0 B11R2.1 BrC1=NNC2=NC=CC=C12 ALBB-022845 [0,0,0,0,0,0|3,0,0]=3 1 B11R2.1 NC1=NNC2=NC=CC=C12 ALBB-004826 [0,0,0,0,0,0|3,0,0]=3 2 B11R2.1 NC1=NOC2=C1N=CC=N2 ALBB-026490 [0,0,0,0,0,0|3,0,0]=3 3 B11R2.1 NC1=NOC2=NC=CC=C12 ALBB-008891 [0,0,0,0,0,0|2,0,0]=2 4 B12R2.1 NCC1=NN=C2C=CC=CN21 ALBB-031462 [0,1,0,0,0,0|3,0,0]=4 5 B12R2.1 OCC1=NNC2=C1C=CC=C2 ALBB-024433 [0,1,0,0,0,0|1,0,0]=2 6 B12R2.18 NC1NC2=CC=CC=C2C1=O ALBB-032691 [0,1,0,0,0,0|2,0,1]=4 7 B12R2.132 CC1=CC=C2CNC(=O)C2=C1 ALBB-022596 [0,1,0,0,0,0|1,0,2]=4 8 B12R2.132 NC1=NN=C2C=CC(Cl)=CN12 ALBB-032285 [0,1,0,0,0,0|3,0,0]=4 9 B12R2.196 NC1=NN=C2C(Cl)=CC=CN12 ALBB-033461 [0,1,0,0,0,0|3,0,0]=4 10 B12R2.203 CC1=NN=C2C=CC=C(Br)N12 ALBB-022799 [0,1,0,0,0,0|3,0,0]=4 11 B12R2.203 CC1=NOC2=C1C(=O)NN=C2 ALBB-033887 [0,1,0,0,0,0|3,0,0]=4 12 B12R2.203 NC1=NNC2=CC=CC(F)=C21 ALBB-013367 [0,1,0,0,0,0|2,0,0]=3 13 B12R2.612 CC1=CC=C2C(=C1)NN=C2I ALBB-022769 [0,1,0,0,0,0|2,0,0]=3 14 B12R2.612 CC1=NOC2=CC(O)=CC=C21 ALBB-016000 [0,1,0,0,0,0|1,0,0]=2 15 B12R2.612 CN1N=NC2=CC(N)=CC=C21 ALBB-031024 [0,1,0,0,0,0|3,0,0]=4 16 B12R2.2028 CN1N=C(N)C2=C1N=CC=C2 ALBB-031072 [0,1,0,0,0,0|3,0,0]=4 17 B10R1.61 N=C(N)C1=CC=CNC1=O ALBB-010782 [0,0,1,0,0,0|2,0,1]=4 18 B12R2.1081 NC1=CN=CC2=CC=CC=C12 ALBB-026672 [0,0,0,0,0,1|2,0,0]=3 19 B12R2.1081 SC1=NC=CC2=CC=CC=C21 ALBB-024539 [0,0,0,0,0,1|1,1,0]=3 20 B9R1.6 N=C(N)C1=CC=CC=C1 ALBB-021313 [1,0,1,0,0,0|1,0,0]=3 21 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 ALBB-019900 [0,1,1,0,0,0|1,0,0]=3 22 B11R1.22 O=C(NO)C1=CC=C(F)C=C1 ALBB-033760 [0,1,1,0,0,0|0,0,2]=4 23 B11R1.23 N\C(=N/O)C1=CC(Cl)=NC=C1 ALBB-016411 [0,1,1,0,0,0|2,0,0]=4 24 B11R1.23 N\C(=N\O)C1=CC(F)=CC=C1 ALBB-019858 [0,1,1,0,0,0|1,0,0]=3 25 B11R1.222 N\C(=N/O)C1=C(Cl)N=CC=C1 ALBB-016410 [0,1,1,0,0,0|2,0,0]=4 26 B11R1.37 COC1=C(C=O)C=C(O)C=C1 ALBB-024747 [0,1,1,0,0,0|1,0,1]=4 27 B11R1.53 NCC1=C(C(=O)O)C=CC=C1 ALBB-012876 [0,1,1,0,0,0|1,0,1]=4 28 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 ALBB-019497 [0,1,1,0,0,0|1,0,1]=4 29 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 ALBB-021333 [1,1,0,0,0,0|2,0,0]=4 30 B11R2.10 NC1=NC2=CC=CC=C2O1 ALBB-005881 [1,1,0,0,0,0|2,0,0]=4 31 B11R2.36 CC1=CC=C2C=NNC2=C1 ALBB-022768 [1,1,0,0,0,0|1,0,0]=3 32 B11R2.106 CC1=C2N=NNC2=CC=C1 ALBB-005409 [1,1,0,0,0,0|2,0,0]=4 33 B11R2.106 CC1=C2NN=CC2=CC=C1 ALBB-006340 [1,1,0,0,0,0|1,0,0]=3 34 B11R2.106 NC1=C2N=NNC2=CC=C1 ALBB-011924 [1,1,0,0,0,0|2,0,0]=4 35 B11R2.106 NC1=C2N=NNC2=CC=C1 ALBB-011924 [1,1,0,0,0,0|2,0,0]=4 36 B13R2.57 O=CC1=CC2=CC=CC=C2OC1 ALBB-007354 [0,1,0,0,0,1|1,0,1]=4 37 B13R2.155 NC1=CC=C2OCC(=O)NC2=C1 ALBB-010331 [0,1,0,0,0,1|1,0,1]=4 38 B13R2.1613 NCC1=CN=CC2=CC=CC=C21 ALBB-036572 [0,1,0,0,0,1|2,0,0]=4 39 B13R2.1 CNCC1=COC2=CC=CC=C12 ALBB-018337 [0,2,0,0,0,0|2,0,0]=4 40 B13R2.2130 COC1=CC=C2C(=O)COC2=C1 ALBB-014714 [0,2,0,0,0,0|1,0,1]=4 41 B13R2.33 O=C1COC2=CC=CC=C2CN1 ALBB-024340 [0,0,0,0,0,2|1,0,1]=4