0 B10R1.18 CC(N)CC1=CC=CN=C1 ALBB-010767 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.18 CC(N)CC1=CC=CN=C1 ALBB-010767 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.18 N=C(N)CC1=NC=CC=C1 ALBB-004970 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.18 N=C(N)NC1=CC=CC=C1 ALBB-019781 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.18 N=C(N)NC1=CC=CC=C1 ALBB-019781 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.8 ON=CC1=CC=CN=C1 ALBB-019926 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 ALBB-019786 [0,1,0,0,0,0|3,0,0]=4 7 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 ALBB-012017 [0,1,0,0,0,0|2,0,0]=3 8 B11R1.157 CC1=CC(NC(=N)N)=CC=C1 ALBB-019779 [0,1,0,0,0,0|3,0,0]=4 9 B11R1.157 CN(C)CC1=CC(Br)=CC=C1 ALBB-015268 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.157 N=C(N)NC1=CC=CC(F)=C1 ALBB-019788 [0,1,0,0,0,0|3,0,0]=4 11 B9R1.13 CC(=O)CN1C=CC=N1 ALBB-012023 [0,0,0,0,1,0|3,0,0]=4 12 B9R1.13 O=C(O)CC1=CC=CN1 ALBB-026954 [0,0,0,0,1,0|1,0,0]=2 13 B11R1.91 N=C(N)OCC1=CC=CC=C1 ALBB-024917 [0,0,0,0,0,1|2,0,0]=3 14 B11R1.91 O=C(O)CCC1=CC=NC=C1 ALBB-000158 [0,0,0,0,0,1|1,0,0]=2 15 B10R1.1 CC1=CC=C(N=C=O)C=C1 ALBB-021369 [1,1,0,0,0,0|1,0,1]=4 16 B10R1.1 NNCC1=CC=C(Cl)C=C1 ALBB-022671 [1,1,0,0,0,0|2,0,0]=4 17 B10R1.1 NNCC1=CC=C(F)C=C1 ALBB-022656 [1,1,0,0,0,0|2,0,0]=4 18 B10R1.4 C=CCC1=C(O)C=CC=C1 ALBB-020392 [1,1,0,0,0,0|1,0,0]=3 19 B10R1.4 NNCC1=C(F)C=CC=C1 ALBB-022654 [1,1,0,0,0,0|2,0,0]=4 20 B10R1.10 NNCC1=CC(F)=CC=C1 ALBB-022655 [1,1,0,0,0,0|2,0,0]=4 21 B10R1.10 O=S=NC1=CC=CC(Br)=C1 ALBB-026568 [1,1,0,0,0,0|2,0,0]=4 22 B10R1.17 NC\C=C\C1=CC=CC=C1 ALBB-015040 [1,1,0,0,0,0|1,0,1]=4 23 B10R1.17 OCCNC1=CC=CC=C1 ALBB-020698 [1,1,0,0,0,0|0,0,1]=3 24 B10R1.13 CC(O)C1=CC=C(N)C=C1 ALBB-006236 [0,1,0,0,1,0|1,0,1]=4 25 B10R1.54 NC1=NC(CC(=O)O)=CS1 ALBB-021297 [0,1,0,0,1,0|2,0,0]=4 26 B12R1.21 NC(=O)CSC1=CC=C(Cl)C=C1 ALBB-020403 [0,1,0,0,0,1|1,0,0]=3 27 B12R1.21 O=C(Cl)\C=C\C1=CC=C(Cl)C=C1 ALBB-011744 [0,1,0,0,0,1|1,0,1]=4 28 B12R1.21 O=C(O)CNC1=CC=C(I)C=C1 ALBB-030143 [0,1,0,0,0,1|0,0,0]=2 29 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 ALBB-031584 [0,1,0,0,0,1|1,0,0]=3 30 B12R1.43 O=C(O)\C(Cl)=C\C1=CC=CC=C1 ALBB-018356 [0,1,0,0,0,1|0,0,1]=3 31 B12R1.125 O=C(Cl)\C=C\C1=CC=CC=C1Cl ALBB-011742 [0,1,0,0,0,1|1,0,1]=4 32 B12R1.226 O=C(Cl)\C=C\C1=CC=CC(Cl)=C1 ALBB-011743 [0,1,0,0,0,1|1,0,1]=4 33 B12R1.226 O=C(O)COC1=CC(Cl)=CC=C1 ALBB-020981 [0,1,0,0,0,1|0,0,0]=2 34 B12R1.49 O=C(CBr)NC1=CC=C(F)C=C1 ALBB-011958 [0,2,0,0,0,0|2,0,0]=4 35 B12R1.233 CC(=O)NC1=C(Br)C=C(Cl)C=C1 ALBB-012013 [0,2,0,0,0,0|2,0,0]=4 36 B12R1.233 CC(=O)NC1=C(N)C=C(Br)C=C1 ALBB-017768 [0,2,0,0,0,0|2,0,0]=4 37 B12R1.34 N\C(=N/O)C(O)C1=CC=CC=C1 ALBB-023954 [0,2,0,0,0,0|1,0,0]=3 38 B12R1.371 NNC(=O)CC1=CC=CC=C1F ALBB-020999 [0,2,0,0,0,0|1,0,0]=3 39 B12R1.371 O=C(CS)NC1=C(F)C=CC=C1 ALBB-017015 [0,2,0,0,0,0|1,1,0]=4 40 B12R1.119 O=S(=O)(Cl)CC1=CC(F)=CC=C1 ALBB-020990 [0,2,0,0,0,0|1,0,1]=4 41 B12R2.606 ClC1=CC=C2OC(Cl)=NC2=C1 ALBB-004128 [0,1,0,1,0,0|2,0,0]=4 42 B12R2.606 O=C1NC2=CC(Br)=CC=C2O1 ALBB-019950 [0,1,0,1,0,0|1,0,0]=3 43 B12R2.606 O=C1NC2=CC=C(F)C=C2O1 ALBB-013601 [0,1,0,1,0,0|1,0,0]=3 44 B12R2.32 O=CC1=CC2=CC=CC=C2S1 ALBB-026951 [0,1,0,1,0,0|0,1,1]=4 45 B8R1.7 NC(=O)C1=CC=CS1 ALBB-019885 [0,0,0,0,2,0|2,0,0]=4 46 B12R1.252 O=C(O)COCC1=CC=CC=C1 ALBB-006231 [0,0,0,0,0,2|0,0,0]=2 47 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 ALBB-021310 [0,0,0,0,0,2|0,0,0]=2