0 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 AC-76236 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.34 CNC(=O)C(O)C1=CC=CC=C1 AC-83053 [0,0,0,0,0,0|1,0,1]=2 2 B12R1.34 COC(=O)C(Br)C1=CC=CC=C1 AC-94487 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 AC-14792 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 AC-59199 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.34 COC(=O)[C@@H](O)C1=CC=CC=C1 AC-38667 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 AC-38666 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.34 N[C@@H](CO)[C@@H](O)C1=CC=CC=C1 AC-20237 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.16 C#CCC(O)C1=CC=CN=C1 AC-90489 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.16 CCCC(N)C1=NC=CC=C1 AC-34690 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.16 N#CCC(O)C1=CC=CC=C1 AC-59838 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.16 NC(CCO)C1=CC=CC=C1 AC-32476 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.16 NCCC(O)C1=CC=CC=C1 AC-79691 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 AC-66687 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.16 OCCC(O)C1=NC=CC=C1 AC-88985 [1,0,0,0,0,0|3,0,0]=4 15 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 AC-14427 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 AC-75835 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 AC-75245 [1,0,0,0,0,0|0,0,2]=3 18 B11R1.36 CC(C)C(=O)C1=NC=CC=C1 AC-41193 [1,0,0,0,0,0|1,0,2]=4 19 B11R1.36 CC(C)C(Br)C1=CC=CC=C1 AC-88554 [1,0,0,0,0,0|1,0,0]=2 20 B11R1.36 CC(C)C(N)C1=NC=CC=C1 AC-92437 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 AC-32405 [1,0,0,0,0,0|2,0,1]=4 22 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 AC-83167 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 AC-76874 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 AC-11550 [1,0,0,0,0,0|2,0,1]=4 25 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 AC-11551 [1,0,0,0,0,0|2,0,1]=4 26 B11R1.40 CC(C#N)NC1=CC=CC=C1 AC-88942 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.40 COC(=N)CC1=CC=CC=C1 AC-95822 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.40 NC(CO)CC1=CC=CC=C1 AC-76906 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 AC-11522 [1,0,0,0,0,0|3,0,0]=4 30 B13R2.15 CC1=NCCC1C2=CC=CC=C2 AC-95940 [0,0,0,1,0,0|1,0,2]=4 31 B13R2.32 NC1C(=O)NCC2=C1C=CC=C2 AC-84516 [0,0,0,1,0,0|2,0,1]=4 32 B13R2.3085 CN1C(=O)C(Br)C2=C1C=CC=C2 AC-89912 [0,0,0,1,0,0|2,0,1]=4 33 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 AC-17013 [0,0,0,0,0,1|2,0,1]=4 34 B10R1.15 C#CC(O)C1=CC=CC=C1 AC-82932 [2,0,0,0,0,0|0,0,2]=4 35 B10R1.15 CC(CN)C1=CC=CC=C1 AC-76879 [2,0,0,0,0,0|1,0,0]=3 36 B10R1.15 CCC(=O)C1=CC=CC=C1 AC-15135 [2,0,0,0,0,0|0,0,2]=4 37 B10R1.15 CCC(N)C1=CC=CN=C1 AC-81475 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.15 CCC(N)C1=NC=CC=C1 AC-85412 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.15 CNC(C)C1=CC=CC=C1 AC-75895 [2,0,0,0,0,0|1,0,0]=3 40 B10R1.15 CNC(C)C1=CC=CC=C1 AC-92088 [2,0,0,0,0,0|1,0,0]=3 41 B10R1.15 CNC(C)C1=CC=NC=C1 AC-57441 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.15 NCC(N)C1=CC=CC=C1 AC-38860 [2,0,0,0,0,0|1,0,0]=3 43 B10R1.15 NCC(O)C1=CC=CC=C1 AC-76221 [2,0,0,0,0,0|0,0,0]=2 44 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-11520 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-11521 [2,0,0,0,0,0|2,0,0]=4 46 B10R1.15 N[C@H](CO)C1=CC=CC=C1 AC-38862 [2,0,0,0,0,0|2,0,0]=4 47 B10R1.15 OC(CBr)C1=CC=CC=C1 AC-77224 [2,0,0,0,0,0|1,0,0]=3 48 B10R1.17 CCCCC1=CC=NC=C1 AC-79321 [2,0,0,0,0,0|2,0,0]=4 49 B10R1.17 CCNCC1=CC=CC=C1 AC-23535 [2,0,0,0,0,0|2,0,0]=4 50 B10R1.17 CNCCC1=CC=CN=C1 AC-86271 [2,0,0,0,0,0|1,0,0]=3 51 B10R1.17 OCCCC1=CC=CC=C1 AC-90879 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.18 CC(Br)CC1=CC=CC=C1 AC-91740 [2,0,0,0,0,0|1,0,0]=3 53 B10R1.18 CC(C)=CC1=CC=CC=C1 AC-94041 [2,0,0,0,0,0|0,0,2]=4 54 B10R1.18 CC(C)NC1=CC=CC=C1 AC-13673 [2,0,0,0,0,0|1,0,0]=3 55 B10R1.18 CC(C)NC1=CC=NC=C1 AC-91115 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.18 CC(C)OC1=NC=CC=C1 AC-83952 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.18 NC(=O)CC1=CC=CC=C1 AC-64120 [2,0,0,0,0,0|1,0,1]=4 58 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 AC-15819 [1,1,0,0,0,0|0,0,0]=2 59 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 AC-63329 [1,1,0,0,0,0|0,0,0]=2 60 B12R1.30 CNCC[C@@H](O)C1=CC=CC=C1 AC-75382 [1,1,0,0,0,0|0,0,0]=2 61 B12R1.107 CN(C)CC(N)C1=CC=CC=C1 AC-88518 [1,1,0,0,0,0|1,0,0]=3 62 B12R1.20 CC(C)S(=O)C1=CC=C(Br)C=C1 AC-77248 [1,1,0,0,0,0|1,0,1]=4 63 B12R1.124 CC(C)[C@@H](N)C1=CC=CC=C1Cl AC-83526 [1,1,0,0,0,0|1,0,0]=3 64 B12R1.225 CC(C)C(=O)C1=CC=CC(Br)=C1 AC-94046 [1,1,0,0,0,0|0,0,2]=4 65 B12R1.225 CC(C)C(=O)C1=CC=CC(Cl)=C1 AC-90076 [1,1,0,0,0,0|0,0,2]=4 66 B12R1.478 CC(C)C(C#N)C1=CC=CC=C1 AC-23814 [1,1,0,0,0,0|1,0,0]=3 67 B12R1.478 CC(C)C(C=O)C1=CC=CC=C1 AC-96206 [1,1,0,0,0,0|0,0,1]=3 68 B12R1.564 CC(C)(C)C(N)C1=CC=CC=C1 AC-19142 [1,1,0,0,0,0|1,0,0]=3 69 B12R1.564 CC(C)(O)C(=O)C1=CC=CC=C1 AC-65482 [1,1,0,0,0,0|0,0,2]=4 70 B12R1.564 CC(C)(O)[C@@H](N)C1=CC=CC=C1 AC-85730 [1,1,0,0,0,0|1,0,0]=3 71 B12R1.564 CC(C)(O)[C@H](N)C1=CC=CC=C1 AC-85731 [1,1,0,0,0,0|1,0,0]=3 72 B12R1.32 CN(CCN)CC1=CC=CC=C1 AC-57957 [1,1,0,0,0,0|2,0,0]=4 73 B12R1.32 CN(CCO)CC1=CC=CC=C1 AC-80118 [1,1,0,0,0,0|2,0,0]=4 74 B12R1.118 COC(CC1=NC=CC=C1)OC AC-88659 [1,1,0,0,0,0|2,0,0]=4 75 B12R1.118 NCC(CO)CC1=CC=CC=C1 AC-86314 [1,1,0,0,0,0|2,0,0]=4 76 B12R2.2 C1=CC=C(C2CCCN2)C=C1 AC-62045 [1,0,0,1,0,0|2,0,0]=4 77 B12R2.2 C1=CC=C(C2CCNC2)C=C1 AC-57402 [1,0,0,1,0,0|1,0,0]=3 78 B12R2.2 C1=CC=C(C2CCNC2)C=C1 AC-91187 [1,0,0,1,0,0|1,0,0]=3 79 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 AC-83118 [1,0,0,1,0,0|1,0,0]=3 80 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 AC-71372 [1,0,0,1,0,0|1,0,0]=3 81 B12R2.2 C1=CN=C(C2CCNC2)C=C1 AC-84744 [1,0,0,1,0,0|2,0,0]=4 82 B12R2.116 NC1(C2=CC=CC=C2)CCC1 AC-64081 [1,0,0,1,0,0|2,0,0]=4 83 B12R2.116 NC1(C2=CC=CC=C2)COC1 AC-87746 [1,0,0,1,0,0|2,0,0]=4 84 B12R2.116 OC1(C2=CC=CC=C2)COC1 AC-87695 [1,0,0,1,0,0|1,0,0]=3 85 B12R2.1081 CC1CNCC2=C1C=CC=C2 AC-41446 [1,0,0,1,0,0|1,0,0]=3 86 B12R2.1081 CC1CNCC2=C1C=CC=C2 AC-79561 [1,0,0,1,0,0|1,0,0]=3 87 B12R2.1081 NC1CCCC2=C1C=CC=C2 AC-88620 [1,0,0,1,0,0|2,0,0]=4 88 B12R2.1081 NC1COCC2=C1C=CC=C2 AC-28095 [1,0,0,1,0,0|2,0,0]=4 89 B12R2.1081 NC1CSCC2=C1C=CC=C2 AC-39187 [1,0,0,1,0,0|2,0,0]=4 90 B12R2.1081 O=C1CNCC2=C1C=CC=C2 AC-84554 [1,0,0,1,0,0|0,0,2]=4 91 B12R2.1081 OC1CCCC2=C1C=CC=C2 AC-21976 [1,0,0,1,0,0|1,0,0]=3 92 B12R2.2075 OC(C1=CC=CN=C1)C2CC2 AC-90111 [1,0,0,1,0,0|2,0,0]=4 93 B12R2.18 CC1CC2=C(C=CC=C2)C1=O AC-39381 [1,0,0,1,0,0|0,0,2]=4 94 B12R2.18 CC1CC2=C(C=CC=C2)N1N AC-11735 [1,0,0,1,0,0|2,0,0]=4 95 B12R2.18 CC1CC2=C(C=CC=C2)N1N AC-32637 [1,0,0,1,0,0|2,0,0]=4 96 B12R2.18 NC1C2=C(C=CC=C2)CC1O AC-39374 [1,0,0,1,0,0|2,0,0]=4 97 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O AC-13235 [1,0,0,1,0,0|2,0,0]=4 98 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@H]1O AC-81411 [1,0,0,1,0,0|2,0,0]=4 99 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O AC-12978 [1,0,0,1,0,0|2,0,0]=4 100 B12R2.24 CC1CC2=C(C=CC=C2)CN1 AC-41390 [1,0,0,1,0,0|0,0,0]=2 101 B12R2.24 CC1CCC2=C(C=CC=C2)N1 AC-92540 [1,0,0,1,0,0|2,0,0]=4 102 B12R2.24 CC1CCC2=C(C=CC=N2)C1 AC-88413 [1,0,0,1,0,0|2,0,0]=4 103 B12R2.24 CC1CNC2=C(C=CC=C2)C1 AC-92541 [1,0,0,1,0,0|2,0,0]=4 104 B12R2.24 CN1CCC2=C(C=CC=C2)C1 AC-95591 [1,0,0,1,0,0|2,0,0]=4 105 B12R2.24 NC1CCC2=C(C=CC=C2)C1 AC-80418 [1,0,0,1,0,0|2,0,0]=4 106 B12R2.32 OCC1CC2=C(C=CC=C2)C1 AC-88530 [1,0,0,1,0,0|2,0,0]=4 107 B14R2.21 OC1CCOC(C2=CC=CC=C2)C1 AC-93926 [0,0,0,1,0,1|2,0,0]=4 108 B14R2.3469 N#CC1(C(O)C2=CC=CC=C2)CC1 AC-86037 [0,1,0,1,0,0|1,0,1]=4 109 B12R1.27 CC(CCl)CNC1=CC=CC=C1 AC-93249 [1,0,0,0,0,1|2,0,0]=4 110 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 AC-75587 [1,0,0,0,0,1|2,0,0]=4