0 B10R1.15 CC(NN)C1=CC=CN=C1 ALBB-018062 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.15 CC(NN)C1=CC=NC=C1 ALBB-018061 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 N=C(N)C1=CC=CC=C1 ALBB-021313 [1,0,0,0,0,0|1,0,1]=3 3 B9R1.8 CCNC1=CC=CN=C1 ALBB-028026 [1,0,0,0,0,0|3,0,0]=4 4 B9R1.8 NCCC1=NC=CN=C1 ALBB-014355 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.8 NCCC1=NC=CN=C1 ALBB-014355 [1,0,0,0,0,0|2,0,0]=3 6 B11R1.22 NC(CO)C1=CC=C(F)C=C1 ALBB-013455 [0,1,0,0,0,0|2,0,0]=3 7 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 ALBB-028043 [0,1,0,0,0,0|1,0,1]=3 8 B9R1.11 CC(CN)N1C=CC=N1 ALBB-021590 [0,0,0,0,1,0|2,0,0]=3 9 B9R1.11 CC(CN)N1C=CC=N1 ALBB-021590 [0,0,0,0,1,0|2,0,0]=3 10 B9R1.11 CC(CN)N1C=NC=N1 ALBB-027995 [0,0,0,0,1,0|3,0,0]=4 11 B9R1.11 CC(CO)N1C=CC=N1 ALBB-004087 [0,0,0,0,1,0|3,0,0]=4 12 B9R1.11 NCC(=O)C1=CSC=C1 ALBB-028035 [0,0,0,0,1,0|2,0,1]=4 13 B11R1.40 CC(CN)OC1=CC=CN=C1 ALBB-010790 [0,0,0,0,0,1|1,0,0]=2 14 B11R1.40 O=C(CBr)NC1=CC=CC=C1 ALBB-011957 [0,0,0,0,0,1|2,0,1]=4 15 B8R1.2 NCC1=NC=CN=C1 ALBB-027348 [2,0,0,0,0,0|2,0,0]=4 16 B8R1.2 NCC1=NC=CN=C1 ALBB-027348 [2,0,0,0,0,0|2,0,0]=4 17 B8R1.2 NCC1=NC=NC=C1 ALBB-018328 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.13 CC(C)C1=CN=C(Cl)N=C1 ALBB-018585 [1,1,0,0,0,0|2,0,0]=4 19 B10R1.13 CC(C)C1=CN=C(O)N=C1 ALBB-018586 [1,1,0,0,0,0|2,0,0]=4 20 B10R1.61 CN(C)C1=C(N)C=NC=C1 ALBB-010447 [1,1,0,0,0,0|2,0,0]=4 21 B10R1.113 CC(C)C1=NC=CC(N)=N1 ALBB-034438 [1,1,0,0,0,0|2,0,0]=4 22 B10R1.113 CC(N)C1=CC=CC(O)=C1 ALBB-019157 [1,1,0,0,0,0|0,0,0]=2 23 B10R1.113 CN(C)C1=NC=CC(N)=C1 ALBB-032733 [1,1,0,0,0,0|2,0,0]=4 24 B10R1.1 CNCC1=CC=C(Br)C=C1 ALBB-021485 [1,1,0,0,0,0|2,0,0]=4 25 B10R1.1 CNCC1=CC=C(O)C=C1 ALBB-004091 [1,1,0,0,0,0|2,0,0]=4 26 B10R1.4 CC1=CC=CC=C1CNN ALBB-012492 [1,1,0,0,0,0|1,0,0]=3 27 B10R1.10 CC1=CC=CC(CCN)=N1 ALBB-014354 [1,1,0,0,0,0|1,0,0]=3 28 B10R1.10 CNCC1=CC(O)=CC=C1 ALBB-004075 [1,1,0,0,0,0|2,0,0]=4 29 B10R1.10 COCC1=CC=CC(N)=C1 ALBB-024619 [1,1,0,0,0,0|2,0,0]=4 30 B10R1.10 NC1=CC=CC(CCO)=N1 ALBB-033070 [1,1,0,0,0,0|2,0,0]=4 31 B10R1.10 NNCC1=CC(Cl)=CC=C1 ALBB-022670 [1,1,0,0,0,0|1,0,0]=3 32 B10R1.17 BrCCCC1=CC=CN=C1 ALBB-021980 [1,1,0,0,0,0|2,0,0]=4 33 B10R1.17 ClCCCC1=CC=NC=C1 ALBB-022002 [1,1,0,0,0,0|2,0,0]=4 34 B10R1.17 NCCCC1=CC=NC=C1 ALBB-022001 [1,1,0,0,0,0|1,0,0]=3 35 B10R1.18 N=C(N)CC1=CC=CC=C1 ALBB-033340 [1,1,0,0,0,0|0,0,1]=3 36 B10R1.18 N=C(N)CC1=CC=CN=C1 ALBB-004984 [1,1,0,0,0,0|1,0,1]=4 37 B10R1.9 CCC(CN)N1C=CC=N1 ALBB-021594 [0,1,0,0,1,0|2,0,0]=4 38 B10R1.11 CC(CCN)N1C=CN=C1 ALBB-013451 [0,1,0,0,1,0|2,0,0]=4 39 B10R1.14 CC1=NN(C(C)CN)C=C1 ALBB-021598 [0,1,0,0,1,0|2,0,0]=4 40 B12R1.371 NC(CO)CC1=CC=CC=C1F ALBB-033341 [0,1,0,0,0,1|2,0,0]=4 41 B12R1.253 CC(N)(C(=O)O)C1=CC=CC=C1 ALBB-025597 [0,2,0,0,0,0|1,0,1]=4 42 B12R1.478 CN(C)C(CN)C1=CC=NC=C1 ALBB-032262 [0,2,0,0,0,0|1,0,0]=3 43 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 ALBB-027102 [0,2,0,0,0,0|2,0,0]=4 44 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 ALBB-010684 [0,2,0,0,0,0|2,0,0]=4 45 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 ALBB-028093 [0,2,0,0,0,0|1,0,1]=4 46 B10R2.136 C1=CN(C2CNC2)N=C1 ALBB-022629 [0,0,0,1,1,0|2,0,0]=4 47 B12R2.24 NC1CCC2=C(C=CC=C2)C1 ALBB-025644 [0,0,0,1,0,1|2,0,0]=4 48 B12R2.32 NCC1=CC2=CC=CC=C2O1 ALBB-024720 [0,0,0,1,0,1|0,0,2]=4 49 B12R2.32 NCC1=NC2=CC=CC=C2N1 ALBB-000022 [0,0,0,1,0,1|1,0,1]=4 50 B12R2.32 NCC1=NC2=CC=CC=C2O1 ALBB-005882 [0,0,0,1,0,1|1,0,1]=4 51 B12R2.94 NC1(CC2=CC=CC=C2)CC1 ALBB-012211 [0,0,0,1,0,1|2,0,0]=4 52 B12R2.48 NCC1(C2=CC=CC=C2)CC1 ALBB-024886 [0,1,0,1,0,0|0,0,0]=2 53 B12R2.48 NCC1(C2=CC=CC=C2)CC1 ALBB-024886 [0,1,0,1,0,0|0,0,0]=2 54 B12R2.1 OCC1=NNC2=C1C=CC=C2 ALBB-024433 [0,1,0,1,0,0|1,0,1]=4 55 B12R2.2 C1=CC(C2CCCN2)=CC=N1 ALBB-029977 [0,1,0,1,0,0|2,0,0]=4 56 B12R2.1081 CN1CCNC2=CC=CN=C21 ALBB-020105 [0,1,0,1,0,0|2,0,0]=4 57 B12R2.290 NC1(C2=CC=C(Cl)C=C2)CC1 ALBB-014859 [0,1,0,1,0,0|2,0,0]=4 58 B8R1.7 CC(C)C1=CNN=C1 ALBB-018584 [1,0,0,0,1,0|2,0,0]=4 59 B8R1.7 CC(C)C1=CNN=C1 ALBB-018584 [1,0,0,0,1,0|2,0,0]=4 60 B8R1.7 CC(N)C1=CSC=N1 ALBB-015230 [1,0,0,0,1,0|2,0,0]=4 61 B8R1.8 NCCC1=CSC=C1 ALBB-015286 [1,0,0,0,1,0|1,0,0]=3 62 B8R1.8 NCCC1=CSC=N1 ALBB-031920 [1,0,0,0,1,0|2,0,0]=4 63 B8R1.8 NCCC1=NC=CN1 ALBB-013489 [1,0,0,0,1,0|2,0,0]=4 64 B8R1.8 NCCC1=NC=CS1 ALBB-005159 [1,0,0,0,1,0|2,0,0]=4 65 B8R1.8 NCCC1=NC=CS1 ALBB-005159 [1,0,0,0,1,0|2,0,0]=4 66 B8R1.8 NCCC1=NC=CS1 ALBB-005159 [1,0,0,0,1,0|2,0,0]=4 67 B8R1.8 NCCC1=NNC=C1 ALBB-018082 [1,0,0,0,1,0|2,0,0]=4 68 B8R1.8 NCCN1C=CC=N1 ALBB-008647 [1,0,0,0,1,0|2,0,0]=4 69 B8R1.8 NCCN1C=CC=N1 ALBB-008647 [1,0,0,0,1,0|2,0,0]=4