0 B10R1.17 CCNCC1=CC=NC=C1 ALBB-021284 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.17 NCCCC1=NC=CC=C1 ALBB-012423 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.17 NC\C=C\C1=CC=CC=C1 ALBB-015040 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.17 OCCNC1=CC=CC=C1 ALBB-020698 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.8 CNCC1=NC=NC=C1 ALBB-018329 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.1 N#CCSC1=CC=C(Cl)C=C1 ALBB-019427 [0,1,0,0,0,0|3,0,0]=4 6 B11R1.1 N#CCSC1=CC=C(F)C=C1 ALBB-019436 [0,1,0,0,0,0|3,0,0]=4 7 B11R1.1 N#CNCC1=CC=C(Cl)C=C1 ALBB-014570 [0,1,0,0,0,0|3,0,0]=4 8 B11R1.1 NC1=CC=C(OCCO)C=C1 ALBB-028625 [0,1,0,0,0,0|3,0,0]=4 9 B11R1.17 C=CCOC1=CC=CC=C1N ALBB-012027 [0,1,0,0,0,0|2,0,1]=4 10 B11R1.24 C=CCOC1=CC=CC(N)=C1 ALBB-012028 [0,1,0,0,0,0|2,0,1]=4 11 B11R1.24 CCCNC1=CC(F)=CC=C1 ALBB-020237 [0,1,0,0,0,0|2,0,0]=3 12 B11R1.24 O=C=NCC1=CC=CC(F)=C1 ALBB-007565 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.28 CNCCOC1=CC=CC=C1 ALBB-025333 [0,1,0,0,0,0|0,0,0]=1 14 B11R1.28 CNCCOC1=CC=CC=C1 ALBB-025333 [0,1,0,0,0,0|0,0,0]=1 15 B11R1.91 N=C(N)OCC1=CC=CC=C1 ALBB-024917 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.91 O=C(O)CCC1=CC=NC=C1 ALBB-000158 [0,1,0,0,0,0|3,0,0]=4 17 B9R1.12 CNCCN1C=CC=N1 ALBB-022642 [0,0,0,0,1,0|2,0,0]=3 18 B9R1.12 CNCCN1C=CN=C1 ALBB-022641 [0,0,0,0,1,0|2,0,0]=3 19 B9R1.12 N#CCCN1C=CC=C1 ALBB-021294 [0,0,0,0,1,0|3,0,0]=4 20 B8R1.2 NCC1=CN=NC=C1 ALBB-026737 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.1 NNCC1=CC=C(Cl)C=C1 ALBB-022671 [1,1,0,0,0,0|1,0,0]=3 22 B10R1.1 NNCC1=CC=C(F)C=C1 ALBB-022656 [1,1,0,0,0,0|1,0,0]=3 23 B10R1.4 C=CCC1=C(O)C=CC=C1 ALBB-020392 [1,1,0,0,0,0|0,0,2]=4 24 B10R1.4 NNCC1=C(F)C=CC=C1 ALBB-022654 [1,1,0,0,0,0|1,0,0]=3 25 B10R1.10 NNCC1=CC(F)=CC=C1 ALBB-022655 [1,1,0,0,0,0|1,0,0]=3 26 B10R1.18 CC(N)CC1=CC=CN=C1 ALBB-010767 [1,1,0,0,0,0|1,0,0]=3 27 B10R1.18 CC(N)CC1=CC=CN=C1 ALBB-010767 [1,1,0,0,0,0|1,0,0]=3 28 B10R1.18 N=C(N)CC1=NC=CC=C1 ALBB-004970 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.18 N=C(N)NC1=CC=CC=C1 ALBB-019781 [1,1,0,0,0,0|1,0,1]=4 30 B10R1.18 N=C(N)NC1=CC=CC=C1 ALBB-019781 [1,1,0,0,0,0|1,0,1]=4 31 B10R1.11 CCCC(N)C1=CC=CS1 ALBB-006746 [0,1,0,0,1,0|2,0,0]=4 32 B12R1.1 NCCNCC1=CC=C(Cl)C=C1 ALBB-021092 [0,2,0,0,0,0|2,0,0]=4 33 B12R1.1 NCCNCC1=CC=C(F)C=C1 ALBB-012109 [0,2,0,0,0,0|2,0,0]=4 34 B12R1.16 CCCC(=O)C1=CC=C(Br)C=C1 ALBB-020857 [0,2,0,0,0,0|1,0,1]=4 35 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 ALBB-020815 [0,2,0,0,0,0|1,0,1]=4 36 B12R1.21 CC(C)CNC1=CC=C(Cl)C=C1 ALBB-020257 [0,2,0,0,0,0|2,0,0]=4 37 B12R1.49 CCC(C)OC1=CC=C(N)C=C1 ALBB-012030 [0,2,0,0,0,0|2,0,0]=4 38 B12R1.69 CCCNC1=CC=C(Cl)C=C1F ALBB-020234 [0,2,0,0,0,0|2,0,0]=4 39 B12R1.385 CCCNC1=CC(C)=C(Br)C=C1 ALBB-020268 [0,2,0,0,0,0|2,0,0]=4 40 B12R1.385 CCCNC1=CC(C)=C(C)C=C1 ALBB-020227 [0,2,0,0,0,0|2,0,0]=4 41 B12R1.385 CCCNC1=CC(F)=C(F)C=C1 ALBB-020236 [0,2,0,0,0,0|2,0,0]=4 42 B12R1.385 CCCNC1=CC=C(F)C(Cl)=C1 ALBB-020239 [0,2,0,0,0,0|2,0,0]=4 43 B12R1.371 NNC(=O)CC1=CC=CC=C1F ALBB-020999 [0,2,0,0,0,0|1,0,1]=4 44 B12R1.28 CCCCOC1=CC=CC(N)=C1 ALBB-012029 [0,2,0,0,0,0|1,0,0]=3 45 B12R1.28 NCCNCC1=CC(F)=CC=C1 ALBB-012128 [0,2,0,0,0,0|2,0,0]=4 46 B12R1.100 CCCNC1=CC(C)=CC(C)=C1 ALBB-020229 [0,2,0,0,0,0|2,0,0]=4 47 B12R1.382 CCCNC1=CC=CC(OC)=C1 ALBB-020264 [0,2,0,0,0,0|2,0,0]=4 48 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 ALBB-031584 [0,2,0,0,0,0|2,0,0]=4 49 B12R1.32 CN(CCN)CC1=CC=CC=C1 ALBB-021042 [0,2,0,0,0,0|2,0,0]=4 50 B12R1.252 O=C(O)COCC1=CC=CC=C1 ALBB-006231 [0,2,0,0,0,0|2,0,0]=4 51 B12R2.24 CC1CNC2=C(C=CC=C2)S1 ALBB-006555 [0,1,0,1,0,0|2,0,0]=4 52 B12R2.1081 NN1CCCC2=CC=CC=C21 ALBB-010056 [0,1,0,1,0,0|1,0,0]=3 53 B8R1.8 CNCC1=CC=CO1 ALBB-012372 [1,0,0,0,1,0|1,0,0]=3 54 B8R1.8 CNCC1=CC=CO1 ALBB-012372 [1,0,0,0,1,0|1,0,0]=3