0 B14R1.540 CCC(NCC(C)C)C1=CC=CC=C1 CS-0260320 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.26 C=C=C(CCCC)C1=CC=CC=C1 CS-1014357 [1,0,0,0,0,0|1,0,2]=4 2 B13R1.45 CC(=O)COC(=O)C1=CC=CC=C1 CS-0110783 [1,0,0,0,0,0|2,0,1]=4 3 B13R1.45 CC(C)=NOC(=O)C1=CC=CC=C1 CS-0155160 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.45 CN(C)\C=N\C(=O)C1=CC=CC=C1 CS-0665006 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.713 CN(C)\C=C(\C#N)C1=CC=CC=C1 CS-0204848 [0,0,0,0,1,0|2,0,1]=4 6 B12R1.30 CCCCC(=O)C1=CC=CC=N1 CS-0205154 [2,0,0,0,0,0|1,0,1]=4 7 B12R1.30 CCCCC(=O)C1=CN=CC=C1 CS-0357971 [2,0,0,0,0,0|1,0,1]=4 8 B12R1.30 CCCNC(=O)C1=CC=CC=C1 CS-0339564 [2,0,0,0,0,0|1,0,0]=3 9 B12R1.30 CCCNC(=O)C1=CN=CC=C1 CS-0160379 [2,0,0,0,0,0|2,0,0]=4 10 B12R1.30 CCSCC(=O)C1=CC=CC=C1 CS-0239496 [2,0,0,0,0,0|1,0,1]=4 11 B12R1.30 CNCCC(=O)C1=CC=CC=C1 CS-0150996 [2,0,0,0,0,0|1,0,1]=4 12 B12R1.30 NCCNC(=O)C1=CC=CC=C1 CS-0215713 [2,0,0,0,0,0|2,0,0]=4 13 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 CS-0063826 [2,0,0,0,0,0|1,0,1]=4 14 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 CS-0117057 [2,0,0,0,0,0|2,0,0]=4 15 B12R1.30 O=C(NCCO)C1=CC=CC=C1 CS-0449058 [2,0,0,0,0,0|2,0,0]=4 16 B14R1.604 CCOC(=O)\C(=C\O)C1=CC=CC=C1 CS-0319451 [1,1,0,0,0,0|1,0,1]=4 17 B14R1.149 CC(C)CNC(=O)C1=CC(Br)=CC=C1 CS-0451185 [1,1,0,0,0,0|1,0,0]=3 18 B14R1.149 CC(C)CNC(=O)C1=CC=CC(O)=C1 CS-0513075 [1,1,0,0,0,0|1,0,0]=3 19 B14R1.149 CN(C)\C=C\C(=O)C1=CC(Br)=CC=C1 CS-0199790 [1,1,0,0,0,0|1,0,1]=4 20 B14R1.160 CN(C)\C=C\C(=O)C1=CC=CC=C1O CS-0468483 [1,1,0,0,0,0|1,0,1]=4 21 B14R1.163 CC(C#N)CNC(=O)C1=CC=CC=C1 CS-0233783 [1,1,0,0,0,0|1,0,1]=4 22 B14R1.417 CC(CN(C)C)C(=O)C1=CC=CC=C1 CS-W015844 [1,1,0,0,0,0|1,0,1]=4 23 B14R1.678 CC(C)CCC(=O)C1=CC=C(Cl)C=C1 CS-0251276 [1,1,0,0,0,0|0,0,1]=3 24 B14R1.678 CC(C)CNC(=O)C1=CC=C(Br)C=C1 CS-0205885 [1,1,0,0,0,0|1,0,0]=3 25 B14R1.678 CC(C)CNC(=O)C1=CC=C(N)C=C1 CS-0249844 [1,1,0,0,0,0|1,0,0]=3 26 B14R1.678 CN(C)\C=C\C(=O)C1=CC=C(Br)C=C1 CS-0783090 [1,1,0,0,0,0|1,0,1]=4 27 B14R1.678 CN(C)\C=C\C(=O)C1=CC=C(Cl)C=C1 CS-0783056 [1,1,0,0,0,0|1,0,1]=4 28 B14R1.813 CC(C)CNS(=O)(=O)C1=CC=CC=C1 CS-0259940 [1,1,0,0,0,0|2,0,0]=4 29 B14R1.3098 CC(C)(C)NOC(=O)C1=CC=CC=C1 CS-0454743 [1,1,0,0,0,0|2,0,0]=4 30 B14R1.6455 CC(C)NC(C(=O)O)C1=CC=CC=C1 CS-0236294 [0,1,0,0,1,0|1,0,1]=4 31 B14R2.2974 O=CC1(C2=CC=CC=C2)CCCC1 CS-0156492 [1,0,0,1,0,0|0,0,2]=4 32 B14R2.422 NC1CN(C(=O)C2=CC=CC=C2)C1 CS-0330555 [1,0,0,1,0,0|2,0,0]=4 33 B14R2.792 O=C(OCC1CO1)C2=CC=CC=C2 CS-0696928 [1,0,0,1,0,0|2,0,0]=4 34 B14R2.2 CC(C)CN1C=NC2=CC=CC=C21 CS-0274296 [0,0,0,1,1,0|2,0,0]=4 35 B14R2.598 NC1CC(=O)N(C2=CC=CC=C2)C1 CS-0117235 [0,0,0,1,1,0|2,0,0]=4 36 B14R2.1146 CC1=NC2=CC=CC=C2C(C=O)=C1 CS-0524386 [0,0,0,1,1,0|1,0,1]=4 37 B16R2.85 CC(C)C1=CC=C(C2=CC=CC=C2)C=C1 CS-0331279 [0,0,0,1,0,1|1,0,1]=4 38 B16R2.2888 CC(C)N1N=C(C2=CC=CC=C2)CC1=O CS-0247701 [0,1,0,1,0,0|2,0,0]=4 39 B12R1.107 CC(C)CC(=O)C1=NC=CC=C1 CS-0205229 [1,0,0,0,1,0|1,0,0]=3 40 B12R1.107 CC(C)C[C@@H](N)C1=CC=CC=C1 CS-0196532 [1,0,0,0,1,0|1,0,1]=4 41 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 CS-0667157 [1,0,0,0,1,0|1,0,0]=3 42 B12R1.107 CC(C)OC(=O)C1=CC=CN=C1 CS-0240172 [1,0,0,0,1,0|2,0,0]=4 43 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 CS-0435545 [1,0,0,0,1,0|1,0,0]=3 44 B14R1.420 CC(C)CCOC(=O)C1=CC=CC=C1 CS-0154227 [1,0,0,0,0,1|0,0,1]=3 45 B14R1.420 CN(C)CCCC(=O)C1=CC=CC=C1 CS-0451834 [1,0,0,0,0,1|1,0,1]=4 46 B14R1.420 CN(C)CCOC(=O)C1=CC=CC=C1 CS-W010683 [1,0,0,0,0,1|1,0,1]=4