0 B14R2.781 O=[N+]([O-])C1=CC=C2N=CC=NC2=C1 ALBB-013496 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.57 ClCC1=CC2=CC=CC=C2N=C1 ALBB-026975 [1,0,0,0,0,0|2,0,1]=4 2 B13R2.57 N#CC1=CC=C2C=CC=NC2=C1 ALBB-008693 [1,0,0,0,0,0|2,0,1]=4 3 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 ALBB-011839 [1,0,0,0,0,0|2,0,1]=4 4 B13R2.57 NCC1=CC=C2N=CC=CC2=C1 ALBB-011845 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 ALBB-014214 [1,0,0,0,0,0|2,0,1]=4 6 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 ALBB-014214 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.57 O=CC1=CC2=CC=CC=C2OC1 ALBB-007354 [1,0,0,0,0,0|1,0,1]=3 8 B15R2.627 O=C(O)C1=CN=C2C=CC=CN2C1=O ALBB-035259 [0,1,0,0,0,0|3,0,0]=4 9 B15R2.7174 CC(=O)C1=CC2=C(C=C1)NCC(=O)N2 ALBB-014555 [0,1,0,0,0,0|2,0,1]=4 10 B15R2.7174 CC(=O)C1=CC2=C(C=C1)SCC(=O)N2 ALBB-014556 [0,1,0,0,0,0|2,0,1]=4 11 B13R1.351 CC(=O)\C(Cl)=N/NC1=CC=CC=C1 ALBB-032222 [0,0,1,0,0,0|3,0,0]=4 12 B13R2.72 N=C(N)C1=CNC2=CC=CC=C21 ALBB-028907 [0,0,0,0,1,0|3,0,0]=4 13 B13R2.430 CC(=O)C1=CC=C2NC=CC2=C1 ALBB-022742 [0,0,0,0,1,0|1,0,0]=2 14 B13R2.430 NC(=O)C1=CN2C=CN=C2C=C1 ALBB-027962 [0,0,0,0,1,0|3,0,0]=4 15 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 ALBB-016902 [0,0,0,0,1,0|1,0,0]=2 16 B13R2.435 CC(=O)C1=CN2C=CC=CC2=C1 ALBB-014800 [0,0,0,0,1,0|1,0,0]=2 17 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2S1 ALBB-015211 [0,0,0,0,1,0|3,0,0]=4 18 B12R2.24 NC1=CC=C2C=CC=NC2=C1 ALBB-026714 [2,0,0,0,0,0|2,0,0]=4 19 B14R1.1031 COC(=O)\C(=C\C1=CC=CC=C1)CN ALBB-031511 [0,1,1,0,0,0|1,0,1]=4 20 B14R2.142 COC1=CC=C2C=CC=C(N)C2=C1 ALBB-033453 [1,1,0,0,0,0|1,0,0]=3 21 B14R2.1128 CC1=NC2=CC=CC=C2N=C1C=O ALBB-010338 [1,1,0,0,0,0|2,0,0]=4 22 B14R2.2332 O=CC1=NC2=CC=C(Cl)C=C2C=C1 ALBB-027856 [1,1,0,0,0,0|1,0,0]=3 23 B14R2.300 CC(=O)N1N=CC2=C1C=CC(Br)=C2 ALBB-031290 [0,1,0,0,1,0|2,0,0]=4 24 B14R2.300 CC1=CC2=C(C=C1)C(C(=O)Cl)=CS2 ALBB-011319 [0,1,0,0,1,0|2,0,0]=4 25 B14R2.642 CC(=O)C1=C(C)N=C2C=CC=CN21 ALBB-024685 [0,1,0,0,1,0|2,0,0]=4 26 B14R2.966 COC(=O)C1=CN2C=CN=C2C=C1 ALBB-027952 [0,1,0,0,1,0|2,0,0]=4 27 B14R2.450 CC(=O)C1=C(N)C2=CC=CN=C2O1 ALBB-034060 [0,1,0,0,1,0|2,0,0]=4 28 B14R2.450 CC1=C(C(N)=O)NC2=CC=CC=C21 ALBB-014488 [0,1,0,0,1,0|2,0,0]=4 29 B14R2.450 NC(=O)C1=CC2=CC=CC=C2N1C ALBB-020133 [0,1,0,0,1,0|2,0,0]=4 30 B14R2.4529 CC(=O)C1=NC2=CC=C(F)C=C2N1 ALBB-014440 [0,1,0,0,1,0|2,0,0]=4 31 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)S1 ALBB-028242 [0,1,0,0,1,0|2,0,0]=4 32 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)S1 ALBB-028241 [0,1,0,0,1,0|2,0,0]=4 33 B16R2.3989 O=C(O)CC1=CC2=C(C=CC=C2)OC1=O ALBB-000194 [0,1,0,0,0,1|2,0,0]=4 34 B16R2.5347 O=C(CCl)NC1=CC2=CC=CC=C2N=C1 ALBB-013027 [0,1,0,0,0,1|1,0,0]=3 35 B16R2.23331 CN1C=C(C(=O)O)C(=O)C2=CC=CC=C21 ALBB-011542 [0,2,0,0,0,0|2,0,0]=4 36 B16R2.23521 O=C(Cl)C1=CC2=C(C=CC(Br)=C2)OC1=O ALBB-011333 [0,2,0,0,0,0|2,0,0]=4 37 B16R2.767 CCOC(=O)C1=CNC2=CC=CC=C2S1 ALBB-033844 [0,2,0,0,0,0|2,0,0]=4 38 B14R2.2 CC(=O)\C=C1/OCC2=C1C=CC=C2 ALBB-018647 [0,0,1,1,0,0|1,0,1]=4 39 B16R2.477 CC(O)COC1=CC2=CC=CC=C2C=C1 ALBB-032062 [0,0,0,0,0,2|0,0,2]=4