0 B10R1.10 CC1=CC=CC(CCN)=N1 ALBB-014354 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.10 CCNC1=NC(C)=CC=C1 ALBB-028024 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.10 CNCC1=CC(O)=CC=C1 ALBB-004075 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.10 COCC1=CC=CC(N)=C1 ALBB-024619 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.10 N#CCC1=NC(Cl)=CC=C1 ALBB-032455 [0,0,0,0,0,0|2,0,2]=4 5 B10R1.10 NC1=CC=CC(CCO)=N1 ALBB-033070 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.10 NNCC1=CC(Cl)=CC=C1 ALBB-022670 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.2 C=CC1=CC(O)=CC=C1 ALBB-026649 [1,0,0,0,0,0|0,0,2]=3 8 B9R1.2 CC1=CC=CC(CN)=N1 ALBB-027664 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.2 CC1=CC=CC(NN)=N1 ALBB-033444 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.2 CC1=NC=CC(CN)=N1 ALBB-015171 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.2 CCC1=CC=NC(N)=N1 ALBB-016460 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.2 CCC1=CC=NC(O)=N1 ALBB-016459 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.2 NNC1=NC(Br)=CC=C1 ALBB-014764 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.2 NNC1=NC(Br)=CC=C1 ALBB-014764 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.8 CCNC1=CC=CN=C1 ALBB-028026 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.8 NCCC1=NC=CN=C1 ALBB-014355 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.8 NCCC1=NC=CN=C1 ALBB-014355 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.24 CC1=CC=CC(CCCN)=C1 ALBB-027048 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.24 CC1=CC=CC(CN=[N+]=[N-])=C1 ALBB-029848 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.24 NCCOC1=CC(Br)=CC=C1 ALBB-025488 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.157 CN(C)CC1=CC(S)=CC=C1 ALBB-015299 [0,1,0,0,0,0|2,1,0]=4 22 B11R1.192 CCOC1=CC(N)=C(N)C=C1 ALBB-026815 [0,1,0,0,0,0|3,0,0]=4 23 B11R2.36 ClC1=CC=C2NC=NC2=C1 ALBB-024654 [0,0,0,1,0,0|2,0,1]=4 24 B11R2.36 FC1=CC=C2NC=NC2=C1 ALBB-028794 [0,0,0,1,0,0|2,0,1]=4 25 B11R2.36 NC1=CC2=C(C=C1)NCC2 ALBB-007400 [0,0,0,1,0,0|1,0,0]=2 26 B11R2.36 OC1=CC=C2NC=NC2=C1 ALBB-022265 [0,0,0,1,0,0|1,0,1]=3 27 B11R2.106 CC1=C2NN=CC2=CC=C1 ALBB-006340 [0,0,0,1,0,0|2,0,1]=4 28 B9R1.7 CC1=CN(CCN)N=C1 ALBB-014651 [0,0,0,0,1,0|3,0,0]=4 29 B9R1.7 CC1=CN(CCN)N=C1 ALBB-014651 [0,0,0,0,1,0|3,0,0]=4 30 B9R1.7 CC1=CN=C(CCN)S1 ALBB-015222 [0,0,0,0,1,0|3,0,0]=4 31 B9R1.7 NCCC1=CSC(N)=N1 ALBB-018572 [0,0,0,0,1,0|3,0,0]=4 32 B9R1.33 CC1=C(CCN)N=CN1 ALBB-030504 [0,0,0,0,1,0|3,0,0]=4 33 B9R1.33 CC1=C(CCN)SC=N1 ALBB-015196 [0,0,0,0,1,0|3,0,0]=4 34 B9R1.33 CC1=NC=CN1CCN ALBB-010783 [0,0,0,0,1,0|3,0,0]=4 35 B9R1.33 CN1C=CN=C1CCN ALBB-015244 [0,0,0,0,1,0|3,0,0]=4 36 B9R1.33 CN1N=CC=C1CCN ALBB-021667 [0,0,0,0,1,0|3,0,0]=4 37 B8R1.2 NCC1=NC=CN=C1 ALBB-027348 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.2 NCC1=NC=CN=C1 ALBB-027348 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.2 NCC1=NC=NC=C1 ALBB-018328 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.2 CN1C=CC=C(CN)C1=O ALBB-034620 [1,1,0,0,0,0|2,0,0]=4 41 B10R1.30 CCC1=C(O)C=CC(C)=N1 ALBB-019184 [1,1,0,0,0,0|2,0,0]=4 42 B10R1.30 CCC1=C(O)C=CC(C)=N1 ALBB-019184 [1,1,0,0,0,0|2,0,0]=4 43 B10R1.113 CC(N)C1=CC=CC(O)=C1 ALBB-019157 [1,1,0,0,0,0|0,0,0]=2 44 B10R1.172 NCC1=CC(CO)=CC=C1 ALBB-022272 [1,1,0,0,0,0|0,0,0]=2 45 B10R1.172 NCC1=CC(CO)=CC=C1 ALBB-022272 [1,1,0,0,0,0|0,0,0]=2 46 B10R1.176 CCC1=CC(N)=C(O)C=C1 ALBB-010241 [1,1,0,0,0,0|1,0,0]=3 47 B10R1.1 CNCC1=CC=C(Br)C=C1 ALBB-021485 [1,1,0,0,0,0|2,0,0]=4 48 B10R1.1 CNCC1=CC=C(O)C=C1 ALBB-004091 [1,1,0,0,0,0|2,0,0]=4 49 B10R1.4 CC1=CC=CC=C1CNN ALBB-012492 [1,1,0,0,0,0|1,0,0]=3 50 B10R1.15 CC(NN)C1=CC=CN=C1 ALBB-018062 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.15 CC(NN)C1=CC=NC=C1 ALBB-018061 [1,1,0,0,0,0|2,0,0]=4 52 B10R1.17 BrCCCC1=CC=CN=C1 ALBB-021980 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.17 ClCCCC1=CC=NC=C1 ALBB-022002 [1,1,0,0,0,0|2,0,0]=4 54 B10R1.17 NCCCC1=CC=NC=C1 ALBB-022001 [1,1,0,0,0,0|1,0,0]=3 55 B10R1.18 N=C(N)CC1=CC=CC=C1 ALBB-033340 [1,1,0,0,0,0|0,0,1]=3 56 B10R1.18 N=C(N)CC1=CC=CN=C1 ALBB-004984 [1,1,0,0,0,0|1,0,1]=4 57 B12R1.544 CC1=CN=C(CNN)C(C)=C1O ALBB-030714 [0,2,0,0,0,0|2,0,0]=4 58 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 ALBB-028093 [0,2,0,0,0,0|0,0,1]=3 59 B12R1.226 CC(C)NCC1=CC(F)=CC=C1 ALBB-015148 [0,2,0,0,0,0|2,0,0]=4 60 B12R1.382 COC1=CC=CC(CCCN)=C1 ALBB-027053 [0,2,0,0,0,0|0,0,0]=2 61 B12R1.279 CCCC1=NC=CC(C(=O)O)=C1 ALBB-025482 [0,2,0,0,0,0|2,0,0]=4 62 B10R1.21 NCCSCC1=CC=CO1 ALBB-027080 [0,0,1,1,0,0|1,0,1]=4 63 B10R1.25 NCC1=C(O)C=C(O)C=C1 ALBB-014856 [0,0,1,1,0,0|1,0,1]=4 64 B12R2.202 O=C1NC2=C(O)C=CC=C2O1 ALBB-036479 [0,1,0,1,0,0|1,0,1]=4 65 B12R2.1081 OC1=C2CCNCC2=CC=C1 ALBB-029016 [0,1,0,1,0,0|1,0,0]=3 66 B12R2.24 BrC1=CC=C2NCCCC2=C1 ALBB-010224 [0,1,0,1,0,0|1,0,0]=3 67 B12R2.24 BrC1=CC=C2NCCCC2=C1 ALBB-010224 [0,1,0,1,0,0|1,0,0]=3 68 B12R2.24 FC1=CC=C2NCCCC2=C1 ALBB-025508 [0,1,0,1,0,0|1,0,0]=3 69 B12R2.606 CC1=NC2=CC(O)=CC=C2N1 ALBB-022264 [0,1,0,1,0,0|1,0,1]=4 70 B12R2.44 COC1=CC=C2NC=NC2=C1 ALBB-022267 [0,1,0,1,0,0|1,0,1]=4 71 B12R2.44 NCC1=CC=C2NCCC2=C1 ALBB-013525 [0,1,0,1,0,0|1,0,0]=3 72 B8R1.1 CC1=CC=C(CN)S1 ALBB-015179 [1,0,0,0,1,0|2,0,0]=4 73 B8R1.1 CCC1=CC(O)=NN1 ALBB-016424 [1,0,0,0,1,0|2,0,0]=4 74 B8R1.1 NCC1=CC=C(Br)S1 ALBB-026980 [1,0,0,0,1,0|2,0,0]=4 75 B8R1.11 CN1C=CC=C1CN ALBB-012806 [1,0,0,0,1,0|2,0,0]=4 76 B8R1.8 NCCC1=CSC=C1 ALBB-015286 [1,0,0,0,1,0|1,0,0]=3 77 B8R1.8 NCCC1=CSC=N1 ALBB-031920 [1,0,0,0,1,0|2,0,0]=4 78 B8R1.8 NCCC1=NC=CN1 ALBB-013489 [1,0,0,0,1,0|2,0,0]=4 79 B8R1.8 NCCC1=NC=CS1 ALBB-005159 [1,0,0,0,1,0|2,0,0]=4 80 B8R1.8 NCCC1=NC=CS1 ALBB-005159 [1,0,0,0,1,0|2,0,0]=4 81 B8R1.8 NCCC1=NC=CS1 ALBB-005159 [1,0,0,0,1,0|2,0,0]=4 82 B8R1.8 NCCC1=NNC=C1 ALBB-018082 [1,0,0,0,1,0|2,0,0]=4 83 B8R1.8 NCCN1C=CC=N1 ALBB-008647 [1,0,0,0,1,0|2,0,0]=4 84 B8R1.8 NCCN1C=CC=N1 ALBB-008647 [1,0,0,0,1,0|2,0,0]=4