Compound Name

SMILES String

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1cccc(O)c1O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1cccc3ccccc13)c2=O)C1CC1

CN(C)c1ccc(Cc2cn(C3CC3)c3c(F)c(c(F)cc3c2=O)-c2cc(C)nc(C)c2)cc1

[H][C@@]1(C)CSc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

[H][C@]1(C)COc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1ccncc1

[H][C@]1(C)COc2c(c(F)c(F)c3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

C[C@H]1COc2c3c(cc(c2N4CCN(CC4)C)F)C(=O)C(=CN31)C(=O)O

[H][C@]1(C)COc2c(ccc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)O[C@@H]3c4cc5c(cc4[C@H]([C@@H]6[C@@H]3COC6=O)c7cc(c(c(c7)OC)O)OC)OCO5)O)O

Cc1cc(cc(C)n1)-c1c(F)cc2c3c1OCC(C)(C)n3cc(C(O)=O)c2=O

Cc1cc(cc(C)n1)-c1c(F)cc2c3c1OCCn3cc(C(O)=O)c2=O

[H][C@@]1(C)COc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

[H][C@]1(C)CNc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

CCn1cc(C(O)=O)c(=O)c2cc(F)c(cc12)-c1cc(C)nc(C)c1

[H][C@]1(C)COc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1ccc2cnccc2c1

[H][C@]1(CC)COc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

[H][C@]1(C)CSc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

COc1cc(ccc1Nc2c3ccccc3nc4c2cccc4)NS(=O)(=O)C

Cc1cc(cc(C)n1)-c1c(F)cc2c3c1OCC1(CC1)n3cc(C(O)=O)c2=O

[H][C@]1(C)COc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

[H][C@]1(C)CCOc2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

[H][C@]1(C)C[S+]([O-])c2c(c(F)cc3c2n1cc(C(O)=O)c3=O)-c1cc(C)nc(C)c1

CCOC(=O)C(\C#N)=C1/C=CN(C2CC2)c2c(F)c(c(F)cc12)-c1cc(C)nc(C)c1 |c:9|

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/Sc1ccc(Cl)cc1)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/C1CC1)C1CC1

CO\N=c1\ccn(C2CC2)c2c(F)c(c(F)cc12)-c1cc(C)nc(C)c1

CN\N=c1/ccn(C2CC2)c2c(F)c(c(F)cc12)-c1cc(C)nc(C)c1

[#6]-c1cc(cc(-[#6])n1)-c1c(F)cc2\[#6](-[#6]=[#6]-[#7](-[#6]-3-[#6]-[#6]-3)-c2c1F)=[#6](\C#N)C#N |c:15|

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(C(O)=O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2\C(=C/C#N)C=CN(C3CC3)c2c1F |c:18|

CN(C)CCC\N=c1/ccn(C2CC2)c2c(F)c(c(F)cc12)-c1cc(C)nc(C)c1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N\O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/NCCO)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/c1ccccn1)C1CC1

Cc1ccc(cc1)S(=O)(=O)\N=c1/ccn(C2CC2)c2c(F)c(c(F)cc12)-c1cc(C)nc(C)c1

CN(C)CC\N=c1/ccn(C2CC2)c2c(F)c(c(F)cc12)-c1cc(C)nc(C)c1

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn(-c4ccccc4)c(=O)c3cn(C3CC3)c2c1F

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/N)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(ccc2=N)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/Sc1ccccn1)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/NC(N)=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(ccc2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/N1C(=O)c2ccccc2C1=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/c1ccc(N)cc1)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/Nc1ccccn1)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/Nc1c2ccccc2nc2ccccc12)C1CC1

CN(C)\N=c1/ccn(C2CC2)c2c(F)c(c(F)cc12)-c1cc(C)nc(C)c1

CC(=O)N\N=c1/ccn(C2CC2)c2c(F)c(c(F)cc12)-c1cc(C)nc(C)c1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/Nc1cnc2ccccc2c1)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(ccc2=S)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc\c2=N/c1ccccc1O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn(C4CCCCC4)c(=O)c3cn(C3CC3)c2c1F

CN(C)[C@H]1CC[C@H](CC1)n1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O |wU:6.9,3.2,(17.41,1.96,;15.87,1.96,;15.1,3.29,;15.1,.63,;15.87,-.71,;15.1,-2.03,;13.58,-2.03,;12.79,-.71,;13.56,.63,;12.81,-3.37,;11.29,-3.52,;10.97,-5.04,;12.3,-5.81,;12.3,-7.35,;10.97,-8.12,;10.97,-9.66,;10.2,-11,;11.74,-10.99,;9.64,-7.35,;8.31,-8.12,;8.31,-9.66,;6.96,-7.35,;6.96,-5.81,;5.62,-5.04,;8.31,-5.04,;9.64,-5.81,;5.63,-8.12,;4.29,-7.35,;2.96,-8.12,;1.61,-7.33,;2.96,-9.66,;4.3,-10.43,;4.32,-11.97,;5.63,-9.66,;13.45,-4.76,;14.96,-5.07,)|

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn(C)c(=O)c3cn(C3CC3)c2c1F

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn(C4CCOCC4)c(=O)c3cn(C3CC3)c2c1F

CN1CCC(CC1)n1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O

CC1CCC(CC1)n1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O |(16.12,-2.01,;15.35,-3.34,;13.81,-3.34,;13.03,-4.69,;13.82,-6,;15.35,-6,;16.12,-4.69,;13.05,-7.35,;11.53,-7.5,;11.21,-9.01,;12.54,-9.78,;12.54,-11.32,;11.21,-12.09,;11.21,-13.63,;10.44,-14.98,;11.98,-14.96,;9.88,-11.32,;8.55,-12.09,;8.55,-13.63,;7.21,-11.32,;7.21,-9.78,;5.86,-9.01,;8.55,-9.01,;9.88,-9.78,;5.88,-12.09,;5.88,-13.63,;4.55,-14.4,;4.56,-15.94,;3.2,-13.63,;3.2,-12.09,;1.85,-11.3,;4.53,-11.32,;13.7,-8.73,;15.2,-9.05,)|

Cc1cc(cc(C)n1)-c1c(F)cc2c3n[nH]c(=O)c3cn(C3CC3)c2c1F

CC(=O)N[C@H]1CC[C@@H](CC1)n1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O |wU:4.3,wD:7.10,(17.78,3.27,;17.01,1.94,;17.78,.61,;15.47,1.94,;14.7,.61,;15.47,-.73,;14.7,-2.05,;13.17,-2.05,;12.37,-.73,;13.16,.61,;12.4,-3.39,;10.88,-3.55,;10.55,-5.06,;11.88,-5.83,;11.88,-7.37,;10.55,-8.14,;10.55,-9.68,;9.78,-11.02,;11.32,-11.01,;9.22,-7.37,;7.89,-8.14,;7.89,-9.68,;6.56,-7.37,;6.56,-5.83,;5.21,-5.06,;7.89,-5.06,;9.22,-5.83,;5.23,-8.14,;5.23,-9.68,;3.9,-10.45,;3.9,-11.99,;2.55,-9.68,;2.55,-8.14,;1.2,-7.35,;3.88,-7.37,;13.04,-4.78,;14.54,-5.09,)|

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn([C@@H]4CC[C@H](N)CC4)c(=O)c3cn(C3CC3)c2c1F |wU:16.16,19.20,(1.59,-7.35,;2.95,-8.14,;4.28,-7.37,;5.63,-8.14,;5.63,-9.68,;4.3,-10.45,;4.3,-11.99,;2.95,-9.68,;6.96,-7.37,;6.96,-5.83,;5.61,-5.06,;8.29,-5.06,;9.62,-5.83,;10.95,-5.06,;11.28,-3.55,;12.79,-3.39,;13.56,-2.05,;15.1,-2.05,;15.87,-.73,;15.1,.61,;15.87,1.94,;13.56,.61,;12.77,-.73,;13.45,-4.78,;14.94,-5.09,;12.28,-5.83,;12.28,-7.37,;10.95,-8.14,;10.95,-9.68,;10.18,-11.02,;11.72,-11.01,;9.62,-7.37,;8.29,-8.14,;8.29,-9.68,)|

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn(CC(O)=O)c(=O)c3cn(C3CC3)c2c1F

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn(CCNCCO)c(=O)c3cn(C3CC3)c2c1F

CN(C)[C@H]1CC[C@@H](CC1)n1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O |wU:6.9,wD:3.2,(17.41,1.96,;15.87,1.96,;15.1,3.29,;15.1,.63,;13.56,.63,;12.79,-.71,;13.58,-2.03,;15.1,-2.03,;15.87,-.71,;12.81,-3.37,;11.29,-3.52,;10.97,-5.04,;12.3,-5.81,;12.3,-7.35,;10.97,-8.12,;10.97,-9.66,;10.2,-11,;11.74,-10.99,;9.64,-7.35,;8.31,-8.12,;8.31,-9.66,;6.96,-7.35,;6.96,-5.81,;5.62,-5.04,;8.31,-5.04,;9.64,-5.81,;5.63,-8.12,;4.29,-7.35,;2.96,-8.12,;1.61,-7.33,;2.96,-9.66,;4.3,-10.43,;4.32,-11.97,;5.63,-9.66,;13.45,-4.76,;14.96,-5.07,)|

CCOC(=O)Cn1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O

CC(=O)N[C@H]1CC[C@H](CC1)n1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O |wU:7.10,4.3,(17.78,3.27,;17.01,1.94,;17.78,.61,;15.47,1.94,;14.7,.61,;15.47,-.73,;14.7,-2.05,;13.17,-2.05,;12.37,-.73,;13.16,.61,;12.4,-3.39,;10.88,-3.55,;10.55,-5.06,;11.88,-5.83,;11.88,-7.37,;10.55,-8.14,;10.55,-9.68,;9.78,-11.02,;11.32,-11.01,;9.22,-7.37,;7.89,-8.14,;7.89,-9.68,;6.56,-7.37,;6.56,-5.83,;5.21,-5.06,;7.89,-5.06,;9.22,-5.83,;5.23,-8.14,;5.23,-9.68,;3.9,-10.45,;3.9,-11.99,;2.55,-9.68,;2.55,-8.14,;1.2,-7.35,;3.88,-7.37,;13.04,-4.78,;14.54,-5.09,)|

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn([C@H]4CC[C@H](N)CC4)c(=O)c3cn(C3CC3)c2c1F |wU:16.16,wD:19.20,(1.59,-7.35,;2.95,-8.14,;4.28,-7.37,;5.63,-8.14,;5.63,-9.68,;4.3,-10.45,;4.3,-11.99,;2.95,-9.68,;6.96,-7.37,;6.96,-5.83,;5.61,-5.06,;8.29,-5.06,;9.62,-5.83,;10.95,-5.06,;11.28,-3.55,;12.79,-3.39,;13.56,-2.05,;12.77,-.73,;13.56,.61,;15.1,.61,;15.87,1.94,;15.87,-.73,;15.1,-2.05,;13.45,-4.78,;14.94,-5.09,;12.28,-5.83,;12.28,-7.37,;10.95,-8.14,;10.95,-9.68,;10.18,-11.02,;11.72,-11.01,;9.62,-7.37,;8.29,-8.14,;8.29,-9.68,)|

CN(C)CCn1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O

CN(C)CCCn1nc2c(cn(C3CC3)c3c(F)c(c(F)cc23)-c2cc(C)nc(C)c2)c1=O

Cc1cc(cc(C)n1)-c1c(F)cc2c3nn(CCO)c(=O)c3cn(C3CC3)c2c1F

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1c(O)cccc1O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccccc1O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccc(N)cc1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccc[nH]1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccccc1CO)c2=O)C1CC1

COc1ccccc1Cc1cn(C2CC2)c2c(F)c(c(F)cc2c1=O)-c1cc(C)nc(C)c1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccncc1)c2=O)C1CC1

CC(=O)Nc1ccccc1Cc1cn(C2CC2)c2c(F)c(c(F)cc2c1=O)-c1cc(C)nc(C)c1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(-c1ccccc1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccc(O)cc1O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccccn1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1cc(O)ccc1O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccccc1NS(C)(=O)=O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccccc1N)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccccc1C(O)=O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccc(Cl)cc1)c2=O)C1CC1

CC(=O)Nc1ccc(Cc2cn(C3CC3)c3c(F)c(c(F)cc3c2=O)-c2cc(C)nc(C)c2)cc1

COc1cccc(Cc2cn(C3CC3)c3c(F)c(c(F)cc3c2=O)-c2cc(C)nc(C)c2)c1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1c(O)cc(O)cc1O)c2=O)C1CC1

COc1ccc(Cc2cn(C3CC3)c3c(F)c(c(F)cc3c2=O)-c2cc(C)nc(C)c2)cc1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(CC1CCCCC1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1cccc(O)c1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ncc[nH]1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1c[nH]cn1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccccc1NC(=O)C(F)(F)F)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccc(O)cc1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(Cc1ccccc1)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(CCc1ccccc1)c2=O)C1CC1

c1c2c(cc(c1F)N3CCNCC3)N(C=C(C2=O)C(=O)O)C4CC4

CCN(CC)CCn1nc2c3c1ccc(CNC=O)c3sc1ccc(OC)cc21

CCN(CC)CCn1nc2c3c1ccc(CNS(C)(=O)=O)c3sc1ccccc21

CCN(CC)CCn1nc2c3c1ccc(CNS(C)(=O)=O)c3sc1ccc(O)cc21

CCN(CC)CCn1nc2c3c1ccc(CNC)c3sc1ccccc21

CCN(CC)CCn1nc2c3c1ccc(CNC(=O)OC)c3sc1ccccc21

CCN(CC)CCn1nc2c3c1ccc(CNC=O)c3sc1ccccc21

CCN(CC)CCn1nc2c3c1ccc(CNC(=O)OC)c3sc1ccc(O)cc21

CCN(CC)CCn1nc2c3c1ccc(CN)c3sc1ccc(OC)cc21

CCN(CC)CCn1nc2c3c1ccc(CN)c3sc1ccccc21

CCN(CC)CCn1nc2c3c1ccc(CNS(C)(=O)=O)c3sc1ccc(OC)cc21

CCN(CC)CCNc1ccc(CNS(C)(=O)=O)c2sc3ccccc3c(=O)c12

CCN(CC)CCn1nc2c3c1ccc(CNC(=O)OC)c3sc1ccc(OC)cc21

CCNN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)N(NC=O)C(=O)c3c3c4cccc(O)c4[nH]c3c12

CCCNN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

NN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)N(NC(=O)c4ccccn4)C(=O)c3c3c4cccc(O)c4[nH]c3c12

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)N(NC(=O)CO)C(=O)c3c3c4cccc(O)c4[nH]c3c12

Oc1cccc2c1[nH]c1c3[nH]c4c(O)cccc4c3c3C(=O)NC(=O)c3c21

CNN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

CN(C)N1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)N(NCC(O)=O)C(=O)c3c3c4cccc(O)c4[nH]c3c12

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)N(NCCC#N)C(=O)c3c3c4cccc(O)c4[nH]c3c12

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)N(NC(=O)CC#N)C(=O)c3c3c4cccc(O)c4[nH]c3c12

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)N(Nc4ccc(cc4)C(O)=O)C(=O)c3c3c4cccc(O)c4[nH]c3c12

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)N(NCc4cccc(O)c4)C(=O)c3c3c4cccc(O)c4[nH]c3c12

OCCNN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

CC(=O)NN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

Cc1ccc(cc1)S(=O)(=O)NN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

OCC1OC(C(O)C(O)C1O)n1c2c(O)cccc2c2c3C(=O)NC(=O)c3c3c4cccc(O)c4[nH]c3c12

CCC(=O)NN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

CS(=O)(=O)NN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

NC(=O)NN1C(=O)c2c(C1=O)c1c3cccc(O)c3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3c(O)cccc3c21

CC1OC(Oc2c(O)c3C(=O)c4ccccc4C(=O)c3c3cccnc23)C(F)C(O)C1O

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@H]3C[C@@H](O)[C@H](O)[C@@H](CO)O3)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

C[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)n1c2cc(O)ccc2c2c3C(=O)N(NC(CO)CO)C(=O)c3c3c4ccc(O)cc4[nH]c3c12

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@H]3O[C@H](CO)[C@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3C[C@@H](O)[C@H](O)[C@@H](CO)O3)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@@H](C(O)CO)[C@@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@H](C(O)CO)[C@@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c1c1[nH]c3cc(O)ccc3c21

OCC(CO)NN1C(=O)c2c(C1=O)c1c3ccc(O)cc3n([C@H]3C[C@H](O)[C@@H](CO)O3)c1c1[nH]c3cc(O)ccc3c21

C[C@H]1COc2c(ccc3c2n1cc(C(O)=O)c3=O)N1CCC[C@H](N)C1

C[C@H]1COc2c(ccc3c2n1cc(C(O)=O)c3=O)N1CCN(C)CC1

[H][C@]1(CCN(C1)c1ccc2c3c1OC[C@H](C)n3cc(C(O)=O)c2=O)[C@H](C)N

C[C@H]1COc2c(ccc3c2n1cc(C(O)=O)c3=O)N1CC[C@H](C1)C(C)(C)N

Cc1cc(=O)oc2cc(CCc3n[nH]c4cccc(OCc5ccc(cc5)C(C)(C)C)c34)ccc12

COC(=O)C1CCCC(C1)NCc1n[nH]c2cccc(OCc3ccc(Cl)c(Cl)c3)c12

COC(=O)C1CCCC(C1)NCc1n[nH]c2cccc(OCc3ccc(cc3)C(C)(C)C)c12

[#6]-[#8]-[#6@@H]1-[#6@@H](-[#8]-[#6](-[#7])=O)-[#6@@H](-[#8])-[#6@H](-[#8]-c2ccc3c(-[#8])c(-[#7]-[#6](=O)-c4ccc(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6])c4)c(=O)oc3c2-[#6])-[#8]C1([#6])[#6] |r|

Clc1cccc(c1)-n1nc(cc1\C=C\c1c[nH]c2ccc(Cl)cc12)C1CCNCC1

Cn1cc(\C=C\c2cc(nn2-c2cccc(Cl)c2)C2CCNCC2)c2cc(Cl)ccc12

C(Oc1ccc(cc1)-c1cc([nH]n1)C1CCNCC1)c1ccccc1

Oc1nc(nc2ccccc12)C(=C)c1cnc2ccccc2c1

Oc1nc(nc2ccccc12)-c1cnc2ccccc2c1

OC1c2cc3ccccc3nc2-c2nc3ccccc3c(=O)n12

COC1c2cc3ccccc3nc2-c2nc3ccccc3c(=O)n12

O=c1n2Cc3cc4ccccc4nc3-c2nc2ccccc12

CC(=O)NC1c2cc3ccccc3nc2-c2nc3ccccc3c(=O)n12

Oc1nc(nc2ccccc12)C(=O)c1cnc2ccccc2c1

CC(C(C)N1CC(=O)NC(=O)C1)N1CC(=O)NC(=O)C1

Oc1cc(cc(O)c1O)C(=O)Nc1ccc(NC(=O)c2cc(O)c(O)c(O)c2)cc1

Oc1cc(cc(O)c1O)C(=O)Nc1cccc(NC(=O)c2cc(O)c(O)c(O)c2)c1

Oc1cc(cc(O)c1O)C(=O)Nc1ccccc1NC(=O)c1cc(O)c(O)c(O)c1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(C1CC1)c(cc2=O)-c1ccccc1

CN1CCN(CC1)c1c(F)cc2c(c1F)n(cc(C(O)=O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(C1CC1)c(-c1ccccc1)c(C(O)=O)c2=O

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(CCF)cc(C(O)=O)c2=O

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(C([O-])=O)c2=O)C(C)(C)C

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(cc(C(O)=O)c2=O)-c1ccc(F)cc1

OC(=O)c1cn(C2CC2)c2c(F)c(c(F)cc2c1=O)-c1ccncc1

OC(=O)c1cn(C2CC2)c2c(F)c(c(F)cc2c1=O)-c1cccnc1

Cc1cc(cc(C)n1)-c1c(F)cc2c(O)c(cnc2c1F)C(O)=O

OC(=O)c1cn(C2CC2)c2c(F)c(c(F)cc2c1=O)-c1ccc(O)cc1

Cc1cc(cc(C)n1)-c1c(F)c(F)c2c(c1F)n(cc(C(O)=O)c2=O)C1CC1

Cc1ccc(c(C)n1)-c1c(F)cc2c(c1F)n(cc(C(O)=O)c2=O)C1CC1 |(-3.13,-9.71,;-1.8,-8.94,;-1.8,-7.38,;-.46,-6.61,;.87,-7.38,;.87,-8.92,;2.2,-9.69,;-.46,-9.69,;2.2,-6.61,;2.2,-5.07,;.87,-4.3,;3.53,-4.3,;4.88,-5.07,;4.86,-6.61,;3.53,-7.38,;3.55,-8.92,;6.21,-7.38,;7.54,-6.61,;7.54,-5.07,;8.87,-4.3,;10.2,-5.07,;8.87,-2.76,;6.21,-4.29,;6.21,-2.75,;6.19,-8.92,;6.98,-10.25,;5.42,-10.24,)|

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(C1CC1)c(C)c(C(O)=O)c2=O

CCn1cc(C(O)=O)c(=O)c2cc(F)c(-c3cc(C)nc(C)c3)c(F)c12

Cc1cc(cc(C)n1)-c1c(F)c(Sc2ccccc2)c2c(c1F)n(cc(C(O)=O)c2=O)C1CC1

NC1CCN(C1)c1c(F)cc2c(c1F)n(cc(C(O)=O)c2=O)C1CC1

Cc1cc(ccn1)-c1c(F)cc2c(c1F)n(cc(C(O)=O)c2=O)C1CC1

Cc1cc(cc(C)n1)-c1c(F)cc2c(scc(C(O)=O)c2=O)c1F

Cc1cc(cc(C)n1)-c1c(F)cc2c(c1F)n(C1CC1)c(C)cc2=O

Cc1cc(cc(C)n1)-c1c(F)c(N)c2c(c1F)n(cc(C(O)=O)c2=O)C1CC1

Cc1ccc(\N=C2/C(Cl)=C(O)c3ncncc3C2=O)c(Br)c1 |t:8|

ClC1=C(Nc2ccc(Br)cc2)C(=O)c2cncnc2C1=O |c:1|

ClC1=C(Nc2ccccc2Br)C(=O)c2cncnc2C1=O |c:1|

CC(C)NC(=O)OCc1ccc(Oc2c3ccccc3nc3ccccc23)cc1

OCc1ccc(Oc2c3ccccc3nc3ccccc23)cc1

Nc1cc(CO)cc(Nc2c3ccccc3nc3ccccc23)c1

CNC(=O)OCc1ccc(Sc2c3ccccc3nc3c(OC)cccc23)cc1

CNC(=O)OCc1ccc(Oc2c3ccccc3nc3c(OC)cccc23)cc1

CC(=O)CCC(=O)Nc1cc(COC(=O)CCC(C)=O)cc(Nc2c3ccccc3nc3ccccc23)c1

CNC(=O)OCc1cc(N)cc(Nc2c3ccccc3nc3ccccc23)c1

CC(=O)CCC(=O)Nc1cc(CO)cc(Nc2c3ccccc3nc3ccccc23)c1

COc1cccc2c(Sc3ccc(CO)cc3)c3ccccc3nc12

CS(=O)(=O)Nc1cc(C[n+]2ccccc2)cc(Nc2c3ccccc3nc3ccccc23)c1

CS(=O)(=O)Nc1cc(CO)cc(Nc2c3ccccc3nc3ccccc23)c1

COc1cccc2c(Oc3ccc(COC(=O)NC(C)C)cc3)c3ccccc3nc12

CNC(=O)OCc1ccc(Oc2c3ccccc3nc3ccccc23)cc1

OCc1ccc(Sc2c3ccccc3nc3ccccc23)cc1

OCc1cccc(Nc2c3ccccc3nc3ccccc23)c1

OC(=O)CCC(=O)Nc1cc(COC(=O)CCC(O)=O)cc(Nc2c3ccccc3nc3ccccc23)c1

CC(=O)OCc1cc(Nc2c3ccccc3nc3ccccc23)cc(NS(C)(=O)=O)c1

COc1cccc2c(Oc3ccc(CO)cc3)c3ccccc3nc12

OCc1cc(NC(=O)CCC(O)=O)cc(Nc2c3ccccc3nc3ccccc23)c1

CN(C)CCCC(=O)Nc1cc(CO)cc(Nc2c3ccccc3nc3ccccc23)c1

CNC(=O)OCc1ccc(Sc2c3ccccc3nc3ccccc23)cc1

CC(C)NC(=O)OCc1ccc(Sc2c3ccccc3nc3ccccc23)cc1

COc1cccc2c(Sc3ccc(COC(=O)NC(C)C)cc3)c3ccccc3nc12

CNC(=O)OCc1cc(NC(=O)OC(C)(C)C)cc(Nc2c3ccccc3nc3ccccc23)c1

C1CNC(=NC1)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C1=NCCCN1

C1CN=C(N1)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C1=NCCN1

OCCN1CCN=C1c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C1=NCCN1CCO

CCN1CCN=C1c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C1=NCCN1CC

C1CCN=C(NC1)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C1=NCCCCN1

C1CCC2N=C(NC2C1)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C1=NC2CCCCC2N1

N[C+](N)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)[C+](N)N

COc1c(O)c(O)cc2CC[C@H](NC(C)=O)c3cc(=O)c(SC)ccc3-c12

CSc1ccc2-c3c(CC[C@H](NC(C)=O)c2cc1=O)cc(O)c(O)c3O |r|

COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(SC)ccc3-c2c(O)c1O

CCN(CC)CCNc1ccc(CNC)c2sc3ccc(OC)cc3c(=O)c12

CCN(CC)CCNc1ccc(CNC(=O)OC)c2sc3ccccc3c(=O)c12

CCN(CC)CCNc1ccc(CN)c2sc3ccccc3c(=O)c12

CCN(CC)CCNc1ccc(CNC(=O)OC)c2sc3ccc(O)cc3c(=O)c12

CCN(CC)CCNc1ccc(CNC=O)c2sc3ccccc3c(=O)c12

CCN(CC)CCNc1ccc(CNS(C)(=O)=O)c2sc3ccc(O)cc3c(=O)c12

CCN(CC)CCNc1ccc(CNC)c2sc3ccc(O)cc3c(=O)c12

CCN(CC)CCNc1ccc(CNC(=O)OC)c2sc3ccc(OC)cc3c(=O)c12

CCN(CC)CCNc1ccc(CNC=O)c2sc3ccc(OC)cc3c(=O)c12

CCN(CC)CCNc1ccc(CNC)c2sc3ccccc3c(=O)c12

CCN(CC)CCNc1ccc(CNS(C)(=O)=O)c2sc3ccc(OC)cc3c(=O)c12

N[C@H]1CCN(C1)c1c(F)cc2c3c1oc1ccccc1n3cc(C(O)=O)c2=O |r|

NC1CCN(C1)c1c(F)cc2c3c1oc1cc4ccccc4cc1n3cc(C(O)=O)c2=O

N[C@@H]1CCN(C1)c1c(F)cc2c3c1oc1cc4ccccc4cc1n3cc(C(O)=O)c2=O

N[C@@H]1CCN(C1)c1c(F)cc2c3c1oc1c4ccccc4ccc1n3cc(C(O)=O)c2=O |r|

OC(=O)c1cn2c3ccc4ccccc4c3oc3c(N4CCNCC4)c(F)cc(c23)c1=O

N[C@H]1CCN(C1)c1c(F)cc2c3c1oc1c4ccccc4ccc1n3cc(C(O)=O)c2=O |r|

N[C@@H]1CCN(C1)c1c(F)cc2c3c1oc1ccc4ccccc4c1n3cc(C(O)=O)c2=O

NC1CCN(C1)c1c(F)cc2c3c1oc1ccc4ccccc4c1n3cc(C(O)=O)c2=O

N[C@H]1CCN(C1)c1c(F)cc2c3c1oc1ccc4ccccc4c1n3cc(C(O)=O)c2=O

OC(=O)c1cn2c3c(ccc4ccccc34)oc3c(N4CCNCC4)c(F)cc(c23)c1=O

NC1CCN(C1)c1c(F)cc2c3c1oc1c4ccccc4ccc1n3cc(C(O)=O)c2=O

OC(=O)c1cn2c3cc4ccccc4cc3oc3c(N4CCNCC4)c(F)cc(c23)c1=O

N[C@H]1CCN(C1)c1c(F)cc2c3c1oc1cc4ccccc4cc1n3cc(C(O)=O)c2=O

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2OC1CC(N)C2OC(C)OCC2O1

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2OC1CC(C2OC(C)OCC2O1)N(C)C

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2O[C@@H]1CC(N)C2OC(C)OCC2O1

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2OC1CC(C2OC(C)OCC2O1)N1CCOCC1

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2OC1CC(N)C(O)C(C)O1

[H][C@@]12C(COC1=O)C(OC1OC3COC(C)OC3C(O)C1N)c1cc3OCOc3cc1[C@H]2c1cc(OC)c(O)c(OC)c1

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2OC1CC(NCCN)C2OC(C)OCC2O1

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2OC1CC(NCC#N)C2OC(C)OCC2O1

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2OC1CC(N)C(O)C(CN)O1

COC(=O)[C@H](CSCc1c(O)cc(OC)c(Br)c1C(=O)OC)Nc1nc(cs1)-c1ccc(cc1)[N+]([O-])=O |r|

COC(=O)c1c(Br)c(OC)cc(O)c1CSC[C@H](Nc1nc(cs1)-c1ccc(cc1)[N+]([O-])=O)C1=NOCCO1 |r,t:36|

COC(=O)c1c(Br)c(OC)cc(O)c1CSC[C@H](Nc1nc(cs1)-c1ccc(cc1)[N+]([O-])=O)c1nc(C)no1 |r|

NC1CCN(C1)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)-c1nccs1

[H][C@@]12CN(C[C@]1([H])[C@H](N)CCC2)c1c(F)c(N)c2c(c1F)n(cc(C(O)=O)c2=O)[C@@H]1C[C@@H]1F

[H][C@@]1(F)CN(C[C@]1([H])C1CC1N)c1c(C)c2n(cc(C(O)=O)c(=O)c2c(N)c1F)[C@@H]1C[C@@H]1F

[H][C@@]12C[C@]1([H])[C@H](N)[C@@]1([H])CN(C[C@@]1([H])C2)c1c(F)c(N)c2c(c1F)n(cc(C(O)=O)c2=O)[C@@H]1C[C@@H]1F

[H][C@@]12CN(C[C@]1([H])[C@H](N)CCC2)c1c(C)c2n(cc(C(O)=O)c(=O)c2c(N)c1F)[C@@H]1C[C@@H]1F

[H][C@@]12C[C@]1([H])[C@@H](N)[C@@]1([H])CN(C[C@@]1([H])C2)c1c(F)c(N)c2c(c1F)n(cc(C(O)=O)c2=O)[C@@H]1C[C@@H]1F

[H][C@]12C[C@@]1(N)[C@@]1([H])CN(C[C@@]1([H])CC2)c1c(F)c(N)c2c(c1F)n(cc(C(O)=O)c2=O)[C@@H]1C[C@@H]1F

[H][C@]12C[C@@]1(N)[C@@]1([H])CN(C[C@@]1([H])CC2)c1c(C)c2n(cc(C(O)=O)c(=O)c2c(N)c1F)[C@@H]1C[C@@H]1F

[H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C(Cl)=C[C@]4(C)C3=CC[C@]12C)[C@H](C)CC[C@@H](O)C(C)(C)O |c:16,22|

[H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C(OC)=C[C@]4(C)C3=CC[C@]12C)[C@H](C)CC[C@@H](O)C(C)(C)O |c:17,23|

[H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C(=C[C@]4(C)C3=CC[C@]12C)C(=O)OC)[C@H](C)CC[C@@H](O)C(C)(C)O |c:15,21|

[H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C=C[C@]4(C)C3=CC[C@]12C)[C@H](C)CC[C@@H](O)C(C)(C)O |c:15,21|

[H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C(Br)=C[C@]4(C)C3=CC[C@]12C)[C@H](C)CC[C@@H](O)C(C)(C)O |c:16,22|

[H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C(=C[C@]4(C)C3=CC[C@]12C)C#N)[C@H](C)CC[C@@H](O)C(C)(C)O |c:15,21|

[H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C(=C[C@]4(C)C3=CC[C@]12C)C(O)=O)[C@H](C)CC[C@@H](O)C(C)(C)O |c:15,21|

[H][C@@]1(CC[C@]2(C)C3CCC4C(C)(C)C(=O)C(C=O)=C[C@]4(C)C3=CC[C@]12C)[C@H](C)CC[C@@H](O)C(C)(C)O |c:17,23|

OC(c1ccc(Cl)s1)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO |r|

OC(c1ccsc1)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

CC(C)C=CC(=O)c1cc(O)c2c(O)ccc(O)c2c1O |w:4.4|

Oc1cc(C(N(CCCl)CCCl)c2ccc(cc2)C(F)(F)F)c(O)c2C(=O)c3ccccc3C(=O)c12

CCOc1ccc(cc1)C(O)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

Oc1ccc(O)c2C(=O)c3ccccc3C(=O)c12

Cc1ccc(s1)C(O)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

OC(c1ccc(Br)s1)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

Oc1cc(C(N(CCCl)CCCl)c2ccc(OC(F)(F)F)cc2)c(O)c2C(=O)c3ccccc3C(=O)c12

Oc1cc(C(N(CCCl)CCCl)c2ccsc2)c(O)c2C(=O)c3ccccc3C(=O)c12

CSc1ccc(cc1)C(N(CCCl)CCCl)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

OC(c1cc(Br)cs1)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

COc1ccc(cc1Br)C(O)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

OC(c1ccc(cc1)C(F)(F)F)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

OC(c1ccc(cc1)C#N)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

CSc1ccc(cc1)C(O)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

OC(c1cccs1)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

OC(c1ccc(OC(F)(F)F)cc1)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

COc1ccc(cc1OC)C(O)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

OC(c1ccc(Cl)cc1Cl)c1cc(O)c2C(=O)c3ccccc3C(=O)c2c1O

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2O[C@]1([H])O[C@]2([H])CO[C@H](O[C@@]2([H])[C@H](OC(=O)CSc2nc3cc(F)ccc3s2)[C@H]1NC(=O)CSc1nc2cc(F)ccc2s1)c1cccs1 |r|

COc1cc(cc(c1O)OC)[C@@H]2c3cc4c(cc3[C@H]([C@@H]5[C@@H]2C(=O)OC5)O[C@H]6[C@@H]([C@H]([C@H]7[C@H](O6)CO[C@H](O7)c8cccs8)O)O)OCO4

[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(O)c(OC)c1)c1cc3OCOc3cc1[C@H]2O[C@]1([H])O[C@]2([H])CO[C@H](O[C@@]2([H])[C@H](OC(=O)CSc2nc3cc(F)ccc3o2)[C@H]1NC(=O)CSc1nc2cc(F)ccc2o1)c1cccs1 |r|

OC(c1cccs1)c1cc2ccccc2nc1Cl

Fc1ccc(COC(c2cccs2)c2cc3ccccc3nc2Cl)cc1

Clc1ccc(COC(c2cccs2)c2cc3ccccc3nc2Cl)cc1

CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccc(O)c(CN(C)C)c4cc3Cn1c2=O |r|