0 B13R1.386 CNCC1=CC(OC)=C(OC)C=C1 ALBB-027044 [0,0,0,0,0,0|1,0,1]=2 1 B13R1.386 COC1=C(OC)C=C(CC#N)C=C1 ALBB-010707 [0,0,0,0,0,0|1,0,1]=2 2 B13R1.386 COC1=C(OC)C=C(\C=N\O)C=C1 ALBB-023265 [0,0,0,0,0,0|2,0,1]=3 3 B13R1.386 COC1=CC=C(N=C=O)C=C1OC ALBB-007509 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.78 CNC1=CC=C(CN)C=C1NC ALBB-035542 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.78 COC1=C(CCl)C=C(C=O)C=C1 ALBB-000105 [1,0,0,0,0,0|3,0,0]=4 6 B12R1.78 COC1=CC=C(C=O)C=C1CO ALBB-026329 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.286 CCCC1=CC=C(O)C(OC)=C1 ALBB-032237 [1,0,0,0,0,0|0,0,2]=3 8 B12R1.286 COC1=C(O)C=CC(SC#N)=C1 ALBB-025686 [1,0,0,0,0,0|2,0,1]=4 9 B14R1.793 COC1=C(OC)C=C(CCCN)C=C1 ALBB-027060 [0,1,0,0,0,0|0,0,2]=3 10 B14R1.1864 CCC(N)C1=CC(OC)=C(OC)C=C1 ALBB-027096 [0,1,0,0,0,0|0,0,2]=3 11 B14R1.1864 COC1=C(OC)C=C(C(=O)CCl)C=C1 ALBB-018551 [0,1,0,0,0,0|1,0,2]=4 12 B14R1.1864 COC1=C(OC)C=C(C(=O)NN)C=C1 ALBB-025727 [0,1,0,0,0,0|2,0,1]=4 13 B14R1.1864 COC1=C(OC)C=C(\C(N)=N\O)C=C1 ALBB-034692 [0,1,0,0,0,0|2,0,1]=4 14 B14R1.1864 COC1=CC=C(C(=O)CBr)C=C1OC ALBB-020924 [0,1,0,0,0,0|1,0,2]=4 15 B14R1.3651 COC1=C(OC)C=C(CC(C)O)C=C1 ALBB-025780 [0,1,0,0,0,0|0,0,2]=3 16 B14R2.112 O=C=NC1=CC2=C(C=C1)OCCO2 ALBB-003046 [0,0,0,1,0,0|2,0,1]=4 17 B14R2.112 O\N=C\C1=CC2=C(C=C1)OCCO2 ALBB-033893 [0,0,0,1,0,0|2,0,1]=4 18 B11R1.280 COC1=CC(CN)=CC=C1O ALBB-006263 [2,0,0,0,0,0|1,0,0]=3 19 B11R1.189 CNCC1=CC=CC(OC)=C1 ALBB-013359 [2,0,0,0,0,0|1,0,1]=4 20 B11R1.189 CNCC1=CC=CC(OC)=C1 ALBB-013359 [2,0,0,0,0,0|1,0,1]=4 21 B11R1.189 COC1=CC(CNN)=CC=C1 ALBB-012472 [2,0,0,0,0,0|2,0,0]=4 22 B11R1.83 CNCC1=CC=C(OC)C=C1 ALBB-027042 [2,0,0,0,0,0|1,0,1]=4 23 B13R1.355 CCOC1=C(OC)C=CC(CN)=C1 ALBB-027046 [1,1,0,0,0,0|1,0,0]=3 24 B13R1.355 CCOC1=CC(C=O)=CC=C1OC ALBB-001312 [1,1,0,0,0,0|1,0,0]=3 25 B13R1.355 COCC1=C(OC)C=CC(C=O)=C1 ALBB-000221 [1,1,0,0,0,0|1,0,0]=3 26 B13R1.434 COC1=C(OC)C(Br)=CC(C=O)=C1 ALBB-001375 [1,1,0,0,0,0|1,0,0]=3 27 B13R1.434 COC1=C(OC)C(O)=CC(C=O)=C1 ALBB-029863 [1,1,0,0,0,0|1,0,0]=3 28 B13R1.434 COC1=CC(C=O)=CC(Cl)=C1OC ALBB-034979 [1,1,0,0,0,0|1,0,0]=3 29 B13R1.1249 CCOC1=C(OC)C=C(C=O)C=C1 ALBB-007462 [1,1,0,0,0,0|1,0,0]=3 30 B13R1.2200 COC1=C(OC)C=C(CCl)C(Br)=C1 ALBB-028493 [1,1,0,0,0,0|1,0,0]=3 31 B13R1.2200 COC1=CC(Br)=C(C=O)C=C1OC ALBB-001366 [1,1,0,0,0,0|1,0,0]=3 32 B13R1.2422 COC1=C(OC)C(Cl)=C(C=O)C=C1 ALBB-005908 [1,1,0,0,0,0|1,0,0]=3 33 B13R1.2430 COC1=C(C(C)C)C=C(C=O)C=C1 ALBB-031726 [1,1,0,0,0,0|2,0,0]=4 34 B13R1.3091 COC1=C(OC)C=C(C(C)N)C=C1 ALBB-000038 [1,1,0,0,0,0|0,0,1]=3 35 B13R1.49 CCC(O)C1=CC=C(O)C(OC)=C1 ALBB-025817 [1,1,0,0,0,0|0,0,2]=4 36 B13R1.49 COC1=C(O)C=CC(C(O)C#N)=C1 ALBB-023630 [1,1,0,0,0,0|1,0,1]=4 37 B13R1.35 COC1=C(Cl)C=C(CC(=O)O)C=C1 ALBB-006058 [1,1,0,0,0,0|2,0,0]=4 38 B13R1.35 COC1=C(F)C=C(CC(=O)O)C=C1 ALBB-006387 [1,1,0,0,0,0|2,0,0]=4 39 B13R1.3088 CCC(N)C1=CC(C)=C(OC)C=C1 ALBB-027099 [1,1,0,0,0,0|0,0,2]=4 40 B15R1.815 COC1=CC=C(C(=O)CC#N)C=C1OC ALBB-027423 [0,2,0,0,0,0|1,0,1]=4 41 B15R1.3769 COC1=C(OC)C=C(CC(=O)NN)C=C1 ALBB-001039 [0,2,0,0,0,0|1,0,0]=3 42 B15R1.3769 COC1=CC=C(NC(=O)CCl)C=C1OC ALBB-002422 [0,2,0,0,0,0|1,0,1]=4 43 B15R1.12854 COC1=CC=C(\C=C\C(=O)Cl)C=C1OC ALBB-011367 [0,2,0,0,0,0|0,0,1]=3 44 B15R1.12854 COC1=CC=C(\C=C\C(=O)O)C=C1OC ALBB-004705 [0,2,0,0,0,0|0,0,1]=3 45 B15R1.12855 COC1=C(OC)C=C(C(OC)OC)C=C1 ALBB-033134 [0,2,0,0,0,0|1,0,1]=4 46 B15R1.3705 CNCC1=CC(OC)=C(OC)C(OC)=C1 ALBB-025354 [0,2,0,0,0,0|1,0,1]=4 47 B15R1.9641 CCOC1=CC=C(CC#N)C=C1OCC ALBB-020763 [0,2,0,0,0,0|1,0,1]=4 48 B13R2.57 O=CC1=CC2=C(C=C1)OCCO2 ALBB-023646 [1,0,0,1,0,0|1,0,0]=3 49 B13R2.449 CCCC1=CC=C2OCOC2=C1 ALBB-035773 [1,0,0,1,0,0|0,0,2]=4 50 B15R2.21574 COC1=C(OC)C=C2C(=O)OCC2=C1 ALBB-020808 [0,1,0,1,0,0|1,0,0]=3 51 B15R2.2035 COC1=C(OC)C=C2NC(S)=NC2=C1 ALBB-024177 [0,1,0,1,0,0|2,0,0]=4 52 B13R1.3911 CNCC1=CC=CC(OC)=C1OC ALBB-026207 [0,0,0,0,1,1|1,0,1]=4