C)=O)c2)c1

BDBM50414229

Oc1cc2ccccc2cc1NC(=O)Nc1cnc(cn1)C#N

BDBM50414082

Clc1ccc(N2CCCC2)c(NC(=O)Nc2cnc(cn2)C#N)c1

BDBM50414077

Cc1n[nH]c2sc3c(nc([nH]c3=O)-c3ccccc3)c12

BDBM50414097

COc1cc(ccc1-c1nc(C)no1)-c1ccc2c(Nc3ccc(C)cc3NC2=O)c1

BDBM50155148

CCN(CC)CCc1c(C)[nH]c(\C=C2/C(=O)NN=C2c2cnccn2)c1C |c:17|

BDBM50414203

COc1cccc(c1)-c1ccc2c(Nc3c(NC2=O)cccc3OCCN2CCOCC2)c1

BDBM50425830

Clc1ccc(Cl)c(CNc2ncc(C(=O)NCCCN3CCCC3=O)c(NC3CCCC3)n2)c1

BDBM50425831

COc1ccccc1CNc2ncc(c(n2)NC3CCCC3)C(=O)NCCCN4CCCC4=O

BDBM50425832

COc1ccc(CCNc2ncc(C(=O)NCCCN3CCCC3=O)c(NC3CCCC3)n2)cc1OC

BDBM50425829

c1cc(c(cc1Cl)CNc2ncc(c(n2)NC3CCCC3)C(=O)NCCCN4CCOC4=O)Cl

BDBM50425865

CN1CCC(CC1)NC(=O)c1cnc(NCc2cc(Cl)ccc2Cl)nc1NC1CCCC1

BDBM50425861

COc1ccccc1CNc1ncc(C(=O)NC2CCN(C)CC2)c(NC2CCCC2)n1

BDBM50425864

CN(C)C1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)ncc1C(=O)NC1CCN(C)CC1 |(47.36,-51.36,;48.9,-51.37,;49.67,-52.7,;49.68,-50.04,;48.92,-48.7,;49.7,-47.37,;51.23,-47.39,;52.01,-48.71,;51.22,-50.05,;52,-46.06,;51.24,-44.72,;49.7,-44.72,;48.94,-43.38,;47.4,-43.38,;46.63,-42.04,;47.41,-40.71,;46.64,-39.37,;47.41,-38.04,;45.1,-39.37,;44.33,-40.71,;42.79,-40.71,;45.1,-42.04,;49.7,-42.05,;51.24,-42.05,;52.01,-43.39,;53.55,-43.39,;54.32,-44.72,;54.32,-42.06,;55.86,-42.06,;56.62,-43.39,;58.16,-43.4,;58.94,-42.07,;60.48,-42.08,;58.17,-40.73,;56.62,-40.72,)|

BDBM50425863

CN1CCC(CC1)NC(=O)c1cnc(Nc2cc(Cl)cc(Cl)c2)nc1N[C@@H]1COC[C@H]1O |r|

BDBM50425862

CN(C)C1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)ncc1-c1cc(C)no1 |(9.04,-43.08,;10.39,-42.35,;11.7,-43.16,;10.44,-40.81,;9.13,-40,;9.18,-38.46,;10.53,-37.74,;11.85,-38.53,;11.8,-40.08,;10.57,-36.2,;9.81,-34.87,;8.27,-34.86,;7.51,-33.53,;5.96,-33.52,;5.2,-32.19,;5.97,-30.85,;5.21,-29.52,;5.98,-28.19,;3.67,-29.52,;2.89,-30.86,;1.35,-30.86,;3.66,-32.19,;8.27,-32.2,;9.8,-32.19,;10.58,-33.53,;12.11,-33.53,;12.6,-34.99,;14.14,-34.99,;15.06,-36.23,;14.61,-33.52,;13.35,-32.62,)|

BDBM50429477

FC(F)(F)c1cc(NC(=O)Nc2ccc(Oc3ncnc4n[nH]cc34)cc2)ccc1Cl

BDBM50429867

Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1)S(C)(=O)=O

BDBM50110208

NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1

BDBM6866

c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F

BDBM7533

CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|

BDBM13531

Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1

BDBM31340

COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1

BDBM50329427

NC(=O)c1cc([nH]c1-c1ccccc1)-c1ccnc(N)n1

BDBM50030881

CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)CN3CC[C@H](C3)C(=O)Nc4ccc(c(c4)Cl)O

BDBM50035709

CN1CCN(CC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50035710

CN1CCN(CC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)C(O)=O

BDBM50035711

CN1CCN(CC1)c1ccc(cc1)-c1cnc2[nH]c3ccc(nc3c2c1)C#N

BDBM50035712

CN1CCN(CC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)C(N)=O

BDBM50035713

CN1CCN(CC1)c1ccc(cc1)-c1cnc(N)c(n1)-c1ccc(cc1)C(O)=O

BDBM50035714

CN1CCN(CC1)c1ccc(cc1)-c1cncc(n1)-c1ccc2c(c1)[nH][nH]c2=O

BDBM50035715

CN1CCN(CC1)c1ccc(cc1)-c1cncc(n1)-c1ccc(cc1)C(=O)NS(C)(=O)=O

BDBM50035716

CN1CCN(CC1)c1ccc(cc1)-c1cncc(n1)-c1ccc(cc1)-c1nnn[nH]1

BDBM50035717

CN1CCN(CC1)c1ccc(cc1)-c1cncc(n1)-c1ccc(cc1)S(N)(=O)=O

BDBM50035718

CN1CCN(CC1)c1ccc(cc1)-c1cncc(n1)-c1ccc(cc1)C#N

BDBM50035720

CN1CCN(CC1)c1ccc(cc1)-c1cncc(n1)-c1ccc(cc1)C(N)=O

BDBM50035721

CN1CCN(CC1)c1ccc(cc1)-c1cncc(c1)-c1ccc(cc1)C(O)=O

BDBM50035788

CN1CCN(CC1)c1ccc(cc1)-c1cncc(n1)-c1ccc(cc1)C(O)=O

BDBM50035792

Cn1cc(cn1)-c1cncc(n1)-c1ccc(cc1)C(O)=O

BDBM50035803

COc1ccc(cc1)-c1cncc(n1)-c1ccc(cc1)C(O)=O

BDBM50035804

OC(=O)c1ccc(cc1)-c1cncc(n1)-c1cccc(O)c1

BDBM50043382

CN(C)S(=O)(=O)c1ccc(cc1)-c1cnc2ccc(nn12)-c1ccnc2[nH]ccc12

BDBM50043383

CN(C)S(=O)(=O)c1ccc(cc1)-c1cnn2CCN(Cc12)c1ccnc2[nH]ccc12

BDBM50043384

C[C@@H]1Cn2ncc(c2CN1c1ccnc2[nH]ccc12)-c1ccc(cc1)S(=O)(=O)N(C)C |r|

BDBM50043385

C[C@@H]1Cn2ncc(c2CN1c1ccnc2[nH]ccc12)-c1ccc(cc1)S(C)(=O)=O |r|

BDBM50043386

C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM50043387

C[C@@H]1Cn2ncc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM50043407

C[C@@H]1COCCN1c1nc(cc2n(C)cnc12)-c1c(F)ncc2[nH]ccc12 |r|

BDBM50043408

C[C@@H]1COCCN1c1nc(cc2n(C)cnc12)-c1cncc2[nH]ccc12 |r|

BDBM50043409

C[C@H](n1cnc2c(nc(cc12)-c1cncc2[nH]ccc12)N1CCOC[C@H]1C)S(C)(=O)=O |r|

BDBM50043410

C[C@@H]1COCCN1c1nc(cc2n(CS(C)(=O)=O)cnc12)-c1cccc2[nH]ccc12 |r|

BDBM50043403

CS(=O)(=O)Cn1cnc2c(nc(cc12)-c1cccc2[nH]ccc12)N1CCOCC1

BDBM50045370

Clc1ccc(cc1)-c1ccc(o1)-c1nccn1-c1ccc(cc1)N1CCNCC1

BDBM50048357

c1cc2c(c(c1)F)c3nc(nn3c(n2)Cc4ccc5c(c4)OCO5)N

BDBM50048362

Nc1nc2c3ccc(N)cc3nc(Cc3ccc4OCOc4c3)n2n1

BDBM50048364

OCCCNc1ccc2c3ncnn3c(nc2c1)-c1ccc2OCOc2c1

BDBM50048365

c1cc2c(cc1Cc3nc4cc(ccc4c5n3nc(n5)N)NCCO)OCO2

BDBM50048374

CN1CCN(CC1)c1cc(F)c2c3nc(N)nn3c(Cc3ccc4OCOc4c3)nc2c1

BDBM50053230

O=c1[nH]c2ccsc2c(NC2CCNC2)c1-c1nc2ccccc2[nH]1

BDBM50053231

O=c1[nH]c2ccsc2c(NC2CCCNC2)c1-c1nc2ccccc2[nH]1

BDBM50053232

Cc1cc2c(NC3CCNC3)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1

BDBM50053233

Cc1cc2c(NC3CCCNC3)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1

BDBM50053234

COc1ccc2[nH]c(nc2c1)-c1c(NC2CN3CCC2CC3)c2cc(Cl)sc2[nH]c1=O |(4.33,-25.42,;5.88,-25.42,;6.65,-24.08,;5.88,-22.74,;6.65,-21.41,;8.18,-21.41,;9.22,-20.26,;10.63,-20.89,;10.47,-22.43,;8.96,-22.74,;8.18,-24.08,;11.97,-20.12,;13.3,-20.89,;13.3,-22.44,;14.63,-23.2,;14.63,-24.74,;15.96,-25.51,;17.29,-24.74,;17.29,-23.2,;15.96,-22.43,;15.15,-23.8,;16.74,-23.8,;14.63,-20.12,;16.1,-20.6,;17.01,-19.35,;18.55,-19.35,;16.1,-18.11,;14.63,-18.58,;13.3,-17.81,;11.97,-18.58,;10.63,-17.81,)|

BDBM50053235

COc1ccc2[nH]c(nc2c1)-c1c(N[C@H]2CCCNC2)c2cc(Cl)sc2[nH]c1=O |r|

BDBM50053236

Brc1cc2c(NC3CCNC3)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1

BDBM50053238

Brc1cc2c(NC3CCCNC3)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1

BDBM50053239

Clc1cc2c(NC3CN4CCC3CC4)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1 |(4.23,-18.7,;5.76,-18.7,;6.67,-17.45,;8.14,-17.93,;9.47,-17.17,;9.47,-15.63,;8.14,-14.86,;8.14,-13.33,;6.81,-12.56,;5.47,-13.32,;5.47,-14.86,;6.8,-15.64,;7.59,-13.93,;6,-13.93,;10.8,-17.93,;12.12,-17.17,;12.29,-15.63,;13.8,-15.32,;14.56,-13.99,;16.1,-13.99,;16.86,-15.32,;16.1,-16.65,;14.56,-16.65,;13.53,-17.79,;10.8,-19.47,;12.12,-20.24,;9.47,-20.24,;8.14,-19.47,;6.67,-19.95,)|

BDBM50053241

Clc1cc2c(NC3CCNC3)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1

BDBM50053242

Clc1cc2c(N[C@H]3CCCNC3)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1 |r|

BDBM50053243

Clc1cc2c(NC3CCCNC3)c(-c3nc4ccccc4[nH]3)c(=O)[nH]c2s1

BDBM50053244

O=c1[nH]c2sccc2c(N2CCOCC2)c1-c1nc2ccccc2[nH]1

BDBM50053245

O=c1[nH]c2sccc2c(N2CCCCC2)c1-c1nc2ccccc2[nH]1

BDBM50053246

OCC1CCN(CC1)c1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2sccc12

BDBM50053247

OCCNc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2sccc12

BDBM50053248

COC(=O)CCNc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2sccc12

BDBM50053249

O=c1[nH]c2sccc2c(NCCN2CCOCC2)c1-c1nc2ccccc2[nH]1

BDBM50053251

CN(C)CCNc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2sccc12

BDBM50053252

CNCCNc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2sccc12

BDBM50053253

NCCNc1c(-c2nc3ccccc3[nH]2)c(=O)[nH]c2sccc12

BDBM50053254

O=c1[nH]c2sccc2c(NCC2CCNCC2)c1-c1nc2ccccc2[nH]1

BDBM50053255

O=c1[nH]c2sccc2c(NC2CCCCC2)c1-c1nc2ccccc2[nH]1

BDBM50053256

O=c1[nH]c2sccc2c(NC2CN3CCC2CC3)c1-c1nc2ccccc2[nH]1 |(23.44,-23.73,;22.09,-23,;20.77,-23.8,;19.42,-23.07,;17.97,-23.59,;17.03,-22.37,;17.9,-21.1,;19.38,-21.53,;20.69,-20.72,;20.64,-19.19,;19.29,-18.45,;19.25,-16.91,;17.89,-16.18,;16.58,-16.99,;16.62,-18.53,;17.98,-19.26,;19.02,-17.66,;17.48,-17.66,;22.04,-21.46,;23.35,-20.65,;23.47,-19.11,;24.97,-18.75,;25.7,-17.4,;27.24,-17.35,;28.05,-18.66,;27.32,-20.02,;25.78,-20.06,;24.78,-21.24,)|

BDBM50053257

O=c1[nH]c2sccc2c(NC2CCNCC2)c1-c1nc2ccccc2[nH]1

BDBM50053258

O=c1[nH]c2sccc2c(NC2CCNC2)c1-c1nc2ccccc2[nH]1

BDBM50053259

O=c1[nH]c2sccc2c(N[C@H]2CCCNC2)c1-c1nc2ccccc2[nH]1 |r|

BDBM50053260

O=c1[nH]c2sccc2c(NC2CCCNC2)c1-c1nc2ccccc2[nH]1

BDBM50072280

S=C(Nc1ccccc1)Nc1nc(cc(-c2ccccc2)c1C#N)-c1ccccc1

BDBM50072281

N#Cc1c(\N=c2/sc(nn2-c2ccccc2)-c2ccccc2)nc(cc1-c1ccccc1)-c1ccccc1

BDBM50072303

CC(=O)c1nn(-c2ccccc2)\c(=N\c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)s1

BDBM50072304

CC(=O)c1nn(-c2ccc(C)cc2)\c(=N\c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)s1

BDBM50072305

COc1ccc(cc1)-n1nc(s\c1=N/c1nc(cc(-c2ccccc2)c1C#N)-c1ccccc1)C(C)=O

BDBM50072306

CC(=O)c1nn(-c2ccc(Cl)cc2)\c(=N\c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)s1

BDBM50072307

CCOC(=O)c1nn(-c2ccccc2)\c(=N\c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)s1

BDBM50072308

CCOC(=O)c1nn(-c2ccc(C)cc2)\c(=N\c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)s1

BDBM50072309

CCOC(=O)c1nn(-c2ccc(Cl)cc2)\c(=N\c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)s1

BDBM50072310

O=C(Nc1ccccc1)c1nn(-c2ccccc2)\c(=N\c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)s1

BDBM50072311

O=C1CS\C(=N/c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)N1c1ccccc1

BDBM50072312

N#Cc1c(\N=c2/scc(-c3ccccc3)n2-c2ccccc2)nc(cc1-c1ccccc1)-c1ccccc1

BDBM50072313

O=C1N(\C(S\C1=C1/SC(=NN1c1ccccc1)c1ccccc1)=N\c1nc(cc(-c2ccccc2)c1C#N)-c1ccccc1)c1ccccc1 |c:9|

BDBM50072314

CC(=O)C1=NN(\C(S1)=C1\S\C(=N/c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)N(C1=O)c1ccccc1)c1ccccc1 |t:3|

BDBM50072315

CCOC(=O)C1=NN(\C(S1)=C1\S\C(=N/c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)N(C1=O)c1ccccc1)c1ccccc1 |t:5|

BDBM50072316

O=C(Nc1ccccc1)C1=NN(\C(S1)=C1\S\C(=N/c2nc(cc(-c3ccccc3)c2C#N)-c2ccccc2)N(C1=O)c1ccccc1)c1ccccc1 |t:10|

BDBM50084464

CN1CCN(CC1)c2ccc(cc2)Nc3ncc(c(n3)NC[C@H]4CCCO4)Cl

BDBM50086441

CCn1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12

BDBM50091309

CCN1CCc2sc(cc2C1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091308

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnccc3c2c1

BDBM50091307

NC(=O)c1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCCCC2)cc1

BDBM50091306

CCNC(=O)c1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCCCC2)cc1

BDBM50091305

COc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCCCC2)cc1

BDBM50091304

OCc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCCCC2)cc1

BDBM50091303

Oc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCCCC2)cc1

BDBM50091302

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1cnco1

BDBM50091301

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1cncs1

BDBM50091300

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1nnco1

BDBM50091289

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1cnoc1

BDBM50091288

Cn1cc(cn1)-c1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCCCC2)cc1

BDBM50091287

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1cccnc1

BDBM50091286

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1ccncc1

BDBM50091285

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1cnccn1

BDBM50091284

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1ccnnc1

BDBM50091283

C(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)-c1cncnc1

BDBM50091282

N#Cc1cc2c(cn1)[nH]c1ncccc21

BDBM50091281

Brc1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091291

C[C@H]1C[C@@H](C)CN(Cc2ccc(cc2)-c2cnc3[nH]c4cnc(cc4c3c2)C#N)C1 |r|

BDBM50091290

CC1(C)CCCN(Cc2ccc(cc2)-c2cnc3[nH]c4cnc(cc4c3c2)C#N)C1

BDBM50091322

CC1(C)CCN(Cc2ccc(cc2)-c2cnc3[nH]c4cnc(cc4c3c2)C#N)CC1

BDBM50091295

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccncc1

BDBM50091294

CN1CCN(CC1)c1cccc(c1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091293

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCCCC2)cc1

BDBM50091292

C[C@H]1CCC[C@@H](C)N1Cc1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N |r|

BDBM50091298

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ncc[nH]1

BDBM50091297

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccccn1

BDBM50091296

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1cccnc1

BDBM50091273

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccoc1

BDBM50091272

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1cccs1

BDBM50091299

Cn1ccc(n1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091313

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1nc(CN2CCCCC2)cs1

BDBM50091311

CCN1CCc2cc(ccc2C1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091317

N#CC1CCN(Cc2ccc(cc2)-c2cnc3[nH]c4cnc(cc4c3c2)C#N)CC1

BDBM50091280

Oc1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091316

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCOCC2)cc1

BDBM50091279

CCNc1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091315

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCC3(COC3)CC2)cc1

BDBM50091278

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(cc1)N1CCOCC1

BDBM50091314

N#Cc1cc2c(cn1)[nH]c1ncc(cc21)-c1ccc(CN2CCCCC2)nc1

BDBM50091277

Oc1ccccc1-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091321

CC(C)(N1CCCCC1)c1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091276

CC(=O)Nc1cccc(c1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091320

OC1CCN(Cc2ccc(cc2)-c2cnc3[nH]c4cnc(cc4c3c2)C#N)CC1

BDBM50091275

OCc1ccc(cc1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091319

O[C@@H]1CCCN(Cc2ccc(cc2)-c2cnc3[nH]c4cnc(cc4c3c2)C#N)C1 |r|

BDBM50091274

OCc1cccc(c1)-c1cnc2[nH]c3cnc(cc3c2c1)C#N

BDBM50091318

FC1CCN(Cc2ccc(cc2)-c2cnc3[nH]c4cnc(cc4c3c2)C#N)CC1

BDBM50095952

NC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(C[C@@H]1F)c1ccc(cn1)C#N |r|

BDBM138348

c1c(cc(c2c1CN(C2=O)C3CCN(CC3)C4CCC(CC4)(F)F)C(=O)N)F

BDBM50123803

CN(C)CCCNC(=O)c1csc2nc(cn12)-c1ccc(NC(=O)Nc2cc(on2)C(C)(C)C)cc1

BDBM50135286

Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F

BDBM50166588

C[C@@H](N1c2cc(ccc2C(=O)NC1(C)C)-n1c2cccnc2[nH]c1=O)c1ccccc1 |r|

BDBM158154

CN1CCN(CC1)c2ccc(c(c2)NC3CCOCC3)C(=O)Nc4c5cc(ccc5[nH]n4)Cc6cc(cc(c6)F)F

BDBM50204290

Cn1cc(cn1)c2c3c(c(c(n2)N[C@@H]4CCCC[C@@H]4N)F)CNC3=O

BDBM50208911

CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|

BDBM50234990

CN(C)CCn1cc(cn1)-c1ccn2c(cnc2c1)-c1ccc(C(N)=O)c(OCc2cccc(F)c2)c1

BDBM50313013

Nc1nc(NCCNc2ncc(-c3ncc[nH]3)c(n2)-c2ccc(Cl)cc2Cl)ccc1[N+]([O-])=O

BDBM50325983

Cc1c[nH]c(n1)c2cnc(nc2c3ccc(cc3Cl)Cl)NCCNc4ccc(cn4)C#N

BDBM50243389

Nc1nc(NCCNc2ncc(c(n2)-c2ccc(Cl)cc2Cl)-n2ccnc2)ccc1[N+]([O-])=O

BDBM50254806

NC(=O)c1cnc(N[C@H]2CCCN[C@@H]2CCO)c2cc(sc12)-c1ccccc1 |r|

BDBM50254814

C[C@@H]1[C@H](CCCN1)Nc2c3cc(sc3c(cn2)C(=O)N)c4ccccc4

BDBM50255141

NC(=O)c1cnc(N(CCO)[C@H]2CCCNC2)c2cc(sc12)-c1ccccc1 |r|

BDBM50255155

CN([C@H]1CCCNC1)c1ncc(C(N)=O)c2sc(cc12)-c1ccccc1 |r|

BDBM50255163

NC(=O)c1ccc(N[C@H]2CCCNC2)c2cc([nH]c12)-c1cccc(F)c1 |r|

BDBM50255165

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cnn(Cc2ccccc2)c1 |r|

BDBM50254810

C[C@@H]1NCCC[C@@H]1Nc1ncc(C(N)=O)c2sc(cc12)-c1ccccc1 |r|

BDBM50255210

NC(=O)c1cnc(N[C@H]2CNCC[C@@H]2O)c2cc(sc12)-c1ccccc1 |r|

BDBM50255166

NC(=O)c1cnc(N(CCc2ccccc2)[C@H]2CCCNC2)c2cc(sc12)-c1ccccc1 |r|

BDBM50255144

CCN([C@H]1CCCNC1)c1ncc(C(N)=O)c2sc(cc12)-c1ccccc1 |r|

BDBM50255167

Cn1cc(cn1)-c1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50255168

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cn[nH]c1 |r|

BDBM50255173

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccs1 |r|

BDBM50255160

NC(=O)c1cnc(O[C@H]2CCCNC2)c2cc(sc12)-c1ccccc1 |r|

BDBM50255161

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(oc12)-c1ccccc1 |r|

BDBM50255162

NC(=O)c1ccc(N[C@H]2CCCNC2)c2cc([nH]c12)-c1ccc(Cl)cc1 |r|

BDBM50255164

c1ccc(cc1)c2cc3c(ccc(c3[nH]2)C(=O)N)N[C@H]4CCCNC4

BDBM50255177

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-n1ccnc1 |r|

BDBM50255178

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1ccsc1 |r|

BDBM50255209

NC(=O)c1cnc(N[C@H]2CCCNC2)c2sc(cc12)-c1ccccc1 |r|

BDBM50254801

C[C@@H]1CC[C@@H](CN1)Nc1ncc(C(N)=O)c2sc(cc12)-c1ccccc1 |r|

BDBM50255214

NC(=O)c1ccc(N[C@H]2CCCNC2)c2cc([nH]c12)-c1ccc(F)cc1 |r|

BDBM50254805

C[C@@H]1CC[C@H](Nc2ncc(C(N)=O)c3sc(cc23)-c2ccccc2)[C@H](C)N1 |r|

BDBM50255213

NC(=O)c1cnc(SC2CCCNC2)c2cc(sc12)-c1ccccc1

BDBM50255216

CN1CCC[C@@H](C1)Nc1ncc(C(N)=O)c2sc(cc12)-c1ccccc1 |r|

BDBM50255208

NC(=O)c1cnc(N[C@H]2CCCNC2)c2cc(sc12)-c1cccc(F)c1 |r|

BDBM50255234

Cc1cc2c(N[C@H]3CCCNC3)ncc(C(N)=O)c2s1 |r|

BDBM50255215

NC(=O)c1cnc(N[C@H]2CCCNC2)c2sc(cc12)-c1cccc(F)c1 |r|

BDBM50537742

C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

BDBM50259155

NC1=NC(=O)\C(N1)=C1/CCNC(=O)c2[nH]c(Br)cc12 |t:1|

BDBM50256044

NC1=NC(C(=O)N1)=C1CCNC(=O)c2[nH]c3ccccc3c12 |w:3.2,t:1|

BDBM50008923

CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O |r|

BDBM16944

N[C@H](COc1cncc(c1)-c1ccc2NC(=O)\C(=C/c3ccc[nH]3)c2c1)Cc1c[nH]c2ccccc12 |r|

BDBM50423654

CN[C@@H]1C[C@@H]2O[C@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|

BDBM50433476

COc1ccc2c(c1)C(=O)N(C2)c3nc(cs3)C(=O)Nc4cnccc4N5CCNCC5

BDBM50433477

COc1ccc2CN(C(=O)c2c1)c1nc(cs1)C(=O)Nc1cnc(C)cc1N1CCNCC1

BDBM50433478

COc1ccc2CN(C(=O)c2c1)c1nc(cs1)C(=O)Nc1cc(F)ccc1N1CCNCC1

BDBM50433479

O=C(Nc1cnccc1N1CCNCC1)c1csc(Nc2n[nH]c3ccccc23)n1

BDBM50433480

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)-n1ncc2ccccc12

BDBM50433481

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)N1Cc2ccccc2C1=O

BDBM50433482

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)N1Cc2ccccc2C1

BDBM50433483

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)-c1cc2ccccc2s1

BDBM50433484

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)-c1ccc2sccc2c1

BDBM50433485

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)-c1ccc2[nH]ccc2c1

BDBM50433486

COc1ccc(cc1)-c1cc(Nc2nc(cs2)C(=O)Nc2ccccc2N2CCNCC2)[nH]n1

BDBM50433487

O=C(Nc1ccccc1N1CCNCC1)c1csc(Nc2cc(n[nH]2)-c2ccccc2)n1

BDBM50433488

O=C(Nc1ccccc1N1CCNCC1)c1csc(Nc2n[nH]c3ccccc23)n1

BDBM50433489

COc1ccc2CN(C(=O)c2c1)c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50433490

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-n1ncc2ccccc12

BDBM50433491

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)N1Cc2ccccc2C1

BDBM50433492

COc1ccc2CN(C(=O)c2c1)c1nc(cs1)C(=O)Nc1cnc2ccccc2c1N1CCNCC1

BDBM50433493

COc1ccc2CN(C(=O)c2c1)c1nc(cs1)C(=O)Nc1ccnnc1N1CCNCC1

BDBM50433494

COc1ccc2CN(C(=O)c2c1)c1nc(cs1)C(=O)Nc1cncnc1N1CCNCC1

BDBM50433495

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)-c1ccc(Oc2ccccc2)cc1

BDBM50433496

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)-c1ccc2occc2c1

BDBM50433497

O=C(Nc1ncccc1N1CCNCC1)c1csc(n1)-c1ccc2OCCc2c1

BDBM50433498

O=C(Nc1cnccc1N1CCNCC1)c1csc(n1)-c1ccc2OCCc2c1

BDBM50433499

O=C(Nc1ccncc1N1CCNCC1)c1csc(n1)-c1ccc2OCCc2c1

BDBM50433500

O=C(Nc1cccnc1N1CCNCC1)c1csc(n1)-c1ccc2OCCc2c1

BDBM50433501

COc1ccc(cc1)-c1cc(N)n(n1)-c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50433502

Cn1nc(cc1Nc1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1)-c1ccccc1

BDBM50433503

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-n1nnc2ccccc12

BDBM50433504

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-n1cccn1

BDBM50433505

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)-n1ccnc1

BDBM50433506

Cc1nc2CN(Cc2s1)c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50433507

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)N1Cc2cn[nH]c2C1

BDBM50433508

Cc1ncc2CN(Cc2n1)c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50433509

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)N1Cc2ccncc2C1

BDBM50433510

O=C(Nc1ccccc1N1CCNCC1)c1csc(NC2Cc3ccccc3C2)n1

BDBM50433511

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)N1CCc2sccc2C1

BDBM50433512

COc1cc2CCN(Cc2cc1OC)c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50433513

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)N1CCc2nc[nH]c2C1

BDBM50433514

Fc1ccc(F)c2CN(CCc12)c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50433515

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)N1CCc2ccccc2C1

BDBM50433516

O=C(Nc1ccccc1N1CCNCC1)c1csc(n1)N1CCCc2ccccc12

BDBM50433517

CN(Cc1ccccc1)c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1

BDBM50433518

CN(c1nc(cs1)C(=O)Nc1ccccc1N1CCNCC1)c1ccccc1

BDBM50433519

O=C(Nc1ccccc1N1CCNCC1)c1csc(NCc2ccccc2)n1

BDBM50433520

O=C(Nc1ccccc1N1CCNCC1)c1csc(Nc2ccccc2)n1

BDBM50433758

NC(=O)c1cnc(N[C@H]2CCCNC2)c2nc(cn12)-c1ccc(Cl)cc1 |r|

BDBM50433759

NC(=O)c1cnc(NC2CCNCC2)c2nc(cn12)-c1ccc(Cl)cc1

BDBM50433760

NCCCNc1ncc(C(N)=O)n2cc(nc12)-c1ccc(Cl)cc1

BDBM50433763

c1cc(ccc1c2cn3c(n2)c(cnc3C(=O)N)N[C@H]4CCCNC4)Cl

BDBM50433771

NC(=O)c1cnc(NCC2CCCNC2)n2cc(nc12)-c1ccc(Cl)cc1

BDBM50433772

CN1CCC(CC1)Nc1ncc(C(N)=O)c2nc(cn12)-c1ccc(Cl)cc1

BDBM50433773

NC(=O)c1cnc(N[C@@H]2CCNC2)n2cc(nc12)-c1ccc(Cl)cc1 |r|

BDBM50433764

N[C@H]1CC[C@@H](CC1)Nc1ncc(C(N)=O)c2nc(cn12)-c1ccc(Cl)cc1 |r,wU:4.7,wD:1.0,(27.43,-20.12,;26.1,-19.35,;26.1,-17.81,;24.76,-17.03,;23.44,-17.81,;23.43,-19.35,;24.76,-20.12,;22.11,-17.04,;22.1,-15.5,;20.77,-14.73,;20.77,-13.19,;22.1,-12.42,;22.1,-10.88,;23.43,-10.1,;20.76,-10.11,;23.44,-13.18,;24.9,-12.7,;25.81,-13.94,;24.91,-15.19,;23.44,-14.72,;27.35,-13.93,;28.13,-15.26,;29.67,-15.25,;30.43,-13.91,;31.97,-13.9,;29.64,-12.58,;28.11,-12.59,)|

BDBM50433765

NC(=O)c1cnc(N[C@H]2CCCNC2)c2nc(cn12)-c1ccc(F)cc1 |r|

BDBM50433766

NC(=O)c1cnc(N[C@H]2CCCNC2)c2nc(cn12)-c1ccc2ccccc2c1 |r|

BDBM50433767

N[C@H]1CC[C@@H](CC1)Nc1ncc(C(N)=O)n2cc(nc12)-c1ccc(Cl)c(Cl)c1 |r,wU:4.7,wD:1.0,(10.68,-10.98,;12.01,-11.75,;12.02,-13.29,;13.35,-14.07,;14.69,-13.3,;14.68,-11.75,;13.35,-10.99,;16.02,-14.06,;16.03,-15.6,;14.7,-16.37,;14.7,-17.92,;16.03,-18.69,;16.03,-20.23,;14.7,-21,;17.37,-20.99,;17.37,-17.91,;18.84,-18.38,;19.74,-17.12,;18.82,-15.88,;17.36,-16.37,;21.28,-17.11,;22.03,-15.78,;23.57,-15.76,;24.35,-17.1,;25.89,-17.09,;23.59,-18.44,;24.37,-19.76,;22.05,-18.44,)|

BDBM50433768

N[C@H]1CC[C@H](CC1)Nc1ncc(C(N)=O)n2cc(nc12)-c1ccc(Cl)cc1 |r,wU:4.7,1.0,(10.68,-10.98,;12.01,-11.75,;13.35,-10.99,;14.68,-11.75,;14.69,-13.3,;13.35,-14.07,;12.02,-13.29,;16.02,-14.06,;16.03,-15.6,;14.7,-16.37,;14.7,-17.92,;16.03,-18.69,;16.03,-20.23,;14.7,-21,;17.37,-20.99,;17.37,-17.91,;18.84,-18.38,;19.74,-17.12,;18.82,-15.88,;17.36,-16.37,;21.28,-17.11,;22.05,-18.44,;23.59,-18.44,;24.35,-17.1,;25.89,-17.09,;23.57,-15.76,;22.03,-15.78,)|

BDBM50433761

N[C@H]1CC[C@@H](CC1)Nc1ncc(C(N)=O)n2cc(nc12)-c1ccc(Cl)cc1 |r,wU:4.7,wD:1.0,(5.4,-11.59,;6.74,-12.36,;6.74,-13.9,;8.07,-14.67,;9.41,-13.9,;9.4,-12.36,;8.07,-11.59,;10.74,-14.67,;10.75,-16.21,;9.42,-16.98,;9.42,-18.52,;10.75,-19.29,;10.75,-20.83,;9.42,-21.6,;12.09,-21.6,;12.09,-18.51,;13.56,-18.98,;14.46,-17.73,;13.55,-16.49,;12.08,-16.97,;16,-17.72,;16.77,-19.05,;18.31,-19.04,;19.07,-17.7,;20.61,-17.69,;18.29,-16.37,;16.75,-16.38,)|

BDBM50433769

CN[C@H]1CC[C@@H](CC1)Nc1ncc(C(N)=O)n2cc(nc12)-c1ccc(Cl)cc1 |r,wU:5.8,wD:2.1,(67.27,-1.42,;67.27,-2.96,;68.6,-3.73,;68.6,-5.27,;69.94,-6.05,;71.27,-5.27,;71.26,-3.73,;69.94,-2.96,;72.61,-6.04,;72.61,-7.58,;71.28,-8.35,;71.28,-9.89,;72.62,-10.66,;72.62,-12.2,;71.29,-12.97,;73.95,-12.97,;73.96,-9.89,;75.43,-10.35,;76.32,-9.1,;75.41,-7.86,;73.95,-8.34,;77.86,-9.09,;78.64,-10.42,;80.17,-10.41,;80.94,-9.07,;82.48,-9.06,;80.15,-7.74,;78.62,-7.76,)|

BDBM50434372

Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)[C@@H]1CCCNC1 |r|

BDBM50434485

Clc1ccc(cc1)-c1cc2Cc3cc(ccc3N(Cc3ccccc3-c3cccnc3)C(=O)c2o1)N1CCNCC1

BDBM50439463

C1CNCC2(C1)CCN(CC2)c1ncnc2nc[nH]c12

BDBM50439464

C1CCC2(CCN(CC2)c2ncnc3nc[nH]c23)NC1

BDBM50439466

O=S(=O)(N1CCCC2(CCCNC2)C1)c1cccc2cnccc12

BDBM50441090

CC(=O)Nc1cccc(c1)-c1cnc2[nH]nc(C)c2c1

BDBM50442672

C(Nc1ccn2ncc(-c3ccc4ccccc4c3)c2n1)c1cccnc1

BDBM50442673

Cc1nnc(o1)-c1cccc(c1)-c1cnn2ccc(NCCN)nc12

BDBM50442757

CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(CC2)C2CCC3(CC2)OCCO3)cc1

BDBM50442758

CC(C)Nc1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1

BDBM50442759

CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1

BDBM50442760

CN1CCC(CC1)NC(=O)c2cc(on2)c3c(cc(cc3Oc4ccc(cc4)[N+](=O)[O-])O)O

BDBM99471

c1cc(cc(c1)C(F)(F)F)CC(=O)Nc2cc(ccc2F)Oc3ccc4c(c3C#N)sc(n4)NC(=O)C5CC5

BDBM50379262

C1CN(CCO1)c1nc(Nc2ccccc2)nc2[nH]cnc12

BDBM50379263

COc1cccc(Nc2nc(N3CCOCC3)c3nc[nH]c3n2)c1

BDBM50379285

Cc1cccc(Nc2nc(N3CCOCC3)c3nc[nH]c3n2)c1

BDBM50389840

Clc1cccc(Nc2nc(N3CCOCC3)c3nc[nH]c3n2)c1

BDBM50391340

Fc1cccc(Nc2nc(N3CCOCC3)c3nc[nH]c3n2)c1

BDBM50393330

Fc1ccc(Nc2nc(N3CCOCC3)c3nc[nH]c3n2)cc1

BDBM50394673

C1CN(CCO1)c1nc(Nc2cccnc2)nc2[nH]cnc12

BDBM50398335

NC(=O)c1ccc(Nc2nc(N3CCOCC3)c3nc[nH]c3n2)cn1

BDBM50460767

CCN(CCO)Cc1cc(Nc2nc(C)cn3c(cnc23)-c2cn[nH]c2)sn1

BDBM50460772

Cc1cn2c(cnc2c(Nc2cc(ns2)C(NC(C)(C)C)c2ccccn2)n1)-c1cn[nH]c1

BDBM50460773

Cc1cn2c(cnc2c(Nc2cc(Cc3ccccn3)ns2)n1)-c1cn[nH]c1

BDBM50462709

O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1

BDBM50463479

CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1

BDBM50463483

O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12

BDBM50463484

CN1CCN(CCCOc2cccc(CC(=O)Nc3nc(cs3)-c3c[nH]c4ncccc34)c2)CC1

BDBM50464846

CCCC[C@@H](Sc1nc2ccccc2c(=O)n1-c1cccc(C)c1)C(=O)N1CCC[C@]2(CCCNC2)C1 |r|

BDBM50486715

c1n[nH]cc1-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50486716

c1cc(n[nH]1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50486717

C(N1CCOCC1)c1ccc(cc1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50486718

C(N1CCOCC1)c1cccc(c1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50486719

O(c1ccccc1)c1ccc(cc1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50486720

Cn1cc(cn1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50486721

c1n[nH]cc1-c1cn2c(cnc2cn1)-c1cccnc1

BDBM50486722

OCc1cccc(c1)-c1cnc2cnc(cn12)-c1cn[nH]c1

BDBM50499153

COc1cc2CCN(CC(=O)Nc3ccc4NC(=O)\C(=C/c5cnc[nH]5)c4c3)Cc2cc1OC

BDBM50499634

OC(=O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1

BDBM444543

CC(C)n1c(C)nc2c(F)cc(cc12)-c1nc(Nc2ccc3CN(CCN(C)C)CCc3n2)ncc1F

BDBM50505541

[H][C@]12C[C@@H](NCCOCCOCCOCCNC(=O)CCC3=[N+]4C(C=C3)=Cc3c(C)cc(C)n3[B-]4(F)F)[C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r,c:24,26,t:21|

BDBM50507645

CN1CCC(CC1)Nc1ccc(cc1)C(=O)Nc1cc(n[nH]1)-c1cc(cs1)C#N

BDBM50519662

CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1

BDBM50524299

N#Cc1ccc(Nc2ncc(cn2)-c2ccccc2OC2CCCNC2)cn1

BDBM50524301

CNc1nc(Nc2cnc(C#N)c(O[C@@H]3CCNC3)c2)ncc1-c1cnn(C)c1 |r|

BDBM50524302

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccco1

BDBM50524303

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccc(F)cc1

BDBM50524304

N#Cc1ncc(Nc2ncc(cn2)-c2ccccc2)cc1OC1CCCNC1

BDBM50524305

N#Cc1ncc(Nc2ncc(cn2)-c2cccs2)cc1OC1CCCNC1

BDBM50524306

N#Cc1ncc(Nc2ncc(cn2)-c2cccnc2)cc1OC1CCCNC1

BDBM50524307

COc1ccc(cc1)-c1cnc(Nc2cnc(C#N)c(OC3CCCNC3)c2)nc1

BDBM50524308

Fc1ccc(cc1)-c1cnc(Nc2cnc(C#N)c(OC3CCCNC3)c2)nc1

BDBM50524298

CNc1nc(Nc2cnc(C#N)c(O[C@@H]3CCCNC3)c2)ncc1-c1cnn(C)c1

BDBM50524309

Cc1cnc(NC(=O)Nc2cc(Br)c(C)cc2OC[C@@H]2CNCCO2)cn1 |r|

BDBM50524310

CNc1nc(Nc2cnc(C#N)c(O[C@H](C)CN(C)C)c2)ncc1-c1cnn(C)c1 |r|

BDBM50524311

CNc1nc(Nc2cnc(C#N)c(OCCN(C)C)c2)ncc1-c1cnn(C)c1

BDBM50524312

CNc1nc(Nc2cnc(C#N)c(OCC3CCNCC3)c2)ncc1-c1cnn(C)c1

BDBM50524313

CNc1nc(Nc2cnc(C#N)c(O[C@H]3CCCNC3)c2)ncc1-c1cnn(C)c1 |r|

BDBM50524314

CNc1nc(Nc2cnc(C#N)c(O[C@@H]3CCCNC3)c2)ncc1-c1cnn(C)c1 |r|

BDBM50524315

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccnn1C

BDBM50524316

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccc(s1)C(=O)OC

BDBM50524317

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1cccs1

BDBM50524318

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1cccnc1

BDBM50524319

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccc(OC)cc1OC

BDBM50524320

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccccc1F

BDBM50524321

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1cccc(F)c1

BDBM50524322

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccccc1

BDBM50524323

COc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1cnn(C)c1

BDBM50524324

Cn1cc(cn1)-c1cnc(Nc2cnc(C#N)c(OC3CCCNC3)c2)nc1

BDBM50524325

N#Cc1ncc(Nc2ncc(cn2)-c2ccco2)cc1OC1CCCNC1

BDBM50524326

N#Cc1ccc(Nc2ncc(cn2)-c2ccccc2)cn1

BDBM50524327

COc1cccc(c1)-c1cnc(Nc2cnc(C#N)c(OC3CCCNC3)c2)nc1

BDBM50524328

CNc1nc(Nc2cnc(C#N)c(OC3CCNCC3)c2)ncc1-c1cnn(C)c1

BDBM50524329

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccc(OC)cc1

BDBM50524330

N#Cc1ncc(Nc2ncc(cn2)-c2ccncc2)cc1OC1CCCNC1

BDBM50524331

Fc1cccc(c1)-c1cnc(Nc2cnc(C#N)c(OC3CCCNC3)c2)nc1

BDBM50524332

CNc1nc(Nc2cnc(C#N)c(O[C@@H](C)CN(C)C)c2)ncc1-c1cnn(C)c1 |r|

BDBM50524333

CNc1nc(Nc2cnc(C#N)c(OC3CCN(C)CC3)c2)ncc1-c1cnn(C)c1

BDBM50524334

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1nc(C)cs1

BDBM50524335

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1ccncc1

BDBM50524336

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1cccc(OC)c1

BDBM50524337

CNc1nc(Nc2cnc(C#N)c(OC3CCCNC3)c2)ncc1-c1cnn(C)c1

BDBM50526692

CC(C)(C)c1ccc(cc1[N+](=O)[O-])C(=O)NNC(=O)Nc2cccc3c2cccc3

BDBM50532181

COc1cc(ccc1OCc2ccc(cc2)C3CC3)C4CN(C4)C(=O)c5cc(ccn5)COC[C@H](CO)O

BDBM50536675

FC(F)(F)CNC(=O)c1cc(cs1)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCCCC2)cc1

BDBM50536681

Cc1sc(cc1-c1cnn2cc(Cl)cnc12)C(=O)N[C@@H]1[C@H](N)CCCC1(F)F |r|

BDBM50536678

Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)NCC(F)(F)F

BDBM50536679

Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)N[C@@H]1CCCC[C@@H]1N |r|

BDBM50543578

COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3c(C)ccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1

BDBM50553207

NC(=O)Cc1cccc(Nc2nc(C#C)c3nc[nH]c3n2)c1

BDBM50235350

C#Cc1nc(Nc2ccccc2)nc2[nH]cnc12

BDBM50235361

NS(=O)(=O)c1ccc(Nc2nc(C#C)c3nc[nH]c3n2)cc1

BDBM50555381

COC(=O)c1cnc(Nc2cnc(cn2)C#N)cc1NCCC1CCNCC1

BDBM50555382

COC(=O)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCN(C)CC1

BDBM50555383

COC(=O)c1cnc(Nc2cnc(cn2)C#N)cc1NC1CCN(C)CC1

BDBM50555384

[H][C@]12CC[C@]([H])(C[C@@H](C1)Nc1cc(Nc3cnc(cn3)C#N)ncc1C(=O)OC)N2 |r|

BDBM50555385

[H][C@]12CC[C@]([H])(CC(C1)Nc1cc(Nc3cnc(cn3)C#N)ncc1C(=O)OC)N2C |r|

BDBM50555386

[H][C@]12CC[C@]([H])(C[C@H](CNc3cc(Nc4cnc(cn4)C#N)ncc3C(=O)OC)C1)N2C |r|

BDBM50555387

COC(=O)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCCNC1

BDBM50555388

CN(C)C(=O)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50555389

CCNC(=O)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50555390

O=C(Nc1ccccc1)c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50555391

OCCCc1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50555392

OCC\C=C\c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50555393

CC(C)(O)C#Cc1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50555394

N#Cc1cnc(Nc2cc(NCC3CCNCC3)c(cn2)-c2ccccc2)cn1

BDBM50555395

Fc1cccc(c1)-c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50555396

Cc1noc(n1)-c1cnc(Nc2cnc(cn2)C#N)cc1NCC1CCNCC1

BDBM50555397

Fc1cccc(c1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555398

Clc1cccc(c1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555399

Fc1ccc(cc1F)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555400

Fc1cc(F)cc(c1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555401

Cc1cnc(s1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555402

Cn1cc(cn1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555403

Cn1cc2cc(ccc2n1)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555404

Cn1ncc2cc(ccc12)-c1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555405

OC1(CCCC1)C#Cc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM50555406

C#Cc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@@H]1CNCCO1 |r|

BDBM50555407

N#Cc1cnc(Nc2cc(NCC3CNCCO3)c(cn2)C#N)cn1

BDBM50555408

N#Cc1cnc(Nc2cc(NC[C@@H]3CNCCO3)c(cn2)C2CC2)cn1 |r|

BDBM50555409

Clc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50555410

Fc1cnc(Nc2cnc(cn2)C#N)cc1NC[C@H]1CNCCO1 |r|

BDBM50573869

Cn1nccc1-c1ccc(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(F)c1

BDBM50574286

CNc1nc(Nc2cnc(C#N)c(O[C@@H]3CCCNC3)c2)ncc1-c1cnn(c1)C(F)(F)F |r|

BDBM50574287

CNc1nc(Nc2cnc(C#N)c(O[C@@H]3CCCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574288

FC(F)(F)c1cnc(Nc2cnc(C#N)c(O[C@@H]3CCCNC3)c2)nc1 |r|

BDBM50574289

FC(F)(F)c1cnc(Nc2cnc(cn2)C#N)nc1NC[C@H]1CNCCO1 |r|

BDBM50574290

CNc1nc(Nc2cnc(C#N)c(O[C@H]3CCCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574291

CNc1nc(Nc2cnc(C#N)c(O[C@@H]3CCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574292

CNc1nc(Nc2cnc(C#N)c(O[C@H]3CCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574293

CNc1nc(Nc2cnc(C#N)c(OC3CCNCC3)c2)ncc1C(F)(F)F

BDBM50574294

CNc1nc(Nc2cnc(C#N)c(OC[C@@H]3CCCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574295

CNc1nc(Nc2cnc(C#N)c(OCC3CCNCC3)c2)ncc1C(F)(F)F

BDBM50574296

CNc1nc(Nc2cnc(C#N)c(OC3CCN(C)CC3)c2)ncc1C(F)(F)F

BDBM50574297

CNc1nc(Nc2cnc(C#N)c(OCCCN)c2)ncc1C(F)(F)F

BDBM50574298

CNc1nc(Nc2cnc(C#N)c(N[C@@H]3CCCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574299

CNc1nc(Nc2cnc(C#N)c(N[C@H]3CCCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574300

CNc1nc(Nc2cnc(C#N)c(N[C@@H]3CCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574301

CNc1nc(Nc2cnc(C#N)c(N[C@H]3CCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574302

CNc1nc(Nc2cnc(C#N)c(NC3CCNCC3)c2)ncc1C(F)(F)F

BDBM50574303

CNc1nc(Nc2cnc(C#N)c(NC[C@@H]3CCCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574304

CNc1nc(Nc2cnc(C#N)c(NC[C@@H]3CCNC3)c2)ncc1C(F)(F)F |r|

BDBM50574305

CNc1nc(Nc2cnc(C#N)c(NCC3CCCCN3)c2)ncc1C(F)(F)F

BDBM50574306

CNc1nc(Nc2cnc(C#N)c(N[C@@H]3CCN(C)C3)c2)ncc1C(F)(F)F |r|

BDBM50574307

CNc1nc(Nc2cnc(C#N)c(NC3CN4CCC3CC4)c2)ncc1C(F)(F)F |(25.15,-3.78,;23.81,-4.56,;23.81,-6.1,;25.16,-6.87,;25.16,-8.42,;26.5,-9.19,;27.84,-8.42,;29.17,-9.19,;30.51,-8.41,;30.51,-6.87,;31.83,-6.1,;33.16,-5.32,;29.15,-6.1,;29.14,-4.56,;30.48,-3.78,;30.47,-2.24,;31.81,-1.46,;33.15,-2.23,;33.15,-3.77,;31.82,-4.55,;32.56,-2.78,;31.03,-2.78,;27.82,-6.88,;23.82,-9.2,;22.48,-8.42,;22.48,-6.87,;21.15,-6.1,;20.37,-7.44,;19.61,-6.1,;21.15,-4.56,)|

BDBM50574308

CNc1nc(Nc2cnc(C#N)c(N[C@@H]3CC[C@H](N)CC3)c2)ncc1C(F)(F)F |r,wU:14.13,17.17,(43.57,-3.44,;42.23,-4.22,;42.23,-5.76,;43.58,-6.52,;43.58,-8.07,;44.92,-8.85,;46.25,-8.07,;47.58,-8.84,;48.91,-8.06,;48.91,-6.52,;50.23,-5.76,;51.56,-4.98,;47.56,-5.76,;47.56,-4.22,;48.89,-3.44,;50.22,-4.21,;51.55,-3.44,;51.55,-1.89,;52.88,-1.13,;50.21,-1.13,;48.87,-1.9,;46.24,-6.53,;42.24,-8.85,;40.9,-8.07,;40.9,-6.53,;39.58,-5.76,;38.8,-7.09,;38.04,-5.76,;39.58,-4.22,)|

BDBM50574309

CNc1nc(Nc2cnc(C#N)c(N[C@H]3CC[C@H](N)CC3)c2)ncc1C(F)(F)F |r,wU:14.13,wD:17.17,(62.87,-3.07,;61.53,-3.85,;61.54,-5.39,;62.88,-6.15,;62.89,-7.7,;64.22,-8.48,;65.56,-7.7,;66.89,-8.48,;68.22,-7.7,;68.22,-6.15,;69.55,-5.39,;70.87,-4.61,;66.87,-5.39,;66.87,-3.85,;68.2,-3.07,;68.18,-1.53,;69.52,-.77,;70.86,-1.52,;72.19,-.76,;70.86,-3.06,;69.54,-3.84,;65.55,-6.16,;61.54,-8.48,;60.21,-7.7,;60.21,-6.16,;58.88,-5.4,;58.1,-6.73,;57.34,-5.39,;58.88,-3.85,)|

BDBM50574310

CNc1nc(Nc2cnc(C#N)c(NCCCN)c2)ncc1C(F)(F)F

BDBM50574311

CNc1nc(Nc2cnc(C#N)c(NCCN)c2)ncc1C(F)(F)F

BDBM50574312

CNCCNc1cc(Nc2ncc(c(NC)n2)C(F)(F)F)cnc1C#N

BDBM50574313

CNc1nc(Nc2cnc(C#N)c(NCCN(C)C)c2)ncc1C(F)(F)F

BDBM50574314

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NC1CCNCC1

BDBM50574315

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NC1CCCNC1

BDBM50574316

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCC1CCNCC1

BDBM50574317

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCC1CCCNC1

BDBM50574318

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCC1CCCCN1

BDBM50574319

CN1CCC(CNc2nc(Nc3ccc(nc3)C#N)ncc2C(F)(F)F)CC1

BDBM50574320

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NC1CN2CCC1CC2 |(39.27,-44.42,;40.05,-43.08,;38.51,-43.07,;40.05,-41.54,;41.38,-43.85,;41.38,-45.4,;42.72,-46.17,;44.06,-45.4,;45.4,-46.17,;46.73,-45.39,;46.72,-43.85,;48.05,-43.08,;49.4,-43.85,;49.4,-45.39,;48.06,-46.17,;50.73,-43.08,;52.05,-42.3,;44.05,-43.84,;42.71,-43.08,;42.71,-41.54,;44.05,-40.76,;44.03,-39.22,;45.37,-38.44,;46.71,-39.21,;46.71,-40.76,;45.4,-41.49,;44.64,-40.16,;46.13,-39.77,)|

BDBM50574321

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NC1CC2CCC(C1)N2

BDBM50574322

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1N[C@@H]1CCCNC1 |r|

BDBM50574323

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1N[C@H]1CCCNC1 |r|

BDBM50574324

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NC[C@@H]1CCCNC1 |r|

BDBM50574325

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NC[C@H]1CCCNC1 |r|

BDBM50574326

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NC[C@H]1CNCCO1 |r|

BDBM50574327

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NC[C@@H]1CCNC1 |r|

BDBM50574328

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1N[C@H]1CCNC1 |r|

BDBM50574329

N[C@H]1CC[C@H](CC1)Nc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F |r,wU:4.7,1.0,(68.49,-1.57,;67.16,-2.33,;67.16,-3.88,;65.84,-4.65,;64.49,-3.88,;64.49,-2.34,;65.82,-1.57,;63.16,-4.66,;63.17,-6.2,;64.5,-6.95,;64.51,-8.5,;65.84,-9.28,;67.17,-8.5,;67.16,-6.96,;68.49,-6.2,;69.83,-6.96,;69.83,-8.5,;68.5,-9.28,;71.16,-6.19,;72.49,-5.41,;63.17,-9.28,;61.84,-8.51,;61.84,-6.96,;60.5,-6.2,;59.72,-7.53,;58.96,-6.19,;60.5,-4.66,)|

BDBM50574330

NCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574331

NCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574332

NCCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574333

CNCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574334

CN(C)CCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574335

CS(=O)(=O)CCNCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574336

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCCCNC=O

BDBM50574337

NC(=O)CCNCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574338

COCCNCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574339

OCCNCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574340

OCC(O)CNCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574341

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCCCNCCN1CCOCC1

BDBM50574342

CC(C)NCCCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574343

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCCCNC1CC1

BDBM50574344

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCCCNC1CCC1

BDBM50574345

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCCCNC1CCCC1

BDBM50574346

FC(F)(F)c1cnc(Nc2ccc(nc2)C#N)nc1NCCCNC1CCCCC1

BDBM50574347

CC(N)CCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574348

CNC(C)CCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574349

CC(C)(N)CCNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574350

CC(C)(CN)CNc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F

BDBM50574351

N[C@H]1CC[C@@H](CC1)Nc1nc(Nc2ccc(nc2)C#N)ncc1C(F)(F)F |r,wU:1.0,wD:4.7,(10.87,-17.84,;9.55,-18.61,;9.55,-20.15,;8.22,-20.93,;6.88,-20.15,;6.87,-18.61,;8.21,-17.84,;5.55,-20.93,;5.55,-22.47,;6.89,-23.23,;6.89,-24.78,;8.23,-25.55,;9.56,-24.77,;9.55,-23.24,;10.87,-22.47,;12.22,-23.23,;12.22,-24.77,;10.89,-25.55,;13.54,-22.47,;14.87,-21.69,;5.55,-25.56,;4.22,-24.78,;4.22,-23.23,;2.89,-22.47,;2.11,-23.8,;1.34,-22.46,;2.89,-20.93,)|

BDBM50578022

Cc1n[nH]c2ccc(cc12)-c1cc(N[C@@H](CO)c2ccccc2)cnc1Cl |r|

BDBM50592745

COCC1CN(C1)C1CCN(CC1)c1cc(OC)c(Nc2ncc(Br)c(Nc3ccc4OCCOc4c3P(C)(C)=O)n2)cc1C

BDBM50593027

CC1(C)c2oc3cc(ccc3c2C(=O)c2ccc(OCCN3CCOCC3)cc12)C#Cc1cc(OCC2CC2)ccn1

BDBM50525707

Cc1cc(cc(n1)C#Cc2ccc3c(c2)oc4c3C(=O)c5ccc(cc5C4(C)C)NS(=O)(=O)C)C(=O)NC(C)(C)C

BDBM50594898

CCOC(=O)NCCCOc1cc(F)cc(OC)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM50594899

COc1cc(F)cc(OCCCN)c1-c1cc(Nc2cnc(cn2)C#N)n[nH]1

BDBM50603678

CC(C)C[C@H](N)c1cc(C#N)c2cc(ccc2n1)-c1ccncc1 |r|

BDBM3096

CCN(CC)CCOc1ccc(cc1)Nc2ncc3c(n2)N(C(=O)C(=C3)c4c(cccc4Cl)Cl)C

BDBM50611755

C[C@@H]1CCN(C[C@@H]1n1ccc2cnc3[nH]ccc3c12)C(=O)CC#N |r|

BDBM50514649

Cn1cc(cn1)-c1[nH]c2cc(NC(=O)[C@H](N)C3CCCCC3)cc3c2c1cn[nH]c3=O |r|

BDBM50584949

Cn1ccc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2c1=O |r,wU:14.13,17.17,(14.79,-47.72,;13.46,-48.49,;13.46,-50.03,;12.13,-50.8,;10.79,-50.04,;9.46,-50.81,;8.13,-50.04,;6.8,-50.81,;5.46,-50.05,;4.13,-50.82,;2.79,-50.05,;2.79,-48.5,;4.12,-47.73,;4.12,-46.19,;5.45,-45.42,;6.78,-46.19,;8.11,-45.42,;8.11,-43.88,;9.45,-43.11,;6.78,-43.11,;5.44,-43.88,;5.46,-48.5,;1.46,-47.73,;1.46,-46.19,;.13,-48.5,;.12,-46.96,;8.12,-48.51,;9.45,-47.73,;10.79,-48.5,;12.12,-47.72,;12.12,-46.18,)|

BDBM50617917

Cn1cnc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2c1=O |r,wU:14.13,17.17,(7.33,-.77,;5.99,-1.54,;5.99,-3.06,;4.68,-3.84,;3.35,-3.07,;2.02,-3.85,;.68,-3.08,;-.66,-3.85,;-1.99,-3.08,;-3.32,-3.85,;-4.66,-3.08,;-4.66,-1.54,;-3.32,-.77,;-3.32,.77,;-1.99,1.54,;-.65,.77,;.68,1.54,;.68,3.08,;2.01,3.85,;-.65,3.85,;-1.99,3.08,;-1.99,-1.54,;-5.99,-.77,;-7.33,-1.54,;-5.99,.77,;-7.33,-0,;.68,-1.54,;2.01,-.77,;3.35,-1.54,;4.66,-.77,;4.66,.76,)|

BDBM50617918

Cn1ncc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2c1=O |r,wU:14.13,17.17,(7.33,-.77,;5.99,-1.54,;5.99,-3.06,;4.68,-3.84,;3.35,-3.07,;2.02,-3.85,;.68,-3.08,;-.66,-3.85,;-1.99,-3.08,;-3.32,-3.85,;-4.66,-3.08,;-4.66,-1.54,;-3.32,-.77,;-3.32,.77,;-1.99,1.54,;-.65,.77,;.68,1.54,;.68,3.08,;2.01,3.85,;-.65,3.85,;-1.99,3.08,;-1.99,-1.54,;-5.99,-.77,;-7.33,-1.54,;-5.99,.77,;-7.33,-0,;.68,-1.54,;2.01,-.77,;3.35,-1.54,;4.66,-.77,;4.66,.76,)|

BDBM50617919

CC(C)(O)Cn1cnc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2c1=O |r,wU:18.17,21.21,(8.66,-.77,;7.33,-1.54,;7.33,-3.08,;8.66,-2.31,;5.99,-.77,;4.66,-1.54,;4.66,-3.06,;3.35,-3.84,;2.01,-3.07,;.68,-3.85,;-.66,-3.08,;-1.99,-3.85,;-3.32,-3.08,;-4.66,-3.85,;-5.99,-3.08,;-5.99,-1.54,;-4.65,-.77,;-4.65,.77,;-3.32,1.54,;-1.99,.77,;-.65,1.54,;-.65,3.08,;.68,3.85,;-1.99,3.85,;-3.32,3.08,;-3.32,-1.54,;-7.33,-.77,;-8.66,-1.54,;-7.33,.77,;-8.66,-0,;-.66,-1.54,;.68,-.77,;2.01,-1.54,;3.33,-.77,;3.33,.77,)|

BDBM50617920

CC(C)(O)Cn1ncc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2c1=O |r,wU:18.17,21.21,(8.66,-.77,;7.33,-1.54,;7.33,-3.08,;8.66,-2.31,;5.99,-.77,;4.66,-1.54,;4.66,-3.06,;3.35,-3.84,;2.01,-3.07,;.68,-3.85,;-.66,-3.08,;-1.99,-3.85,;-3.32,-3.08,;-4.66,-3.85,;-5.99,-3.08,;-5.99,-1.54,;-4.65,-.77,;-4.65,.77,;-3.32,1.54,;-1.99,.77,;-.65,1.54,;-.65,3.08,;.68,3.85,;-1.99,3.85,;-3.32,3.08,;-3.32,-1.54,;-7.33,-.77,;-8.66,-1.54,;-7.33,.77,;-8.66,-0,;-.66,-1.54,;.68,-.77,;2.01,-1.54,;3.33,-.77,;3.33,.76,)|

BDBM50617921

CC(C)(O)Cn1ccc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2c1=O |r,wU:18.17,21.21,(8.66,-.77,;7.33,-1.54,;7.33,-3.08,;8.66,-2.31,;5.99,-.77,;4.66,-1.54,;4.66,-3.06,;3.35,-3.84,;2.01,-3.07,;.68,-3.85,;-.66,-3.08,;-1.99,-3.85,;-3.32,-3.08,;-4.66,-3.85,;-5.99,-3.08,;-5.99,-1.54,;-4.65,-.77,;-4.65,.77,;-3.32,1.54,;-1.99,.77,;-.65,1.54,;-.65,3.08,;.68,3.85,;-1.99,3.85,;-3.32,3.08,;-3.32,-1.54,;-7.33,-.77,;-8.66,-1.54,;-7.33,.77,;-8.66,-0,;-.66,-1.54,;.68,-.77,;2.01,-1.54,;3.33,-.77,;3.33,.77,)|

BDBM50617922

CN1CCc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1=O |r,wU:14.13,17.17,(7.33,-.77,;5.99,-1.54,;5.99,-3.06,;4.68,-3.84,;3.35,-3.07,;2.02,-3.85,;.68,-3.08,;-.66,-3.85,;-1.99,-3.08,;-3.32,-3.85,;-4.66,-3.08,;-4.66,-1.54,;-3.32,-.77,;-3.32,.77,;-1.99,1.54,;-.65,.77,;.68,1.54,;.68,3.08,;2.01,3.85,;-.65,3.85,;-1.99,3.08,;-1.99,-1.54,;-5.99,-.77,;-7.33,-1.54,;-5.99,.77,;-7.33,-0,;.68,-1.54,;2.01,-.77,;3.35,-1.54,;4.66,-.77,;4.66,.76,)|

BDBM50617923

CCn1ccc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2c1=O |r,wU:15.14,18.18,(7.33,.77,;7.33,-.77,;5.99,-1.54,;5.99,-3.06,;4.68,-3.84,;3.35,-3.07,;2.02,-3.85,;.68,-3.08,;-.66,-3.85,;-1.99,-3.08,;-3.32,-3.85,;-4.66,-3.08,;-4.66,-1.54,;-3.32,-.77,;-3.32,.77,;-1.99,1.54,;-.65,.77,;.68,1.54,;.68,3.08,;2.01,3.85,;-.65,3.85,;-1.99,3.08,;-1.99,-1.54,;-5.99,-.77,;-7.33,-1.54,;-5.99,.77,;-7.33,-0,;.68,-1.54,;2.01,-.77,;3.35,-1.54,;4.66,-.77,;4.66,.76,)|

BDBM50617924

CC(C)(O)Cn1ccc2cc(Nc3ncc(c(NC4CC5(CNC5)C4)n3)C(F)(F)F)ccc2c1=O

BDBM50617925

[H][C@]12CC[C@]([H])(C[C@@H](C1)Nc1nc(Nc3ccc4c(ccn(CC(C)(C)O)c4=O)c3)ncc1C(F)(F)F)N2 |r|

BDBM50617926

CC(=O)N1CCc2nc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:16.15,19.19,(7.99,-1.54,;6.66,-.77,;6.66,.77,;5.33,-1.54,;5.33,-3.06,;4.01,-3.84,;2.68,-3.07,;1.35,-3.85,;.01,-3.08,;-1.32,-3.85,;-2.66,-3.08,;-3.99,-3.85,;-5.33,-3.08,;-5.33,-1.54,;-3.99,-.77,;-3.99,.77,;-2.65,1.54,;-1.32,.77,;.01,1.54,;.01,3.08,;1.35,3.85,;-1.32,3.85,;-2.65,3.08,;-2.66,-1.54,;-6.66,-.77,;-7.99,-1.54,;-6.66,.77,;-7.99,-0,;.01,-1.54,;1.34,-.77,;2.68,-1.54,;4,-.77,)|

BDBM50617927

CC(C)(O)C(=O)N1CCc2nc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:19.18,22.22,(8.66,-.77,;7.33,-1.54,;7.33,-3.08,;8.66,-2.31,;5.99,-.77,;5.99,.77,;4.66,-1.54,;4.66,-3.06,;3.35,-3.84,;2.01,-3.07,;.68,-3.85,;-.66,-3.08,;-1.99,-3.85,;-3.32,-3.08,;-4.66,-3.85,;-5.99,-3.08,;-5.99,-1.54,;-4.65,-.77,;-4.65,.77,;-3.32,1.54,;-1.99,.77,;-.65,1.54,;-.65,3.08,;.68,3.85,;-1.99,3.85,;-3.32,3.08,;-3.32,-1.54,;-7.33,-.77,;-8.66,-1.54,;-7.33,.77,;-8.66,-0,;-.66,-1.54,;.68,-.77,;2.01,-1.54,;3.33,-.77,)|

BDBM50617928

CC(C)(O)CC(=O)N1CCc2nc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:20.19,23.23,(9.33,-1.54,;7.99,-.77,;7.99,.77,;9.33,0,;6.66,-1.54,;5.33,-.77,;5.33,.77,;3.99,-1.54,;3.99,-3.06,;2.68,-3.84,;1.34,-3.07,;.02,-3.85,;-1.32,-3.08,;-2.66,-3.85,;-3.99,-3.08,;-5.32,-3.85,;-6.66,-3.08,;-6.66,-1.54,;-5.32,-.77,;-5.32,.77,;-3.99,1.54,;-2.65,.77,;-1.32,1.54,;-1.32,3.08,;.01,3.85,;-2.65,3.85,;-3.99,3.08,;-3.99,-1.54,;-7.99,-.77,;-7.99,.77,;-9.33,-0,;-9.33,-1.54,;-1.32,-1.54,;.01,-.77,;1.34,-1.54,;2.66,-.77,)|

BDBM50617929

CC(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:16.15,19.19,(8,-1.54,;6.66,-.77,;6.66,.77,;5.33,-1.54,;5.33,-3.06,;4.01,-3.84,;2.68,-3.07,;1.35,-3.85,;.01,-3.08,;-1.32,-3.85,;-2.66,-3.08,;-3.99,-3.85,;-5.33,-3.08,;-5.33,-1.54,;-3.99,-.77,;-3.99,.77,;-2.65,1.54,;-1.32,.77,;.01,1.54,;.01,3.08,;1.35,3.85,;-1.32,3.85,;-2.65,3.08,;-2.66,-1.54,;-6.66,-.77,;-6.66,.77,;-8,-0,;-8,-1.54,;.01,-1.54,;1.34,-.77,;2.68,-1.54,;4,-.77,)|

BDBM50617930

N[C@H]1CC[C@H](CC1)Nc1nc(Nc2ccc3CN(CCc3c2)C(=O)CO)ncc1C(F)(F)F |r,wU:4.7,1.0,(.68,3.85,;-.65,3.08,;-.65,1.54,;-1.99,.77,;-3.32,1.54,;-3.32,3.08,;-1.99,3.85,;-4.65,.77,;-4.65,-.77,;-3.32,-1.54,;-3.32,-3.08,;-1.99,-3.85,;-.65,-3.08,;-.65,-1.54,;.67,-.77,;2.01,-1.54,;3.33,-.77,;4.66,-1.54,;4.66,-3.06,;3.35,-3.84,;2.01,-3.07,;.68,-3.85,;5.99,-.77,;5.99,.77,;7.33,-1.54,;8.66,-.77,;-4.66,-3.85,;-5.99,-3.08,;-5.99,-1.54,;-7.33,-.77,;-7.33,.77,;-8.66,-0,;-8.66,-1.54,)|

BDBM50617931

C[C@@H](O)C(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:18.17,21.21,wD:1.0,(7.33,-3.08,;7.33,-1.54,;8.66,-.77,;5.99,-.77,;5.99,.77,;4.66,-1.54,;4.66,-3.06,;3.35,-3.84,;2.01,-3.07,;.68,-3.85,;-.65,-3.08,;-1.99,-3.85,;-3.32,-3.08,;-4.66,-3.85,;-5.99,-3.08,;-5.99,-1.54,;-4.65,-.77,;-4.65,.77,;-3.32,1.54,;-1.99,.77,;-.65,1.54,;-.65,3.08,;.68,3.85,;-1.99,3.85,;-3.32,3.08,;-3.32,-1.54,;-7.33,-.77,;-7.33,.77,;-8.66,-0,;-8.66,-1.54,;-.65,-1.54,;.68,-.77,;2.01,-1.54,;3.33,-.77,)|

BDBM50617932

C[C@H](O)C(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:18.17,21.21,1.0,(7.33,-3.08,;7.33,-1.54,;8.66,-.77,;5.99,-.77,;5.99,.77,;4.66,-1.54,;4.66,-3.06,;3.35,-3.84,;2.01,-3.07,;.68,-3.85,;-.65,-3.08,;-1.99,-3.85,;-3.32,-3.08,;-4.66,-3.85,;-5.99,-3.08,;-5.99,-1.54,;-4.65,-.77,;-4.65,.77,;-3.32,1.54,;-1.99,.77,;-.65,1.54,;-.65,3.08,;.68,3.85,;-1.99,3.85,;-3.32,3.08,;-3.32,-1.54,;-7.33,-.77,;-7.33,.77,;-8.66,-0,;-8.66,-1.54,;-.65,-1.54,;.67,-.77,;2.01,-1.54,;3.33,-.77,)|

BDBM50617933

CC(C)(O)C(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:19.18,22.22,(8.66,-.77,;7.33,-1.54,;7.33,-3.08,;8.66,-2.31,;5.99,-.77,;5.99,.77,;4.66,-1.54,;4.66,-3.06,;3.35,-3.84,;2.01,-3.07,;.68,-3.85,;-.65,-3.08,;-1.99,-3.85,;-3.32,-3.08,;-4.66,-3.85,;-5.99,-3.08,;-5.99,-1.54,;-4.65,-.77,;-4.65,.77,;-3.32,1.54,;-1.99,.77,;-.65,1.54,;-.65,3.08,;.68,3.85,;-1.99,3.85,;-3.32,3.08,;-3.32,-1.54,;-7.33,-.77,;-7.33,.77,;-8.66,-0,;-8.66,-1.54,;-.65,-1.54,;.67,-.77,;2.01,-1.54,;3.33,-.77,)|

BDBM50617916

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:20.19,23.23,(7.99,.77,;7.99,-.77,;9.33,-1.54,;9.33,0,;6.66,-1.54,;5.33,-.77,;5.33,.77,;3.99,-1.54,;3.99,-3.06,;2.68,-3.84,;1.34,-3.07,;.02,-3.85,;-1.32,-3.08,;-2.66,-3.85,;-3.99,-3.08,;-5.32,-3.85,;-6.66,-3.08,;-6.66,-1.54,;-5.32,-.77,;-5.32,.77,;-3.99,1.54,;-2.65,.77,;-1.32,1.54,;-1.32,3.08,;.01,3.85,;-2.65,3.85,;-3.99,3.08,;-3.99,-1.54,;-7.99,-.77,;-7.99,.77,;-9.33,-0,;-9.33,-1.54,;-1.32,-1.54,;.01,-.77,;1.34,-1.54,;2.66,-.77,)|

BDBM50617934

CC(=O)N1CCc2ccc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)cc2C1 |r,wU:17.16,20.20,(7.99,-2.3,;6.66,-3.07,;6.66,-4.61,;5.33,-2.3,;5.33,-.78,;4,-.01,;2.68,-.78,;1.34,-.01,;.01,-.78,;.01,-2.32,;-1.32,-3.09,;-2.66,-2.32,;-3.99,-3.09,;-5.33,-2.32,;-5.33,-.78,;-3.99,-.01,;-3.99,1.53,;-2.65,2.3,;-1.32,1.53,;.01,2.3,;.01,3.84,;1.35,4.61,;-1.32,4.61,;-2.65,3.84,;-2.66,-.78,;-6.66,-.01,;-6.66,1.53,;-7.99,.76,;-7.99,-.78,;1.35,-3.09,;2.68,-2.31,;4.01,-3.08,)|

BDBM50617935

CC(C)(O)C(=O)N1CCc2ccc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)cc2C1 |r,wU:20.19,23.23,(7.33,-.76,;7.33,-2.3,;8.66,-3.07,;8.66,-1.53,;5.99,-3.07,;5.99,-4.61,;4.66,-2.3,;4.66,-.78,;3.33,-.01,;2.01,-.78,;.68,-.01,;-.66,-.78,;-.66,-2.32,;-1.99,-3.08,;-3.32,-2.32,;-4.66,-3.09,;-5.99,-2.32,;-5.99,-.78,;-4.65,-.01,;-4.65,1.53,;-3.32,2.3,;-1.99,1.53,;-.65,2.3,;-.65,3.84,;.68,4.61,;-1.99,4.61,;-3.32,3.84,;-3.32,-.78,;-7.33,-.01,;-7.33,1.53,;-8.66,.76,;-8.66,-.78,;.68,-3.09,;2.01,-2.31,;3.35,-3.08,)|

BDBM50617936

CC(C)(O)CC(=O)N1CCc2ccc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)cc2C1 |r,wU:21.20,24.24,(9.33,-2.3,;7.99,-3.07,;7.99,-4.61,;9.33,-3.84,;6.66,-2.3,;5.33,-3.07,;5.33,-4.61,;3.99,-2.3,;3.99,-.78,;2.66,-.01,;1.35,-.78,;.01,-.01,;-1.32,-.77,;-1.32,-2.31,;-2.66,-3.08,;-3.99,-2.31,;-5.32,-3.09,;-6.66,-2.32,;-6.66,-.78,;-5.32,-.01,;-5.32,1.53,;-3.99,2.3,;-2.65,1.53,;-1.32,2.3,;-1.32,3.84,;.01,4.61,;-2.65,4.61,;-3.99,3.84,;-3.99,-.78,;-7.99,-.01,;-7.99,1.53,;-9.33,.76,;-9.33,-.78,;.02,-3.09,;1.35,-2.31,;2.68,-3.08,)|

BDBM50617937

CC(=O)N1Cc2ccc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)cc2C1 |r,wU:16.15,19.19,(7.68,-3.62,;6.91,-2.29,;7.68,-.96,;5.37,-2.29,;4.49,-1.08,;3,-1.54,;1.66,-.77,;.33,-1.54,;.33,-3.08,;-1,-3.85,;-2.34,-3.08,;-3.67,-3.85,;-5.01,-3.08,;-5.01,-1.54,;-3.67,-.77,;-3.67,.77,;-2.34,1.54,;-1,.77,;.33,1.54,;.33,3.08,;1.67,3.85,;-1,3.85,;-2.34,3.08,;-2.34,-1.54,;-6.34,-.77,;-6.34,.77,;-7.68,-0,;-7.68,-1.54,;1.67,-3.85,;3,-3.07,;4.45,-3.53,)|

BDBM50617938

N[C@H]1CC[C@H](CC1)Nc1nc(Nc2ccc3CN(Cc3c2)C(=O)CO)ncc1C(F)(F)F |r,wU:4.7,1.0,(.9,3.85,;-.44,3.08,;-.44,1.54,;-1.77,.77,;-3.11,1.54,;-3.11,3.08,;-1.77,3.85,;-4.44,.77,;-4.44,-.77,;-3.11,-1.54,;-3.11,-3.08,;-1.77,-3.85,;-.44,-3.08,;-.44,-1.54,;.89,-.77,;2.23,-1.54,;3.72,-1.08,;4.6,-2.29,;3.68,-3.53,;2.23,-3.07,;.9,-3.85,;6.14,-2.29,;6.91,-.96,;6.91,-3.62,;8.45,-3.62,;-4.44,-3.85,;-5.78,-3.08,;-5.78,-1.54,;-7.11,-.77,;-7.11,.77,;-8.45,-0,;-8.45,-1.54,)|

BDBM50617939

CC(C)(O)C(=O)N1Cc2ccc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)cc2C1 |r,wU:19.18,22.22,(8.45,-3.07,;6.91,-3.07,;6.14,-4.4,;7.68,-4.4,;6.14,-1.74,;6.91,-.4,;4.6,-1.74,;3.72,-.52,;2.23,-.99,;.89,-.22,;-.44,-.98,;-.44,-2.52,;-1.77,-3.29,;-3.11,-2.52,;-4.44,-3.29,;-5.78,-2.53,;-5.78,-.99,;-4.44,-.22,;-4.44,1.32,;-3.11,2.09,;-1.77,1.32,;-.44,2.09,;-.44,3.63,;.9,4.4,;-1.77,4.4,;-3.11,3.63,;-3.11,-.99,;-7.11,-.22,;-7.11,1.32,;-8.45,.55,;-8.45,-.99,;.9,-3.3,;2.23,-2.52,;3.68,-2.98,)|

BDBM50617940

CC(C)(O)CC(=O)N1Cc2ccc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)cc2C1 |r,wU:20.19,23.23,(8.44,-4.4,;7.67,-3.07,;8.44,-1.74,;9.21,-3.07,;6.13,-3.07,;5.37,-1.74,;6.13,-.4,;3.83,-1.74,;2.95,-.52,;1.46,-.99,;.12,-.22,;-1.21,-.98,;-1.21,-2.52,;-2.54,-3.29,;-3.88,-2.52,;-5.21,-3.29,;-6.55,-2.53,;-6.55,-.99,;-5.21,-.22,;-5.21,1.32,;-3.87,2.09,;-2.54,1.32,;-1.21,2.09,;-1.21,3.63,;.13,4.4,;-2.54,4.4,;-3.87,3.63,;-3.88,-.99,;-7.88,-.22,;-7.88,1.32,;-9.21,.55,;-9.21,-.99,;.13,-3.3,;1.46,-2.52,;2.91,-2.98,)|

BDBM50617941

CC(=O)N1CCc2ccc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)cc12 |r,wU:17.16,20.20,(7.01,-4.29,;5.52,-3.89,;4.43,-4.98,;5.12,-2.4,;6.03,-1.16,;5.16,.05,;3.67,-.41,;2.33,.36,;1,-.41,;1,-1.95,;-.33,-2.72,;-1.67,-1.95,;-3,-2.72,;-4.34,-1.96,;-4.34,-.42,;-3,.36,;-3,1.9,;-1.67,2.67,;-.33,1.9,;1,2.67,;1,4.21,;2.34,4.98,;-.33,4.98,;-1.67,4.21,;-1.67,-.41,;-5.67,.35,;-5.67,1.89,;-7.01,1.12,;-7.01,-.42,;2.34,-2.72,;3.67,-1.94,)|

BDBM50617942

CC(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc12 |r,wU:16.15,19.19,(7.03,.81,;5.54,.41,;4.45,1.5,;5.14,-1.08,;6.01,-2.29,;5.1,-3.53,;3.65,-3.07,;2.32,-3.85,;.98,-3.08,;-.35,-3.85,;-1.69,-3.08,;-3.02,-3.85,;-4.36,-3.08,;-4.36,-1.54,;-3.02,-.77,;-3.02,.77,;-1.69,1.54,;-.35,.77,;.98,1.54,;.98,3.08,;2.32,3.85,;-.35,3.85,;-1.69,3.08,;-1.69,-1.54,;-5.69,-.77,;-5.69,.77,;-7.03,-0,;-7.03,-1.54,;.98,-1.54,;2.31,-.77,;3.65,-1.54,)|

BDBM50617943

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc12 |r,wU:20.19,23.23,(7.97,2.7,;6.48,2.3,;5.39,3.39,;6.88,3.78,;6.08,.81,;4.6,.41,;3.51,1.5,;4.2,-1.08,;5.07,-2.29,;4.16,-3.53,;2.7,-3.07,;1.38,-3.85,;.04,-3.08,;-1.3,-3.85,;-2.63,-3.08,;-3.96,-3.85,;-5.3,-3.08,;-5.3,-1.54,;-3.96,-.77,;-3.96,.77,;-2.63,1.54,;-1.3,.77,;.04,1.54,;.04,3.08,;1.37,3.85,;-1.3,3.85,;-2.63,3.08,;-2.63,-1.54,;-6.64,-.77,;-6.64,.77,;-7.97,-0,;-7.97,-1.54,;.04,-1.54,;1.37,-.77,;2.7,-1.54,)|

BDBM50617944

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(N[C@H]4CC[C@H](N)CC4)n3)C(F)(F)F)ccc2C1 |r,wU:20.19,wD:23.23,(8,.77,;8,-.77,;9.33,-1.54,;9.33,0,;6.66,-1.54,;5.33,-.77,;5.33,.77,;3.99,-1.54,;3.99,-3.06,;2.68,-3.84,;1.34,-3.07,;.02,-3.85,;-1.32,-3.08,;-2.66,-3.85,;-3.99,-3.08,;-5.32,-3.85,;-6.66,-3.08,;-6.66,-1.54,;-5.32,-.77,;-5.32,.77,;-3.99,1.54,;-3.99,3.08,;-2.65,3.85,;-1.32,3.08,;.01,3.85,;-1.32,1.54,;-2.65,.77,;-3.99,-1.54,;-8,-.77,;-8,.77,;-9.33,-0,;-9.33,-1.54,;-1.32,-1.54,;.01,-.77,;1.34,-1.54,;2.66,-.77,)|

BDBM50617945

CC(=O)N[C@H]1CC[C@H](CC1)Nc1nc(Nc2ccc3CN(CCc3c2)C(=O)CC(C)(C)O)ncc1C(F)(F)F |r,wU:7.10,4.3,(1.35,5,;.01,4.23,;-1.32,5,;.01,2.69,;-1.32,1.92,;-1.32,.38,;-2.65,-.39,;-3.99,.38,;-3.99,1.92,;-2.65,2.7,;-5.32,-.39,;-5.32,-1.93,;-3.99,-2.7,;-3.99,-4.23,;-2.66,-5,;-1.32,-4.23,;-1.32,-2.69,;.01,-1.92,;1.35,-2.7,;2.66,-1.93,;3.99,-2.69,;3.99,-4.22,;2.68,-4.99,;1.35,-4.23,;.02,-5,;5.33,-1.92,;5.33,-.38,;6.66,-2.69,;7.99,-1.92,;7.99,-.38,;9.33,-2.69,;9.33,-1.15,;-5.32,-5,;-6.66,-4.24,;-6.66,-2.7,;-7.99,-1.93,;-7.99,-.39,;-9.33,-1.16,;-9.33,-2.7,)|

BDBM50617946

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(N[C@H]4CC[C@H](CC4)NS(C)(=O)=O)n3)C(F)(F)F)ccc2C1 |r,wU:20.19,23.26,(7.99,-.67,;7.99,-2.21,;9.33,-2.98,;9.33,-1.44,;6.66,-2.98,;5.33,-2.21,;5.33,-.67,;3.99,-2.98,;3.99,-4.5,;2.68,-5.28,;1.35,-4.51,;.02,-5.29,;-1.32,-4.51,;-2.66,-5.28,;-3.99,-4.51,;-5.32,-5.28,;-6.66,-4.52,;-6.66,-2.98,;-5.32,-2.21,;-5.32,-.67,;-3.99,.1,;-3.99,1.64,;-2.65,2.41,;-1.32,1.64,;-1.32,.1,;-2.65,-.67,;.01,2.41,;.01,3.95,;1.35,4.72,;-.76,5.29,;-1.53,3.95,;-3.99,-2.98,;-7.99,-2.21,;-7.99,-.67,;-9.33,-1.44,;-9.33,-2.98,;-1.32,-2.97,;.01,-2.21,;1.35,-2.98,;2.66,-2.21,)|

BDBM50617947

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(N[C@H]4CCCC[C@H]4N)n3)C(F)(F)F)ccc2C1 |r|

BDBM50617948

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CCCC[C@@H]4N)n3)C(F)(F)F)ccc2C1 |r|

BDBM50617949

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(N[C@@H]4CCCNC4)n3)C(F)(F)F)ccc2C1 |r|

BDBM50617950

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(N[C@H]4CCCNC4)n3)C(F)(F)F)ccc2C1 |r|

BDBM50617951

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NC4CCNCC4)n3)C(F)(F)F)ccc2C1

BDBM50617952

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NCC4CCNCC4)n3)C(F)(F)F)ccc2C1

BDBM50617953

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NC[C@H]4CCCNC4)n3)C(F)(F)F)ccc2C1 |r|

BDBM50617954

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NC[C@@H]4CCCNC4)n3)C(F)(F)F)ccc2C1 |r|

BDBM50617955

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NCCN)n3)C(F)(F)F)ccc2C1

BDBM50617956

CC(C)(N)CNc1nc(Nc2ccc3CN(CCc3c2)C(=O)CC(C)(C)O)ncc1C(F)(F)F

BDBM50617957

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NCCCN)n3)C(F)(F)F)ccc2C1

BDBM50617958

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NCC(C)(C)CN)n3)C(F)(F)F)ccc2C1

BDBM50617959

CC(C)(N)CCNc1nc(Nc2ccc3CN(CCc3c2)C(=O)CC(C)(C)O)ncc1C(F)(F)F

BDBM50617960

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NCCCCN)n3)C(F)(F)F)ccc2C1

BDBM50617961

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NCCCCCN)n3)C(F)(F)F)ccc2C1

BDBM50617962

CC(=O)NCCCNc1nc(Nc2ccc3CN(CCc3c2)C(=O)CC(C)(C)O)ncc1C(F)(F)F

BDBM50617963

CC(C)(O)CC(=O)N1CCc2cc(Nc3ncc(c(NCCCNS(C)(=O)=O)n3)C(F)(F)F)ccc2C1

BDBM50617964

CNCCCNc1nc(Nc2ccc3CN(CCc3c2)C(=O)CC(C)(C)O)ncc1C(F)(F)F

BDBM50468574

CCS(=O)(=O)N1CCN(CC1)c2ccc(cc2)Nc3ncc(c(n3)NC4CC4)C(=O)N

BDBM50631815

CC(=O)c1ccc(Nc2ncc(c(NCCCN)n2)C(F)(F)F)cc1

BDBM50631816

NCCCNc1nc(Nc2ccc3C(=O)CCCc3c2)ncc1C(F)(F)F

BDBM50631817

NCCCNc1nc(Nc2ccc3C(=O)CCc3c2)ncc1C(F)(F)F

BDBM50631818

NCCCNc1nc(Nc2ccc3C(=O)CCOc3c2)ncc1C(F)(F)F

BDBM50631819

NCCCNc1nc(Nc2ccc3C(=O)OCc3c2)ncc1C(F)(F)F

BDBM50631820

NCCCNc1nc(Nc2ccc3OCCOc3c2)ncc1C(F)(F)F

BDBM50631821

NCCCNc1nc(Nc2ccc3OCOc3c2)ncc1C(F)(F)F

BDBM50631822

NCCCNc1nc(Nc2ccc3c(CCS3(=O)=O)c2)ncc1C(F)(F)F

BDBM50631823

CS(=O)(=O)N1CCCc2cc(Nc3ncc(c(NCCCN)n3)C(F)(F)F)ccc12

BDBM50631824

CS(=O)(=O)N1CCc2cc(Nc3ncc(c(NCCCN)n3)C(F)(F)F)ccc2C1

BDBM50631825

CS(=O)(=O)N1CCc2cc(Nc3ncc(c(NCCCN)n3)C(F)(F)F)ccc12

BDBM50631826

CS(=O)(=O)N1Cc2ccc(Nc3ncc(c(NCCCN)n3)C(F)(F)F)cc2C1

BDBM50631827

CS(=O)(=O)N1CCOc2cc(Nc3ncc(c(NCCCN)n3)C(F)(F)F)ccc12

BDBM50631828

CCS(=O)(=O)N1CCCc2cc(Nc3ncc(c(NCCCN)n3)C(F)(F)F)ccc12

BDBM50631829

CCS(=O)(=O)N1CCc2cc(Nc3ncc(c(NCCCN)n3)C(F)(F)F)ccc2C1

BDBM50631830

NCCCNc1nc(Nc2ccc3N(CCCc3c2)S(=O)(=O)C2CC2)ncc1C(F)(F)F

BDBM50631831

NCCCNc1nc(Nc2ccc3CN(CCc3c2)S(=O)(=O)C2CC2)ncc1C(F)(F)F

BDBM50631832

NCCCNc1nc(Nc2ccc3CN(CCc3c2)S(=O)(=O)C2CCCCC2)ncc1C(F)(F)F

BDBM50631833

NCCCNc1nc(Nc2ccc3N(CCCc3c2)S(=O)(=O)c2ccccc2)ncc1C(F)(F)F

BDBM50631834

NCCCNc1nc(Nc2ccc3CN(CCc3c2)S(=O)(=O)c2ccccc2)ncc1C(F)(F)F

BDBM50634753

N#Cc1ncc(Nc2ncc3c(n2)CCC(=O)N3)cc1N[C@@H]1CCNC1

BDBM50634754

N#Cc1ncc(Nc2ncc3[nH]c(=O)ccc3n2)cc1N[C@@H]1CCNC1

BDBM50634755

N#Cc1ncc(Nc2ncc3c(ccc(=O)n3CC(F)F)n2)cc1N[C@@H]1CCNC1

BDBM50634756

Cn1c(=O)ccc2nc(Nc3cnc(C#N)c(N[C@H]4CC[C@@H](N)CC4)c3)ncc21

BDBM50634757

CC(C)n1c(=O)ccc2nc(Nc3cnc(C#N)c(N[C@H]4CC[C@@H](N)CC4)c3)ncc21

BDBM50634758

N#Cc1ncc(Nc2ncc3c(ccc(=O)n3CC(F)(F)F)n2)cc1N[C@H]1CC[C@@H](N)CC1

BDBM50648020

N#CC1(CNc2cccc(-c3cc(Nc4cnn(Cc5ccc(C(=O)Nc6ccccc6N)cc5)c4)ncc3Cl)n2)CCOCC1

BDBM50648038

CCCNNC(=O)c1ccc(Cn2cc(Nc3ncc(Cl)c(-c4cnc5ccccn45)n3)cn2)cc1

BDBM50652481

Cc1nn2c(-c3ccccc3)ccnc2c1/C(N)=N/O

BDBM50652483

Cc1nn2c(-c3ccc(Cl)cc3)ccnc2c1/C(N)=N/O

BDBM50652484

Cc1nn2c(-c3ccc(Br)cc3)ccnc2c1/C(N)=N/O

BDBM50652486

Cc1nc(-c2c(C)nn3c(-c4ccccc4)ccnc23)no1

BDBM50652490

COc1ccc(-c2ccnc3c(-c4noc(C)n4)c(C)nn23)cc1

BDBM50652491

Cn1cc(-c2cnn3c(N)cc([C@@H]4CCCNC4)nc23)cn1

BDBM50652793

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12

BDBM50652792

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C

BDBM174948

Cc1cc2c(c[nH]c2nc1)Cc3ccc(nc3F)NCc4cc(cnc4OC)F

BDBM130909

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC

BDBM14210

COc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(cc4)NC(=O)c5ccccc5

BDBM112499

COc1cc2c(cc1NC(=O)/C=C/CN3CCCCC3)c(ncn2)Nc4ccc(c(c4)Cl)F

BDBM50337134

CCOc1cc(ccc1Nc2ncc3c(n2)N(c4ccccc4C(=O)N3C)C)N5CCC(CC5)O

BDBM50075102

Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12

BDBM185674

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc4ncccc4c3)C(C)(C)C)c(F)c2)ccn1

BDBM50391802

c1cc(c(cc1I)F)Nc2c(ccc(c2F)F)C(=O)N3CC(C3)([C@@H]4CCCCN4)O

BDBM50395821

CC1=CN2C(=O)C=C(N=C2C(=C1)[C@@H](C)Nc3ccccc3C(=O)O)N4CCOCC4

BDBM50365463

CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12 |r,t:7|

BDBM50185140

CN1CCN(CC1)C2CCN(CC2)c3ccc(c(c3)OC)Nc4ncc(c(n4)Nc5ccccc5P(=O)(C)C)Cl

BDBM50311017

O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50349102

CCc1cccc(CC)c1NC(=O)c1nn(C)c-2c1CCc1cnc(Nc3ccc(cc3OC(F)(F)F)C(=O)NC3CCN(C)CC3)nc-21

BDBM16018

O=C1c2ccccc2-c2n[nH]c3cccc1c23