0 B14R1.540 CN(C)CC\C(=N\O)C1=CC=CC=C1 SBB025857 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.45 CC(=O)CCC(=O)C1=CC=CC=C1 SBB071424 [1,0,0,0,0,0|1,0,2]=4 2 B13R1.45 CN(C)CCC(=O)C1=CC=CC=C1 SBB068823 [1,0,0,0,0,0|1,0,1]=3 3 B13R1.45 CN(C)\C=C/C(=O)C1=CC=CC=C1 SBB023014 [1,0,0,0,0,0|1,0,1]=3 4 B13R1.45 CN(C)\C=C\C(=O)C1=CC=CC=N1 SBB083302 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.45 CN(C)\C=C\C(=O)C1=CC=CN=C1 SBB065455 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.45 CN(C)\C=N\C(=O)C1=CC=CC=C1 SBB055111 [1,0,0,0,0,0|2,0,1]=4 7 B13R1.45 [NH+](C)(C)CCC(=O)C1=CC=CC=C1 SBB057905 [1,0,0,0,0,0|1,0,1]=3 8 B15R2.39201 CC(=O)N1C=C(C=O)C2=C1C=CC=C2 SBB066667 [0,0,0,1,0,0|2,0,1]=4 9 B15R2.39201 CC(C)N1C=C(C=O)C2=C1C=CC=C2 SBB010759 [0,0,0,1,0,0|1,0,0]=2 10 B13R1.713 CN(C)\C=C(/C#N)C1=CC=CC=C1 SBB082376 [0,0,0,0,1,0|2,0,1]=4 11 B12R1.30 CCCCC(=O)C1=CC=CC=C1 SBB064862 [2,0,0,0,0,0|0,0,1]=3 12 B12R1.30 CCCNC(=O)C1=CC=CC=C1 SBB058554 [2,0,0,0,0,0|1,0,0]=3 13 B12R1.30 CCCOC(=O)C1=CC=CC=C1 SBB061241 [2,0,0,0,0,0|1,0,0]=3 14 B12R1.30 CCCOC(=O)C1=CN=CC=C1 SBB061278 [2,0,0,0,0,0|2,0,0]=4 15 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 SBB008196 [2,0,0,0,0,0|2,0,0]=4 16 B14R1.149 CC1=CC=CC(C(=O)\C=C/N(C)C)=C1 SBB021396 [1,1,0,0,0,0|1,0,1]=4 17 B14R1.149 CN(C)\C=C/C(=O)C1=CC(Cl)=CC=C1 SBB023816 [1,1,0,0,0,0|1,0,1]=4 18 B14R1.160 CC(C)COC(=O)C1=C(N)C=CC=C1 SBB017731 [1,1,0,0,0,0|1,0,0]=3 19 B14R1.163 CCC(C)COC(=O)C1=CC=CC=C1 SBB061296 [1,1,0,0,0,0|1,0,0]=3 20 B14R1.678 CC(C)COC(=O)C1=CC=C(N)C=C1 SBB073012 [1,1,0,0,0,0|1,0,0]=3 21 B14R1.678 CC(C)COC(=O)C1=CC=C(O)C=C1 SBB080168 [1,1,0,0,0,0|1,0,0]=3 22 B14R1.678 CC1=CC=C(C(=O)\C=C/N(C)C)C=C1 SBB021404 [1,1,0,0,0,0|1,0,1]=4 23 B14R1.678 CN(C)CCC(=O)C1=CC=C(Cl)C=C1 SBB100369 [1,1,0,0,0,0|1,0,1]=4 24 B14R1.678 CN(C)\C=C/C(=O)C1=CC=C(Br)C=C1 SBB022074 [1,1,0,0,0,0|1,0,1]=4 25 B14R1.678 CN(C)\C=C/C(=O)C1=CC=C(Cl)C=C1 SBB021406 [1,1,0,0,0,0|1,0,1]=4 26 B14R1.678 CN(C)\C=C/C(=O)C1=CC=C(F)C=C1 SBB021399 [1,1,0,0,0,0|1,0,1]=4 27 B14R2.19587 CCN1C=C(C=O)C2=C1C=CC=C2 SBB010556 [1,0,0,1,0,0|1,0,0]=3 28 B14R2.2 N1C=C(CN(C)C)C2=C1C=CC=C2 SBB003799 [0,0,0,1,1,0|2,0,0]=4 29 B16R2.1625 CC(C)CN1C2=CC=CC=C2N=C1C=O SBB018394 [0,0,0,1,0,1|1,0,0]=3 30 B16R2.48623 CC(C)N1C=C(C=O)C2=C1C=C(F)C=C2 SBB011105 [0,1,0,1,0,0|1,0,0]=3 31 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SBB040798 [1,0,0,0,1,0|1,0,1]=4 32 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 SBB058207 [1,0,0,0,1,0|1,0,0]=3 33 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 SBB063237 [1,0,0,0,1,0|1,0,0]=3 34 B14R1.420 CC(C)CCOC(=O)C1=CC=CC=C1 SBB068552 [1,0,0,0,0,1|0,0,1]=3 35 B14R1.423 CC(C)CNC(=O)NC1=CC=CC=C1 SBB056570 [1,0,0,0,0,1|1,0,0]=3