0 B13R2.531 COC(=O)C1=CC2=C(C=CS2)N1 ALBB-020303 [0,1,0,0,0,0|2,0,0]=3 1 B11R1.35 O=C(O)C(=O)NC1=NC=CS1 ALBB-018690 [0,0,1,0,0,0|2,0,0]=3 2 B11R1.35 O=C(O)C(=O)NC1=NN=CS1 ALBB-009502 [0,0,1,0,0,0|3,0,0]=4 3 B11R1.90 CC1=C(\C=C\C(=O)O)SC=C1 ALBB-007473 [0,0,1,0,0,0|1,0,1]=3 4 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=CS2 ALBB-015542 [0,0,0,0,0,1|2,0,0]=3 5 B13R2.430 O=C(O)C1=CC=C2N=CNC2=C1 ALBB-008407 [0,0,0,0,0,1|3,0,0]=4 6 B13R2.430 O=C(O)C1=CN2C=CN=C2C=C1 ALBB-027668 [0,0,0,0,0,1|3,0,0]=4 7 B13R2.430 OC(=O)C1=CC2=C(C=C1)C=CN2 ALBB-006287 [0,0,0,0,0,1|2,0,0]=3 8 B13R2.435 CC(=O)C1=NC2=CC=CC=C2N1 ALBB-020352 [0,0,0,0,0,1|3,0,0]=4 9 B13R2.435 NC(=O)C1=NC2=CC=CC=C2N1 ALBB-035730 [0,0,0,0,0,1|3,0,0]=4 10 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 ALBB-016356 [0,0,0,0,0,1|2,0,0]=3 11 B13R2.435 O=C(O)C1=CC2=CC=CC=C2S1 ALBB-032943 [0,0,0,0,0,1|2,0,0]=3 12 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 ALBB-014746 [0,0,0,0,0,1|2,0,1]=4 13 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 ALBB-010231 [0,0,0,0,0,1|2,0,0]=3 14 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 ALBB-010231 [0,0,0,0,0,1|2,0,0]=3 15 B10R1.66 O=C(Cl)\C=C\C1=CC=CS1 ALBB-011741 [1,0,1,0,0,0|2,0,0]=4 16 B10R1.66 O=C(O)\C=C\C1=CC=CO1 ALBB-011720 [1,0,1,0,0,0|1,1,0]=4 17 B10R1.66 O=C(O)\C=C\C1=CC=CS1 ALBB-011721 [1,0,1,0,0,0|1,0,0]=3 18 B10R1.66 O=C(O)\C=C\C1=CNC=N1 ALBB-025618 [1,0,1,0,0,0|2,0,0]=4 19 B10R1.66 O=C(O)\C=C\C1=CNC=N1 ALBB-025618 [1,0,1,0,0,0|2,0,0]=4 20 B10R1.66 O=[N+]([O-])\C=C\C1=CSC=C1 ALBB-031219 [1,0,1,0,0,0|1,0,1]=4 21 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=C2 ALBB-006388 [0,1,0,0,0,1|2,0,0]=4 22 B14R2.966 COC(=O)C1=CC=C2C=CNC2=C1 ALBB-008919 [0,1,0,0,0,1|2,0,0]=4 23 B14R2.5719 CN1C=CC2=CC(C(=O)O)=CC=C21 ALBB-014094 [0,1,0,0,0,1|2,0,0]=4 24 B14R2.5998 O=C(O)C1=CN=C2SC=CN2C1=O ALBB-028079 [0,1,0,0,0,1|1,0,1]=4 25 B14R2.24358 CN1C=CC2=CC=C(C(=O)O)C=C21 ALBB-014085 [0,1,0,0,0,1|2,0,0]=4 26 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 ALBB-000192 [0,1,0,0,0,1|2,0,0]=4 27 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 ALBB-007751 [0,1,0,0,0,1|1,0,0]=3 28 B14R2.450 NC1=C(C(=O)O)SC2=NC=CC=C21 ALBB-004830 [0,1,0,0,0,1|2,0,0]=4 29 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)S1 ALBB-000118 [0,1,0,0,0,1|2,0,0]=4 30 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)N1 ALBB-019237 [0,1,0,0,0,1|1,0,0]=3 31 B14R2.972 COC(=O)C1=CC2=CC=CC=C2S1 ALBB-024206 [0,1,0,0,0,1|2,0,0]=4 32 B14R2.972 COC(=O)C1=NC2=CC=CC=C2N1 ALBB-034539 [0,1,0,0,0,1|2,0,0]=4 33 B14R2.4529 CC1=CC2=C(C=C1)N=C(C(=O)O)N2 ALBB-012415 [0,1,0,0,0,1|2,0,0]=4 34 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=C1 ALBB-032679 [0,1,0,0,0,1|1,0,0]=3 35 B14R2.4529 NC1=CC=C2SC(C(=O)O)=CC2=C1 ALBB-026199 [0,1,0,0,0,1|2,0,0]=4 36 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)S1 ALBB-028255 [0,1,0,0,0,1|2,0,0]=4 37 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 ALBB-007015 [0,1,0,0,0,1|1,0,0]=3 38 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)S1 ALBB-028243 [0,1,0,0,0,1|2,0,0]=4 39 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 ALBB-006019 [0,1,0,0,0,1|1,0,0]=3 40 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2O1 ALBB-024355 [0,1,0,0,0,1|2,0,0]=4 41 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)S1 ALBB-028254 [0,1,0,0,0,1|2,0,0]=4 42 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CC=C2N1 ALBB-005030 [0,1,0,0,0,1|1,0,0]=3 43 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Cl)=CC=C2 ALBB-028249 [0,1,0,0,0,1|2,0,0]=4 44 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 ALBB-005031 [0,1,0,0,0,1|1,0,0]=3 45 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2N1 ALBB-005032 [0,1,0,0,0,1|1,0,0]=3 46 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O ALBB-025649 [0,0,1,0,0,1|2,0,0]=4 47 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 ALBB-009501 [0,0,1,0,0,1|2,0,0]=4 48 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 ALBB-007550 [0,0,1,0,0,1|2,0,0]=4 49 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br ALBB-011738 [0,0,1,0,0,1|2,0,0]=4 50 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl ALBB-006017 [0,0,1,0,0,1|2,0,0]=4 51 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F ALBB-011736 [0,0,1,0,0,1|2,0,0]=4 52 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O ALBB-025832 [0,0,1,0,0,1|2,0,0]=4 53 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 ALBB-021134 [0,0,1,0,0,1|2,0,0]=4 54 B12R1.226 CC1=CC=CC(\C=C/C(=O)O)=N1 ALBB-024569 [0,0,1,0,0,1|2,0,0]=4 55 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 ALBB-005232 [0,0,1,0,0,1|1,0,0]=3 56 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 ALBB-006261 [0,0,1,0,0,1|2,0,0]=4 57 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 ALBB-007482 [0,0,1,0,0,1|2,0,0]=4 58 B12R2.32 O=CC1=NC2=CC=CC=C2N1 ALBB-012175 [1,0,0,0,0,1|2,0,0]=4 59 B12R2.44 O=CC1=CC=C2C=CNC2=C1 ALBB-004799 [1,0,0,0,0,1|2,0,0]=4 60 B12R2.44 O=CC1=CC=C2NC=CC2=C1 ALBB-004800 [1,0,0,0,0,1|2,0,0]=4 61 B14R2.781 O=C(O)C1=CC2=CC=CC=C2OC1 ALBB-018358 [0,0,0,0,0,2|2,0,0]=4 62 B14R2.781 O=C(O)C1=CC=C2C=CC=CC2=N1 ALBB-005959 [0,0,0,0,0,2|1,0,1]=4 63 B14R2.781 O=C(O)C1=NC2=C(C=CC=C2)N=C1 ALBB-023929 [0,0,0,0,0,2|1,0,1]=4 64 B14R2.781 O=C(O)C1=NC2=NC=CC=C2C=C1 ALBB-030610 [0,0,0,0,0,2|1,0,1]=4 65 B14R2.768 O=C(O)CC1=NC2=CC=CC=C2N1 ALBB-022312 [0,0,0,0,0,2|2,0,0]=4