Compound Name

SMILES String

Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F

CCN1CCN(CC1)c2ccc(cc2)Nc3cc(ncn3)N(C)C(=O)Nc4c(c(cc(c4Cl)OC)OC)Cl

Cn1c2c(C(C#N)C3(CCNCC3)NC2=O)c2ccc(Cl)c(Cl)c12

[2H]C([2H])([2H])Nc1nc(cs1)-c1cc(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)cn1

COc1cccc(c1)-c1cc(c(C)cn1)-n1cc(CNCC(C)C)c2ccccc12

CNc1nc(cs1)-c1cc(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)cn1

CNc1nc(cs1)-c1cc(ccn1)C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1

COc1cccc(c1)-c1cc(C(=O)N(C)[C@@H]2CCN(Cc3ccc(Cl)cc3)C2)c2ccccc2n1 |r|

COc1cccc(c1)-c1cc(ccn1)-n1cc(CNCC2CCCCC2)c2ccccc12

COc1cccc(c1)-c1cccc(c1)-n1cc(CNCC2CCCCC2)c2ccccc12

C(NCc1cn(-c2cccc(c2)-c2ccccc2)c2ccccc12)C1CCCCC1

CNc1nc(cs1)-c1ccc2N(CCc2c1)C(=O)c1ccccc1OCc1ccc(Cl)cc1

COc1cccc(c1)-c1cc(ccn1)C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1

COc1cccc(c1)-c1cc(ccn1)-n1cc(CNCC2CCCCC2)c2ccc(F)cc12

COc1cccc(c1)-c1cc(C(=O)N2CCN(Cc3ccccc3)CC2)c2ccccc2n1

CN1CCN(CC1)c2ccc(cc2)Nc3ncc4c(n3)n(c(n4)Nc5ccccc5)C6CCCC6

C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC

CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1

c1cc(c(cc1S(=O)(=O)C(Cl)(Cl)Br)[N+](=O)[O-])NC2CCCCC2

CCS(=O)(=O)c1ccc(NC2CCCCC2)c(c1)[N+]([O-])=O

[O-][N+](=O)c1ccccc1NC1CCCCC1

[O-][N+](=O)c1cc(ccc1NC1CCCCC1)S(=O)(=O)C(F)(F)F

[O-][N+](=O)c1cc(ccc1NC1CCCCC1)S(=O)(=O)C(Cl)Cl

[O-][N+](=O)c1cc(ccc1Nc1ccccc1)S(=O)(=O)C(Cl)(Cl)Br

[O-][N+](=O)c1cc(ccc1NCc1ccco1)S(=O)(=O)C(Cl)(Cl)Br

[O-][N+](=O)c1cc(ccc1NCCCCc1ccccc1)S(=O)(=O)C(Cl)(Cl)Br

[O-][N+](=O)c1cc(ccc1NC1CCCC1)S(=O)(=O)C(Cl)(Cl)Br

CN1CCN(CC1)c1ccc(cc1[N+]([O-])=O)S(=O)(=O)C(Cl)(Cl)Br

ClC(Cl)(Br)S(=O)(=O)c1ccc(NC2CCCCC2)cc1

[O-][N+](=O)c1cc(ccc1NC1CCCCC1)S(=O)(=O)C(Cl)(Cl)Cl

CS(=O)(=O)c1ccc(NC2CCCCC2)c(c1)[N+]([O-])=O

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12

CCOc1cc(ccc1Nc2ncc3c(n2)N(c4ccccc4C(=O)N3C)C)N5CCC(CC5)O

Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12