0 B12R2.1081 ClC1=NC=CC2=C1C=CC=C2 ALBB-023931 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.1081 ClC1=NN=CC2=CC=CC=C21 ALBB-033921 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 ALBB-023501 [0,0,0,0,0,0|1,0,0]=1 3 B12R2.1081 NC1=CC=CC2=C1C=CC=N2 ALBB-021975 [0,0,0,0,0,0|3,0,0]=3 4 B12R2.1081 NC1=NC=CC2=C1C=CC=C2 ALBB-021325 [0,0,0,0,0,0|3,0,0]=3 5 B12R2.1081 NC1=NC=NC2=CC=CC=C21 ALBB-005413 [0,0,0,0,0,0|4,0,0]=4 6 B12R2.1081 O=C1NC=CC2=CC=CC=C12 ALBB-023588 [0,0,0,0,0,0|2,0,1]=3 7 B12R2.1081 O=C1NC=NC2=CC=CC=C12 ALBB-012761 [0,0,0,0,0,0|3,0,1]=4 8 B12R2.1081 O=C1NN=CC2=C1C=CC=C2 ALBB-028398 [0,0,0,0,0,0|3,0,1]=4 9 B12R2.1081 OC1=CC=CC2=C1C=CC=N2 ALBB-021972 [0,0,0,0,0,0|2,0,0]=2 10 B12R2.1081 OC1=CC=NC2=CC=CC=C12 ALBB-019954 [0,0,0,0,0,0|2,0,0]=2 11 B12R2.1081 OC1=CN=NC2=CC=CC=C12 ALBB-019489 [0,0,0,0,0,0|3,0,0]=3 12 B12R2.1081 SC1=NC=NC2=CC=CC=C21 ALBB-023577 [0,0,0,0,0,0|3,1,0]=4 13 B12R2.1081 SC1=NN=CC2=CC=CC=C21 ALBB-024229 [0,0,0,0,0,0|3,1,0]=4 14 B13R2.32 CC1=CC=C2N=CC=CC2=C1Br ALBB-026378 [0,1,0,0,0,0|3,0,0]=4 15 B13R2.32 CC1=[N+](C)C2=CC=CC=C2C=C1 ALBB-026425 [0,1,0,0,0,0|3,0,0]=4 16 B13R2.32 CN1C(=O)C=CC2=CC=CC=C21 ALBB-032305 [0,1,0,0,0,0|3,0,0]=4 17 B13R2.32 NC1=C(O)C=CC2=CC=CC=C21 ALBB-025726 [0,1,0,0,0,0|2,0,0]=3 18 B13R2.32 O=C1C(Br)=CSC2=CC=CC=C12 ALBB-034433 [0,1,0,0,0,0|2,0,1]=4 19 B13R2.162 CC1=CC=C2C=CC=C(N)C2=N1 ALBB-027739 [0,1,0,0,0,0|1,0,0]=2 20 B13R2.162 NC1=NC2=C(C=CC=C2O)C=C1 ALBB-021953 [0,1,0,0,0,0|0,0,0]=1 21 B13R2.162 O=C1C=CC2=C(N1)C(O)=CC=C2 ALBB-021966 [0,1,0,0,0,0|0,0,1]=2 22 B13R2.162 OC1=CC=CC2=C1N=C(Cl)C=C2 ALBB-021957 [0,1,0,0,0,0|0,0,0]=1 23 B13R2.328 CC1=CC(Cl)=NC2=CC=CC=C12 ALBB-031604 [0,1,0,0,0,0|3,0,0]=4 24 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 ALBB-026701 [0,1,0,0,0,0|3,0,0]=4 25 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=C1 ALBB-019949 [0,1,0,0,0,0|3,0,0]=4 26 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=C1 ALBB-019949 [0,1,0,0,0,0|3,0,0]=4 27 B13R2.328 CC1=NC2=CC=CC=C2C(O)=C1 ALBB-019943 [0,1,0,0,0,0|2,0,0]=3 28 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)N1 ALBB-006386 [0,1,0,0,0,0|2,0,0]=3 29 B13R2.371 CC1=C2N=CC=CC2=C(Br)C=C1 ALBB-026376 [0,1,0,0,0,0|1,0,0]=2 30 B13R2.1613 N#CC1=CN=CC2=CC=CC=C12 ALBB-023701 [0,1,0,0,0,0|3,0,0]=4 31 B13R2.1613 NCC1=CC=CC2=CC=CC=C21 ALBB-025707 [0,1,0,0,0,0|2,0,0]=3 32 B13R2.1613 NNC1=NC=CC2=CC=CC=C21 ALBB-025405 [0,1,0,0,0,0|3,0,0]=4 33 B13R2.1613 NNC1=NC=CC2=CC=CC=C21 ALBB-025405 [0,1,0,0,0,0|3,0,0]=4 34 B13R2.1613 O=CC1=C2C=CN=CC2=CC=C1 ALBB-011852 [0,1,0,0,0,0|2,0,1]=4 35 B13R2.1613 OCC1=C2C=CC=NC2=CC=C1 ALBB-014217 [0,1,0,0,0,0|2,0,0]=3 36 B13R2.1613 OCC1=C2N=CC=CC2=CC=C1 ALBB-014216 [0,1,0,0,0,0|0,0,0]=1 37 B13R2.5179 CC1=CC=C2C(C)=CC=CC2=C1 ALBB-013849 [0,1,0,0,0,0|2,0,0]=3 38 B13R2.5179 O=C1C=CNC2=CC(Cl)=CC=C12 ALBB-024683 [0,1,0,0,0,0|2,0,1]=4 39 B13R2.5179 SC1=CC=NC2=CC(Cl)=CC=C12 ALBB-023883 [0,1,0,0,0,0|2,1,0]=4 40 B11R1.13 O\N=C\C1=C(O)C(O)=CC=C1 ALBB-027201 [0,0,1,0,0,0|3,0,0]=4 41 B11R2.1 ON1N=NC2=C1N=CC=C2 ALBB-006385 [0,0,0,0,1,0|3,0,0]=4 42 B11R2.106 CC1=CC=CC2=C1C=CN2 ALBB-006050 [0,0,0,0,1,0|2,0,0]=3 43 B11R2.106 ClC1=C2NC=CC2=CC=C1 ALBB-014230 [0,0,0,0,1,0|1,0,1]=3 44 B11R2.106 ClC1=CC=CC2=C1C=CN2 ALBB-006049 [0,0,0,0,1,0|2,0,0]=3 45 B11R2.106 NC1=C2C=CNC2=CC=C1 ALBB-032635 [0,0,0,0,1,0|2,0,0]=3 46 B11R2.106 NC1=CC=CC2=NON=C12 ALBB-000347 [0,0,0,0,1,0|3,0,0]=4 47 B11R2.106 NC1=CC=CC2=NSN=C12 ALBB-000349 [0,0,0,0,1,0|3,0,0]=4 48 B10R1.17 C=CCNC1=CC=CC=C1 ALBB-032919 [1,0,1,0,0,0|0,0,2]=4 49 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O ALBB-025832 [0,1,1,0,0,0|2,0,0]=4 50 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 ALBB-021134 [0,1,1,0,0,0|2,0,0]=4 51 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 ALBB-005232 [0,1,1,0,0,0|2,0,0]=4 52 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 ALBB-006261 [0,1,1,0,0,0|1,0,0]=3 53 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 ALBB-007482 [0,1,1,0,0,0|2,0,0]=4 54 B12R1.27 CC(\C=C\C1=CC=CC=C1)=N/O ALBB-036261 [0,1,1,0,0,0|2,0,0]=4 55 B12R1.27 COC(=O)\C=C\C1=CC=CN=C1 ALBB-033989 [0,1,1,0,0,0|2,0,0]=4 56 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 ALBB-025860 [1,1,0,0,0,0|0,0,0]=2 57 B12R2.24 FC1=CC2=CC=CC=C2C=C1 ALBB-035360 [1,1,0,0,0,0|1,0,0]=3 58 B12R2.24 NC1=CC2=CC=CC=C2N=C1 ALBB-008921 [1,1,0,0,0,0|0,0,0]=2 59 B12R2.24 NC1=CC=C2N=CC=CC2=C1 ALBB-014510 [1,1,0,0,0,0|0,0,0]=2 60 B12R2.24 NC1=CC=C2N=CC=NC2=C1 ALBB-013497 [1,1,0,0,0,0|1,0,0]=3 61 B12R2.24 O=C1C=NC2=CC=CC=C2N1 ALBB-024162 [1,1,0,0,0,0|1,0,0]=3 62 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 ALBB-021965 [1,1,0,0,0,0|0,0,0]=2 63 B12R2.24 OC1=CC2=C(C=CC=N2)C=C1 ALBB-021973 [1,1,0,0,0,0|0,0,0]=2 64 B12R2.2028 O=C1NC(=O)C2=NC=CC=C12 ALBB-026495 [0,1,0,0,1,0|1,0,1]=4 65 B12R2.202 CC1=C2N=C(S)NC2=CC=C1 ALBB-004067 [0,1,0,0,1,0|2,0,0]=4 66 B12R2.315 N#CC1=C2C=CNC2=CC=C1 ALBB-004773 [0,1,0,0,1,0|2,0,0]=4 67 B12R2.315 NCC1=C2C=CNC2=CC=C1 ALBB-014315 [0,1,0,0,1,0|2,0,0]=4 68 B12R2.315 O=CC1=C2C=CNC2=CC=C1 ALBB-004801 [0,1,0,0,1,0|1,0,1]=4 69 B14R2.7724 CC1=CC(C)=C(O)C2=C1C=CC=N2 ALBB-021961 [0,2,0,0,0,0|0,0,0]=2 70 B14R2.7724 OC1=C(Br)C=C(Cl)C2=CC=CN=C21 ALBB-033421 [0,2,0,0,0,0|0,0,0]=2 71 B14R2.7724 OC1=C(I)C=C(Cl)C2=C1N=CC=C2 ALBB-031653 [0,2,0,0,0,0|0,0,0]=2 72 B14R2.142 N#CC1=NC2=C(O)C=CC=C2C=C1 ALBB-027854 [0,2,0,0,0,0|0,0,0]=2 73 B14R2.142 O=CC1=NC2=C(C=CC=C2O)C=C1 ALBB-021958 [0,2,0,0,0,0|0,0,0]=2 74 B14R2.8045 CC1=CC(=O)NC2=C1C=CC=C2C ALBB-024208 [0,2,0,0,0,0|1,0,1]=4 75 B14R2.8045 CC1=CC(Cl)=NC2=C(C)C=CC=C12 ALBB-026135 [0,2,0,0,0,0|1,0,0]=3 76 B14R2.8045 CC1=CC=CN2C(=O)C=C(O)N=C12 ALBB-033394 [0,2,0,0,0,0|2,0,0]=4 77 B14R2.8235 CC1=CC=C2OC(=O)C=C(O)C2=C1 ALBB-007066 [0,2,0,0,0,0|2,0,0]=4 78 B14R2.8751 CC1=CC=C(O)C2=C1C=CC(C)=N2 ALBB-021960 [0,2,0,0,0,0|0,0,0]=2 79 B14R2.11684 COC1=CC=CC2=CC=C(C)N=C21 ALBB-027820 [0,2,0,0,0,0|0,0,0]=2 80 B14R2.1131 CC1=C2N=CC=CC2=C(C=O)C=C1 ALBB-014358 [0,2,0,0,0,0|1,0,0]=3 81 B14R2.1131 COC1=C2N=CC=CC2=C(Br)C=C1 ALBB-026377 [0,2,0,0,0,0|0,0,0]=2 82 B14R2.1131 FC1=CC=C(CCl)C2=CC=CC=C12 ALBB-024892 [0,2,0,0,0,0|2,0,0]=4 83 B14R2.1131 O=NC1=C2C=CC=NC2=C(O)C=C1 ALBB-023716 [0,2,0,0,0,0|0,0,0]=2 84 B14R2.1131 OC1=C2N=CC=CC2=C(CCl)C=C1 ALBB-010263 [0,2,0,0,0,0|0,0,0]=2 85 B14R2.1131 OCC1=C2C=CC=NC2=C(O)C=C1 ALBB-010716 [0,2,0,0,0,0|0,0,0]=2 86 B14R2.7150 NCCC1=CC=CC2=CC=CC=C21 ALBB-025417 [0,2,0,0,0,0|2,0,0]=4 87 B14R2.31359 CC(N)C1=CC=CC2=C1C=CC=C2 ALBB-002137 [0,2,0,0,0,0|2,0,0]=4 88 B14R2.31359 CC(N)C1=CC=CC2=C1C=CC=C2 ALBB-002137 [0,2,0,0,0,0|2,0,0]=4 89 B14R2.31359 O=C(O)C1=C2C=CC=CC2=CC=N1 ALBB-005987 [0,2,0,0,0,0|2,0,0]=4 90 B14R2.31359 O=C(O)C1=C2N=CC=CC2=CC=C1 ALBB-011848 [0,2,0,0,0,0|0,0,0]=2 91 B14R2.31359 O=C(O)C1=CC=NC2=C1C=CC=C2 ALBB-010275 [0,2,0,0,0,0|2,0,0]=4 92 B14R2.31359 OB(O)C1=C2C=CN=CC2=CC=C1 ALBB-011851 [0,2,0,0,0,0|2,0,0]=4 93 B14R2.31359 OB(O)C1=C2N=CC=CC2=CC=C1 ALBB-011847 [0,2,0,0,0,0|0,0,0]=2 94 B14R2.1801 COC1=CC2=C(C=C1)C(O)=CC=N2 ALBB-021964 [0,2,0,0,0,0|2,0,0]=4 95 B12R2.2 C1=CN=C(C2=NNC=C2)C=C1 ALBB-017219 [0,0,1,1,0,0|2,0,0]=4 96 B12R2.32 C=CC1=NC2=C(C=CC=C2)N1 ALBB-016094 [0,0,1,1,0,0|1,0,0]=3 97 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 ALBB-026692 [0,0,1,1,0,0|1,0,1]=4 98 B12R2.32 NNC1=NC2=C(C=CC=C2)O1 ALBB-006596 [0,0,1,1,0,0|2,0,0]=4 99 B12R2.32 O=CC1=NC2=CC=CC=C2N1 ALBB-012175 [0,0,1,1,0,0|2,0,0]=4 100 B12R2.32 O=CC1=NC2=CC=CC=C2S1 ALBB-015206 [0,0,1,1,0,0|1,1,0]=4 101 B10R2.7 C1=CC2=NC=CN2C=C1 ALBB-022744 [1,0,0,0,1,0|1,0,0]=3 102 B10R2.7 C1=CC2=NC=CN2C=C1 ALBB-022744 [1,0,0,0,1,0|1,0,0]=3 103 B10R2.7 C1=CN2C=CN=C2N=C1 ALBB-027689 [1,0,0,0,1,0|2,0,0]=4 104 B10R2.7 C1=CN2C=CN=C2N=C1 ALBB-027689 [1,0,0,0,1,0|2,0,0]=4