Compound Name

SMILES String

NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCN(CC2)c2ccc(F)cc2)c1

Clc1ccccc1-n1c(nnc1-c1ccncn1)[C@H]1C[C@@H](C1)n1c2ccc(cc2[nH]c1=O)C#N |r,wU:20.25,wD:18.20,(25.39,-29.03,;24.05,-29.8,;24.05,-31.34,;22.72,-32.11,;21.39,-31.34,;21.39,-29.8,;22.72,-29.03,;22.72,-27.49,;23.97,-26.59,;23.49,-25.13,;21.95,-25.13,;21.48,-26.59,;20.01,-27.07,;19.69,-28.57,;18.22,-29.05,;17.08,-28.02,;17.4,-26.52,;18.87,-26.04,;25.43,-27.07,;26.13,-28.44,;27.5,-27.74,;26.8,-26.37,;28.97,-28.22,;29.44,-29.68,;28.67,-31.01,;29.44,-32.35,;30.98,-32.35,;31.75,-31.01,;30.98,-29.68,;31.46,-28.22,;30.21,-27.31,;30.21,-25.77,;31.75,-33.68,;32.52,-35.01,)|

c1cc(ccc1C(=O)N)Oc2ccc(cc2)C(=O)N

NC(=O)c1ccc(OCc2ccccc2F)cc1

c1cc(ccc1C(=O)N)Oc2ccc(cc2)C(=O)O

COc1ccc(cc1)C(=O)N

NC(=O)c1ccc(Oc2ccc(C=O)cc2)cc1

Cc1c2CCNC(=O)c2ccc1-c1ccnc(c1)C(F)(F)F

c1cc(ccc1C(=O)N)OCC2CCC2

O=c1[nH][nH]c(=O)c2cc(OCC3CCCCC3)ccc12

Fc1ccccc1COc1ccc2c(c1)c(=O)[nH][nH]c2=O

O=c1[nH][nH]c(=O)c2cc(OCc3ccsc3)ccc12

Nc1ncc2-c3c(Br)c(Br)[nH]c3C(=O)NCc2n1

O[C@@H]1[C@@H](CNC(=O)c2cc(Cl)c(Cl)cc12)c1ccccn1 |r|

O[C@@H]1[C@@H](CNC(=O)c2ccccc12)c1ccccc1 |r|

C[C@@H](COCCC(=O)N1CCN(CC1)c2ncc(cn2)C(F)(F)F)NC3=C(C(=O)NN=C3)C(F)(F)F

c1ccc2c(c1)C(=NNC2=O)Cc3ccc(c(c3)C(=O)N4CCN(CC4)C(=O)C5CC5)F

CNCc1ccc(cc1)c2c3c4c(cc(cc4[nH]2)F)C(=O)NCC3

NC(=O)c1cccc2cn(nc12)-c1ccc(cc1)[C@@H]1CCCNC1 |r|

Cn1c(ncn1)[C@@H]2[C@H](Nc3cc(cc4c3C2=NNC4=O)F)c5ccc(cc5)F

C[C@@]1(CCCN1)c1nc2c(cccc2[nH]1)C(N)=O

O[C@@H]1C(CNC(=O)c2cc(Cl)c(Cl)cc12)c1ccccn1 |r|

c1cc2c(cc1O)sc3n2cnn3

Cc1ccc2c(c1)sc1nnc(N)n21

COc1ccc(c2c1n3c(nnc3s2)N)OC

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

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C

Cn1ncnc1[C@H]1[C@@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(F)cc1 |r|

Cc1cccc2c1N=C(NC2=O)CCC(=O)Nc3ccc(cc3)C(=O)Nc4cccc5c4nccc5

c1ccc2c(c1)C(=O)NC(=N2)CCC(=O)Nc3ccc(cc3)C(=O)Nc4cccc5c4nccc5

O=C(N1CCN(CC1)c1ncccn1)c1ccc(Nc2nc3ccccc3n3nnnc23)cc1

Cn1cnc(c1)C(=O)N1CCN(CC1)C(=O)c1ccc(Nc2nc3ccccc3n3nnnc23)cc1

c1cc(ccc1c2nc3c(c(n2)O)CSCC3)C(F)(F)F

c1ccc2c(c1)nc(c3n2nnn3)Nc4ccc(cc4)C(=O)N5CCOCC5

CC(C)c1ccc(Nc2nc3ccccc3n3nnnc23)cc1