0 B13R1.45 CN(C)CCC(N)C1=CC=CC=C1 BB05-4727 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.45 CN(C)CCC(N)C1=CC=CC=C1 BB57-4297 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.45 CN(C)\C=C\C(=O)C1=CC=CC=C1 BB12-4188 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.30 NCCNC(=O)C1=CC=CC=C1 BB32-0721 [1,0,0,0,0,0|2,0,0]=3 4 B14R1.160 CN(C)\C=C\C(=O)C1=C(Cl)C=CC=C1 BB12-4443 [0,1,0,0,0,0|2,0,1]=4 5 B14R1.540 CN(C)CC\C(=N/O)C1=CC=CC=C1 BB05-4085 [0,1,0,0,0,0|2,0,1]=4 6 B14R1.678 CC(=O)CCC(=O)C1=CC=C(Br)C=C1 BB20-0476 [0,1,0,0,0,0|2,0,1]=4 7 B14R1.678 CC1=CC=C(C(=O)\C=C\N(C)C)C=C1 BB12-4189 [0,1,0,0,0,0|2,0,1]=4 8 B14R1.678 CN(C)\C=C\C(=O)C1=CC=C(Br)C=C1 BB12-4192 [0,1,0,0,0,0|2,0,1]=4 9 B14R1.678 CN(C)\C=C\C(=O)C1=CC=C(Cl)C=C1 BB12-4191 [0,1,0,0,0,0|2,0,1]=4 10 B14R1.678 CN(C)\C=C\C(=O)C1=CC=C(F)C=C1 BB12-4190 [0,1,0,0,0,0|2,0,1]=4 11 B14R2.422 O=C(C1=CC=CC=C1)N2CC(O)C2 BB32-1734 [0,0,0,1,0,0|2,0,0]=3 12 B14R2.792 S=C(NCC1CC1)C2=CC=CN=C2 BB20-3359 [0,0,0,1,0,0|2,1,0]=4 13 B14R2.792 S=C(NCC1CC1)C2=CC=NC=C2 BB20-3356 [0,0,0,1,0,0|2,1,0]=4 14 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 BB12-2875 [0,0,0,0,1,0|1,0,1]=3 15 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 BB58-0616 [0,0,0,0,1,0|1,0,1]=3 16 B12R1.107 CC(C)NC(=S)C1=CC=CN=C1 BB20-3355 [0,0,0,0,1,0|2,1,0]=4 17 B11R1.16 CCOC(=O)C1=CC=NC=C1 BB12-2749 [2,0,0,0,0,0|1,0,0]=3 18 B11R1.28 NCCOCC1=CC=CC=C1 BB55-4803 [2,0,0,0,0,0|1,0,1]=4 19 B13R1.17 CCCNC(=O)C1=CC=C(N)C=C1 BB55-1692 [1,1,0,0,0,0|1,0,0]=3 20 B13R1.17 CCCNC(=O)C1=CN=C(Cl)C=C1 BB50-0235 [1,1,0,0,0,0|2,0,0]=4 21 B13R1.17 NC1=CC=C(C(=O)NCCO)C=C1 BB55-4918 [1,1,0,0,0,0|2,0,0]=4 22 B13R1.18 CCCOC(=O)C1=CC=CC(N)=C1 BB17-0322 [1,1,0,0,0,0|0,0,0]=2 23 B13R1.24 NCCCNC(=O)C1=CC=CC=C1 BB32-3477 [1,1,0,0,0,0|1,0,0]=3 24 B13R1.718 CC(CO)CNCC1=CC=CC=C1 BB57-2239 [1,1,0,0,0,0|1,0,1]=4 25 B13R1.3523 CC(C)(O)CNCC1=CC=CC=C1 BB58-2129 [1,1,0,0,0,0|1,0,1]=4 26 B13R1.132 CC(=O)CC(=O)C1=CC=C(C)C=C1 BB12-2877 [0,1,0,0,1,0|1,0,1]=4 27 B13R1.132 CC(=O)CC(=O)C1=CC=C(Cl)C=C1 BB32-3001 [0,1,0,0,1,0|1,0,1]=4 28 B13R1.132 CC(=O)CC(=O)C1=CC=C(F)C=C1 BB01-8027 [0,1,0,0,1,0|1,0,1]=4 29 B13R1.132 CC(C)NC(=O)C1=CC=C(N)C=C1 BB55-1690 [0,1,0,0,1,0|1,0,0]=3 30 B13R1.132 CC(C)OC(=O)C1=CC=C(N)C=C1 BB05-1927 [0,1,0,0,1,0|0,0,0]=2 31 B13R1.147 CC(C)NC(=O)C1=CC=CC(N)=C1 BB57-1186 [0,1,0,0,1,0|1,0,0]=3 32 B13R1.201 CC(=O)CC(=O)C1=C(Br)C=CC=C1 BB32-3227 [0,1,0,0,1,0|1,0,1]=4 33 B13R1.201 CC(=O)CC(=O)C1=C(F)C=CC=C1 BB31-7739 [0,1,0,0,1,0|1,0,1]=4 34 B13R1.201 CC(C)NC(=O)C1=CC=CC=C1N BB54-2440 [0,1,0,0,1,0|1,0,0]=3 35 B13R1.352 CS(=O)(=O)CC(=O)C1=CC=CC=C1 BB53-1337 [0,1,0,0,1,0|2,0,0]=4 36 B15R1.65 COC1=CC=CC(C(=O)CCN(C)C)=C1 BB57-2964 [0,2,0,0,0,0|2,0,0]=4 37 B15R1.903 CC(C)CNS(=O)(=O)C1=CC=C(N)C=C1 BB55-1632 [0,2,0,0,0,0|2,0,0]=4 38 B13R2.2931 COC1OC(=O)C2=CC=CC=C21 BB01-7776 [1,0,0,1,0,0|1,0,0]=3 39 B13R2.328 CC1=NC2=CC=CC=C2C(=O)O1 BB55-4970 [0,0,0,1,1,0|1,0,1]=4 40 B15R2.993 CC(C)CN1C(=S)NC2=CC=CC=C21 BB54-2305 [0,0,0,1,0,1|1,1,0]=4 41 B15R2.14951 CC(C)C1NC(=O)C2=CC=CC=C2N1 BB26-0719 [0,1,0,1,0,0|1,0,0]=3 42 B15R2.18934 CC1=CC=C(C2=NC(C)(C)CO2)C=C1 BB53-1395 [0,1,0,1,0,0|1,0,0]=3 43 B15R2.42976 O=S(=O)(OCC1CO1)C2=CC=CC=C2 BB20-3399 [0,1,0,1,0,0|2,0,0]=4 44 B11R1.91 CC(N)COC1=CC=CC=C1 BB58-0599 [1,0,0,0,1,0|1,0,0]=3 45 B11R1.91 CC(N)\C=C\C1=CC=CC=C1 BB12-1707 [1,0,0,0,1,0|1,0,1]=4 46 B11R1.36 CC(C)C(N)C1=CC=CC=C1 BB58-0614 [0,0,0,0,2,0|1,0,1]=4 47 B13R1.337 CC(C)CCNCC1=CC=CC=C1 BB32-2891 [1,0,0,0,0,1|1,0,1]=4