0 B15R2.6 NC(=O)CCN1C=NC2=CC=CC=C21 BB54-2414 [1,0,0,0,0,0|2,0,1]=4 1 B15R2.6 O=C(O)CCC1=CNC2=CC=CC=C12 BB01-7425 [1,0,0,0,0,0|0,0,0]=1 2 B15R2.6 O=C(O)CCN1N=CC2=C1C=CC=C2 BB01-8274 [1,0,0,0,0,0|3,0,0]=4 3 B15R2.6 O=C(O)CCN1N=NC2=CC=CC=C21 BB55-3559 [1,0,0,0,0,0|2,0,1]=4 4 B17R2.7 COC(=O)C(N)CC1=CNC2=C1C=CC=C2 BB12-3443 [0,1,0,0,0,0|0,0,0]=1 5 B17R2.2473 CC(C)(O)C(N)CC1=CNC2=CC=CC=C12 BB01-7168 [0,1,0,0,0,0|1,0,1]=3 6 B17R2.3450 NC(CC1=CNC2=C1C=CC(Br)=C2)C(=O)O BB31-7920 [0,1,0,0,0,0|0,0,0]=1 7 B17R2.3450 N[C@H](CC1=CNC2=C1C=CC(Br)=C2)C(=O)O BB32-2381 [0,1,0,0,0,0|0,0,0]=1 8 B17R2.5003 NC(CC1C(=O)NC2=C1C=CC=C2)C(=O)O BB54-4278 [0,1,0,0,0,0|0,0,1]=2 9 B17R2.25461 NC(CC1=CNC2=C1C=C(Br)C=C2)C(=O)O BB31-5648 [0,1,0,0,0,0|0,0,0]=1 10 B17R2.37147 N[C@@H](CC1=CNC2=C(Br)C=CC=C12)C(=O)O BB32-3925 [0,1,0,0,0,0|0,0,0]=1 11 B17R2.37552 N[C@@H](CC1=CNC2=CC=CC(Cl)=C12)C(=O)O BB32-2278 [0,1,0,0,0,0|0,0,0]=1 12 B17R2.37552 N[C@H](CC1=CNC2=CC=CC(F)=C12)C(=O)O BB31-8896 [0,1,0,0,0,0|0,0,0]=1 13 B17R2.45515 CC(C1=CNC2=C1C=CC=C2)C(O)C(=O)O BB54-3164 [0,1,0,0,0,0|1,0,0]=2 14 B15R1.3664 N[C@@H](CCOCC1=CC=CC=C1)C(=O)O BB32-3131 [0,0,1,0,0,0|2,0,1]=4 15 B15R1.3664 N[C@H](CCOCC1=CC=CC=C1)C(=O)O BB31-8929 [0,0,1,0,0,0|2,0,1]=4 16 B15R2.1255 O=C(O)C(=O)C1=CNC2=C1C=CC=C2 BB55-7570 [0,0,0,0,1,0|1,0,1]=3 17 B14R1.161 NC(CCC1=C(Cl)C=CC=C1)C(=O)O BB31-1129 [1,0,1,0,0,0|1,0,1]=4 18 B14R2.2 O=C(O)CC1=CNC2=CC=CC=C12 BB56-1705 [2,0,0,0,0,0|1,0,1]=4 19 B14R2.3 NCCCC1=CNC2=CC=CC=C12 BB56-0917 [2,0,0,0,0,0|1,0,1]=4 20 B16R2.14 NNC(=O)CCC1=CNC2=C1C=CC=C2 BB01-0043 [1,1,0,0,0,0|1,0,0]=3 21 B16R2.2976 CC1=CC=C2C(=C1)C=CN2CCC(=O)O BB55-8633 [1,1,0,0,0,0|2,0,0]=4 22 B16R2.4003 O=C(O)CCN1C(=O)SC2=CC=CC=C21 BB01-1788 [1,1,0,0,0,0|2,0,0]=4 23 B16R2.15551 CC1=CC=C2C=CN(CCC(=O)O)C2=C1 BB27-0015 [1,1,0,0,0,0|2,0,0]=4 24 B16R2.15551 O=C(O)CCN1C=CC2=CC=C(Cl)C=C21 BB55-8632 [1,1,0,0,0,0|2,0,0]=4 25 B16R2.22833 O=C(O)CCN1C=CC2=C(Cl)C=CC=C21 BB27-0021 [1,1,0,0,0,0|2,0,0]=4 26 B16R2.104522 CC1=CN(CCC(=O)O)C2=CC=CC=C12 BB27-0016 [1,1,0,0,0,0|2,0,0]=4 27 B16R2.104522 CN1C=C(CCC(=O)O)C2=CC=CC=C21 BB01-1230 [1,1,0,0,0,0|0,0,0]=2 28 B16R2.104522 CN1C=C(SCC(=O)O)C2=C1C=CC=C2 BB54-0438 [1,1,0,0,0,0|1,0,0]=3 29 B18R2.120970 COC1=CC2=C(C=C1)NC=C2CC(N)C(=O)O BB12-3442 [0,2,0,0,0,0|0,0,0]=2 30 B16R2.6284 NC(C(=O)O)C1=CC2=CC=CC=C2C=C1 BB56-0069 [0,0,1,1,0,0|1,0,1]=4 31 B16R2.244415 NC(C(=O)O)C1=CC=CC2=CC=CC=C21 BB56-0052 [0,0,1,1,0,0|1,0,1]=4 32 B18R3.115616 O=C(O)[C@@H]1CC2=C(CN1)NC3=CC=CC=C32 BB12-2200 [0,1,0,1,0,0|0,0,0]=2 33 B14R2.95 N\C(=N/O)C1=CNC2=C1C=CC=C2 BB50-0405 [1,0,0,0,1,0|1,0,1]=4 34 B16R2.477 O=C(O)COC1=CC2=CC=CC=C2C=C1 BB17-2113 [1,0,0,0,0,1|2,0,0]=4 35 B16R2.179941 O=C(O)COC1=CC=CC2=CC=CC=C21 BB12-4630 [1,0,0,0,0,1|2,0,0]=4 36 B16R2.179941 O=C(O)CSC1=CC=CC2=C1C=CC=C2 BB26-0847 [1,0,0,0,0,1|2,0,0]=4