0 B10R1.10 NCCC1=CC(O)=CC=C1 T11937L [0,0,0,0,0,0|1,0,0]=1 1 B9R1.2 CNc1cccc(C)c1 T0557 [1,0,0,0,0,0|1,0,0]=2 2 B9R1.2 NCc1ccnc(Cl)c1 T7185 [1,0,0,0,0,0|2,0,0]=3 3 B9R1.2 O=Cc1cccc(O)c1 T4778 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.2 OCc1cccc(O)c1 T4760 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.2 [O-][n+]1cccc(CO)c1 T0257 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.8 NCCC1=NC=CC=C1 T22501 [1,0,0,0,0,0|1,0,0]=2 7 B9R1.8 NCCc1ccccc1 T2935 [1,0,0,0,0,0|0,0,0]=1 8 B9R1.8 NCCc1ccccc1 T7433 [1,0,0,0,0,0|0,0,0]=1 9 B9R1.8 O=CCC1=CC=CC=C1 TCS1857 [1,0,0,0,0,0|1,0,1]=3 10 B9R1.8 OCCC1=CC=CC=C1 T0011 [1,0,0,0,0,0|1,0,0]=2 11 B9R1.8 OCCc1ccccn1 T0658 [1,0,0,0,0,0|2,0,0]=3 12 B11R1.157 O=C(O)Cc1cccc(O)c1 T4829 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.189 COc1cccc(CCN)c1 T7855 [0,1,0,0,0,0|0,0,0]=1 14 B11R1.192 C=CCc1ccc(O)c(O)c1 TN1274 [0,1,0,0,0,0|2,0,1]=4 15 B11R1.192 NCCc1ccc(O)c(O)c1 T1644 [0,1,0,0,0,0|1,0,0]=2 16 B11R1.192 OCCc1ccc(O)c(O)c1 T3412 [0,1,0,0,0,0|2,0,0]=3 17 B11R2.36 Oc1ccc2c(c1)OCO2 T3676 [0,0,0,1,0,0|3,0,0]=4 18 B9R1.33 CC1=C(CCCl)SC=N1 T10796 [0,0,0,0,1,0|3,0,0]=4 19 B9R1.33 CC1=C(CCCl)SC=N1 T14983 [0,0,0,0,1,0|3,0,0]=4 20 B9R1.33 Cn1cncc1CCN T4940 [0,0,0,0,1,0|2,0,0]=3 21 B8R1.2 NCc1cccnc1 T1581 [2,0,0,0,0,0|1,0,0]=3 22 B8R1.2 O=CC1=CC=CC=C1 TWO2659 [2,0,0,0,0,0|1,0,1]=4 23 B8R1.2 OCC1=CC=CC=C1 T0732 [2,0,0,0,0,0|1,0,0]=3 24 B8R1.2 OCc1ccccn1 T1112 [2,0,0,0,0,0|2,0,0]=4 25 B8R1.2 OCc1cccnc1 T1299 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.2 CCc1occc(=O)c1O T5566 [1,1,0,0,0,0|2,0,0]=4 27 B10R1.2 COc1cccc(Cl)c1Cl T1358 [1,1,0,0,0,0|2,0,0]=4 28 B10R1.30 CCc1nc(C)ccc1O T7875 [1,1,0,0,0,0|1,0,0]=3 29 B10R1.30 CCc1nc(C)ccc1O T8624 [1,1,0,0,0,0|1,0,0]=3 30 B10R1.113 C[n+]1cccc(C(N)=O)c1 T4853 [1,1,0,0,0,0|1,0,1]=4 31 B10R1.113 Cc1cccc(C(=O)Cl)c1 T7850 [1,1,0,0,0,0|1,0,1]=4 32 B10R1.113 NC(=O)c1cccc(N)c1 T6329 [1,1,0,0,0,0|1,0,1]=4 33 B10R1.1 N#CCc1ccc(O)cc1 Fr16745 [1,1,0,0,0,0|0,0,2]=4 34 B10R1.1 NCCC1=CC=C(O)C=C1 T0307 [1,1,0,0,0,0|0,0,0]=2 35 B10R1.1 NCCc1ccc(O)cc1 T3095 [1,1,0,0,0,0|0,0,0]=2 36 B10R1.1 NCCc1ccc(O)cc1 T7851 [1,1,0,0,0,0|0,0,0]=2 37 B10R1.1 OCCc1ccc(O)cc1 T2861 [1,1,0,0,0,0|1,0,0]=3 38 B10R1.15 NCC(O)c1ccccc1 T4873 [1,1,0,0,0,0|0,0,0]=2 39 B10R1.15 OCC(O)c1ccccc1 T1346 [1,1,0,0,0,0|1,0,0]=3 40 B10R1.17 CNCCc1ccccn1 T0246 [1,1,0,0,0,0|1,0,0]=3 41 B10R1.17 CNCCc1ccccn1 T0246L [1,1,0,0,0,0|1,0,0]=3 42 B10R1.17 CNCCc1ccccn1 T4195 [1,1,0,0,0,0|1,0,0]=3 43 B10R1.17 NNCCc1ccccc1 T12441 [1,1,0,0,0,0|0,0,0]=2 44 B10R1.17 OCCCC1=CC=CC=C1 T3754 [1,1,0,0,0,0|1,0,0]=3 45 B10R1.17 OC\C=C\C1=CC=CC=C1 T5S1550 [1,1,0,0,0,0|1,0,1]=4 46 B10R1.17 S=C=NCc1ccccc1 T1082 [1,1,0,0,0,0|1,0,1]=4 47 B12R1.17 CNC[C@H](O)c1cccc(O)c1 T0453 [0,2,0,0,0,0|1,0,0]=3 48 B12R1.225 C[C@H](N)[C@H](O)c1cccc(O)c1 T0279 [0,2,0,0,0,0|1,0,0]=3 49 B12R1.367 NCC(O)C1=CC=C(O)C(O)=C1 T13655 [0,2,0,0,0,0|1,0,0]=3 50 B12R1.367 NCC(O)c1ccc(O)c(O)c1 T21066 [0,2,0,0,0,0|1,0,0]=3 51 B12R1.367 NC[C@H](O)c1ccc(O)c(O)c1 T0871 [0,2,0,0,0,0|1,0,0]=3 52 B12R1.367 NC[C@H](O)c1ccc(O)c(O)c1 T1064 [0,2,0,0,0,0|1,0,0]=3 53 B12R1.367 NC[C@H](O)c1ccc(O)c(O)c1 T7044 [0,2,0,0,0,0|1,0,0]=3 54 B12R1.367 OCC(O)c1ccc(O)c(O)c1 TQ0281 [0,2,0,0,0,0|2,0,0]=4 55 B12R1.226 O=C(O)CCc1cccc(O)c1 T7437 [0,2,0,0,0,0|2,0,0]=4 56 B12R1.438 COc1cccc(CC(=O)O)c1 Fr13883 [0,2,0,0,0,0|1,0,1]=4 57 B12R1.1123 NCCc1cc(O)c(O)cc1O T12352 [0,2,0,0,0,0|1,0,0]=3 58 B12R1.1123 NCCc1cc(O)c(O)cc1O T12352L [0,2,0,0,0,0|1,0,0]=3 59 B12R1.286 C=CCc1ccc(O)c(OC)c1 T1297 [0,2,0,0,0,0|1,0,1]=4 60 B12R1.286 COc1cc(CCN)ccc1O T4710 [0,2,0,0,0,0|0,0,0]=2 61 B12R1.286 COc1cc(CCN)ccc1O T8269 [0,2,0,0,0,0|0,0,0]=2 62 B12R1.286 COc1cc(CCO)ccc1O TN1742 [0,2,0,0,0,0|1,0,0]=3 63 B10R2.7 c1ccc2c(c1)CCO2 Fr14127 [1,0,0,1,0,0|1,0,0]=3 64 B12R2.221 Oc1ccc(Cl)c2c1CCC2 T1253 [0,1,0,1,0,0|2,0,0]=4 65 B8R1.8 NCCC1=CNC=N1 T6535 [1,0,0,0,1,0|2,0,0]=4