Compound Name

SMILES String

Clc1ccc(NC(=O)c2ccc3ccccc3c2)c(Cl)c1

Cc1cc(Br)ccc1NC(=O)c1ccc2ccccc2c1

Fc1ccccc1NC(=O)c1ccc2ccccc2c1

Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1cccc(Br)c1

Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1ccc(F)c(Cl)c1

Cc1c(cccc1[N+](=O)[O-])C(=O)Nc2cc(cc(c2)Cl)Cl

Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1ccc(F)c(F)c1

Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1cccc2ccccc12

Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1ccc(Cl)c(Cl)c1

Cc1c(cccc1[N+]([O-])=O)C(=O)Nc1cccc(c1)C(F)(F)F

FC(F)(F)c1ccccc1NC(=O)Nc1cccc2ccccc12

COc1ccccc1NC(=O)Nc1cccc2ccccc12

Clc1ccc(NC(=O)Nc2cccc3cccnc23)cc1

OC(=O)C1=C(CCC1)C(=O)Nc1ccc(cc1)-c1ccccc1 |t:3|

COc1cccc(c1)-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1 |t:16|

COc1ccccc1-c1c(F)c(F)c(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1F |t:18,(1.02,8.12,;-.07,7.03,;.7,5.69,;2.24,5.69,;3.01,4.36,;2.24,3.03,;.7,3.03,;-.07,4.36,;-1.61,4.36,;-2.38,5.69,;-1.61,7.03,;-3.92,5.69,;-4.69,7.03,;-4.69,4.36,;-6.23,4.36,;-7,3.03,;-6.23,1.69,;-8.54,3.03,;-9.21,4.41,;-10.73,4.21,;-11.01,2.69,;-9.65,1.96,;-8.48,5.77,;-9.29,7.08,;-6.94,5.82,;-3.92,3.03,;-4.69,1.69,;-2.38,3.03,;-1.61,1.69,)|

OC(=O)c1sccc1C(=O)Nc1ccc(cc1)-c1ccccc1

COc1cccc(c1)-c1ccc(NC(=O)c2ccsc2C(O)=O)c(F)c1

CCOc1cccc(c1)-c1cc(F)c(NC(=O)c2ccsc2C(O)=O)c(F)c1

CCOc1ccccc1-c1cc(F)c(NC(=O)c2ccsc2C(O)=O)c(F)c1

COc1ccccc1-c1c(F)c(F)c(NC(=O)c2ccsc2C(O)=O)c(F)c1F |(1.02,8.12,;-.07,7.03,;.7,5.69,;2.24,5.69,;3.01,4.36,;2.24,3.03,;.7,3.03,;-.07,4.36,;-1.61,4.36,;-2.38,5.69,;-1.61,7.03,;-3.92,5.69,;-4.69,7.03,;-4.69,4.36,;-6.23,4.36,;-7,3.03,;-6.23,1.69,;-8.54,3.03,;-9.65,1.96,;-11.01,2.69,;-10.73,4.21,;-9.21,4.41,;-8.48,5.77,;-9.29,7.08,;-6.94,5.82,;-3.92,3.03,;-4.69,1.69,;-2.38,3.03,;-1.61,1.69,)|

COc1ccccc1-c1ccc(NC(=O)c2ccsc2C(O)=O)cc1Cl

OC(=O)c1cscc1C(=O)Nc1ccc(cc1)-c1ccccc1

CCOc1ccccc1-c1cc(F)c(NC(=O)c2cscc2C(O)=O)c(F)c1

OC(=O)c1cscc1C(=O)Nc1c(F)cc(cc1F)-c1cccc(OC(F)(F)F)c1

COc1cccc(c1)-c1ccc(NC(=O)c2c(csc2C(O)=O)C(O)=O)c(F)c1

COc1cccc(c1)-c1ccc(NC(=O)c2cc(sc2C(O)=O)C(O)=O)c(F)c1

COc1cccc(c1)-c1ccc(NC(=O)c2csc(C(O)=O)c2C(O)=O)c(F)c1

CCOc1cccc(c1)-c1cc(F)c(NC(=O)c2cocc2C(O)=O)c(F)c1

COc1cccc(c1)-c1ccc(NC(=O)c2cocc2C(O)=O)c(F)c1

Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F

Clc1ccc(cc1)C1CCC(CC1)C1C(=O)C(=O)c2ccccc2C1=O |(22.89,-15.28,;24.23,-14.51,;25.56,-15.28,;26.9,-14.51,;26.9,-12.97,;25.56,-12.2,;24.23,-12.97,;28.23,-12.2,;29.56,-12.97,;30.9,-12.2,;30.9,-10.66,;29.56,-9.89,;28.23,-10.66,;32.23,-9.89,;32.23,-8.35,;30.9,-7.58,;33.56,-7.58,;33.56,-6.04,;34.9,-8.35,;36.27,-7.53,;37.67,-8.32,;37.67,-9.92,;36.27,-10.71,;34.9,-9.89,;33.56,-10.66,;33.56,-12.2,)|

Cc1cc(Nc2ccc3ccccc3c2)n2ncnc2n1

Cc1cc(n2c(n1)ncn2)Nc3ccc4cc5ccccc5cc4c3

Cc1cc(Nc2ccccc2)n2ncnc2n1

Cc1cc(Nc2cccc(Cl)c2)n2ncnc2n1

Cc1cc(Nc2ccc(Cl)cc2)n2ncnc2n1

Cc1cc(Nc2ccc(Br)cc2)n2ncnc2n1

Cc1cc(n2c(n1)ncn2)Nc3ccc(cc3)C(F)(F)F

Cc1cc(Nc2ccc(OC(F)(F)F)cc2)n2ncnc2n1

Cc1cc(Nc2ccc(Cl)c(c2)C(F)(F)F)n2ncnc2n1

Cc1cc(Nc2ccc(Br)c(c2)C(F)(F)F)n2ncnc2n1

Cc1cc(Nc2ccc(C)c(c2)C(F)(F)F)n2ncnc2n1

Cc1cc(Nc2ccc(C)c(C)c2)n2ncnc2n1

Cc1cc(Nc2ccc(C)c(F)c2)n2ncnc2n1

Cc1cc(Nc2ccc(c(F)c2)C(F)(F)F)n2ncnc2n1