0 B20R3.671153 CC(=Cc1cc2ccccc2c3c1cccc3)C 271570a_100102525489_100009813645 [0,0,0,0,0,0|3,0,0]=3 1 B20R3.671153 CC(=Cc1cc2cccnc2c3c1cccc3)C 271570a_100102525489_100050056114 [0,0,0,0,0,0|4,0,0]=4 2 B20R3.671153 CC(=Cc1nc2ccccc2c3c1cccc3)C 271570a_100102525489_100000028652 [0,0,0,0,0,0|4,0,0]=4 3 B20R3.671153 CC(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100015343762 [0,0,0,0,0,0|2,0,0]=2 4 B20R3.671153 CC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100015343762 [0,0,0,0,0,0|2,0,0]=2 5 B20R3.671153 CC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000070787 [0,0,0,0,0,0|2,0,0]=2 6 B20R3.671153 CC(=O)Nc1cc2cccnc2c3c1cccn3 11a_100000043302_100015343762 [0,0,0,0,0,0|4,0,0]=4 7 B20R3.671153 CC(=O)Nc1cc2cccnc2c3c1cccn3 1626a_100000043302_100015343762 [0,0,0,0,0,0|4,0,0]=4 8 B20R3.671153 CC(=O)Nc1cc2cccnc2c3c1cccn3 22a_100000043302_100000070787 [0,0,0,0,0,0|4,0,0]=4 9 B20R3.671153 CC(C)Nc1cc2ccccc2c3c1cccc3 34a_100000029970_100000210206 [0,0,0,0,0,0|2,0,1]=3 10 B20R3.671153 CC(C)Nc1nc2ccccc2c3c1cccc3 27a_100138425928_100000028652 [0,0,0,0,0,0|3,0,1]=4 11 B20R3.671153 CC(C)Oc1cc2ccccc2c3c1cccc3 34a_100000036577_100000210206 [0,0,0,0,0,0|3,0,1]=4 12 B20R3.671153 CC(C)Oc1cc2ccccc2c3c1cccc3 7a_100000036577_100000210206 [0,0,0,0,0,0|3,0,1]=4 13 B20R3.671153 CC(C)Sc1cc2ccccc2c3c1cccc3 62a_100000210206_100009813645 [0,0,0,0,0,0|3,0,1]=4 14 B20R3.671153 CN(C)Cc1cc2ccccc2c3c1cccc3 270004a_100102631434_100000033530 [0,0,0,0,0,0|4,0,0]=4 15 B19R3.142008 C=C=Cc1cc2ccccc2c3c1cccc3 271570a_100015277604_100009813645 [1,0,0,0,0,0|2,0,1]=4 16 B19R3.142008 CC=Cc1cc2ccccc2c3c1cccc3 271570a_100016259895_100009813645 [1,0,0,0,0,0|2,0,0]=3 17 B19R3.142008 CC=Cc1cc2cccnc2c3c1cccc3 271570a_100016259895_100050056114 [1,0,0,0,0,0|3,0,0]=4 18 B19R3.142008 CC=Cc1nc2ccccc2c3c1cccc3 271570a_100016259895_100000028652 [1,0,0,0,0,0|3,0,0]=4 19 B19R3.142008 CCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000210202 [1,0,0,0,0,0|1,0,1]=3 20 B19R3.142008 CCNc1nc2ccccc2c3c1cccc3 27a_100015525214_100000028652 [1,0,0,0,0,0|2,0,1]=4 21 B19R3.142008 CCOc1cc2ccccc2c3c1cccc3 34a_100000036577_100000210202 [1,0,0,0,0,0|2,0,1]=4 22 B19R3.142008 CCOc1cc2ccccc2c3c1cccc3 7a_100000036577_100000210202 [1,0,0,0,0,0|2,0,1]=4 23 B19R3.142008 CCSc1cc2ccccc2c3c1cccc3 62a_100000210202_100009813645 [1,0,0,0,0,0|2,0,1]=4 24 B19R3.142008 CNCc1cc2ccccc2c3c1cccc3 207a_100102657272_100000033530 [1,0,0,0,0,0|3,0,0]=4 25 B19R3.142008 CNCc1cc2ccccc2c3c1cccc3 270004a_106832991635_100000033530 [1,0,0,0,0,0|3,0,0]=4 26 B19R3.142008 FCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100015361967 [1,0,0,0,0,0|1,0,1]=3 27 B19R3.142008 FCOc1cc2ccccc2c3c1cccc3 34a_100000036577_100015361967 [1,0,0,0,0,0|2,0,1]=4 28 B19R3.142008 FCOc1cc2ccccc2c3c1cccc3 7a_100000036577_100015361967 [1,0,0,0,0,0|2,0,1]=4 29 B19R3.142008 FCSc1cc2ccccc2c3c1cccc3 62a_100015361967_100009813645 [1,0,0,0,0,0|2,0,1]=4 30 B21R3.9534009 C#CC(C)Nc1cc2ccccc2c3c1cccc3 34a_100000029970_200000035995 [0,1,0,0,0,0|2,0,1]=4 31 B21R3.9534009 C=CC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000185746 [0,1,0,0,0,0|2,0,0]=3 32 B21R3.9534009 C=CC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000185746 [0,1,0,0,0,0|2,0,0]=3 33 B21R3.9534009 CC(=Cc1cc2ccccc2c3c1cccc3)C#N 6a_100000033530_200000212204 [0,1,0,0,0,0|2,0,1]=4 34 B21R3.9534009 CC(CO)Nc1cc2ccccc2c3c1cccc3 34a_100000029970_100012180447 [0,1,0,0,0,0|2,0,1]=4 35 B21R3.9534009 CCC(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000210414 [0,1,0,0,0,0|2,0,0]=3 36 B21R3.9534009 CCC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000210414 [0,1,0,0,0,0|2,0,0]=3 37 B21R3.9534009 CCC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000210414 [0,1,0,0,0,0|2,0,0]=3 38 B21R3.9534009 CCC(C)Nc1cc2ccccc2c3c1cccc3 34a_100000029970_100011215416 [0,1,0,0,0,0|2,0,1]=4 39 B21R3.9534009 CNC(=O)Nc1cc2ccccc2c3c1cccc3 2430a_100000029970_100102657272 [0,1,0,0,0,0|1,0,0]=2 40 B21R3.9534009 CNC(=O)Nc1cc2cccnc2c3c1cccn3 2430a_100000043302_100102657272 [0,1,0,0,0,0|3,0,0]=4 41 B21R3.9534009 N#CC(=Cc1cc2ccccc2c3c1cccc3)F 6a_100000033530_200000032654 [0,1,0,0,0,0|2,0,1]=4 42 B21R3.9534009 O=C(CO)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000210174 [0,1,0,0,0,0|2,0,0]=3 43 B21R3.13947255 CC(=C(C)c1cc2ccccc2c3c1cccc3)C 271570a_200000049429_100009813645 [0,1,0,0,0,0|3,0,0]=4 44 B21R3.14719077 CC(C)(C)Nc1cc2ccccc2c3c1cccc3 34a_100000029970_100000210625 [0,1,0,0,0,0|2,0,1]=4 45 B21R3.14719077 CS(=O)(=O)Nc1cc2ccccc2c3c1cccc3 40a_100000029970_100000738038 [0,1,0,0,0,0|3,0,0]=4 46 B21R3.14719077 FC(F)(F)Nc1cc2ccccc2c3c1cccc3 34a_100000029970_200103152311 [0,1,0,0,0,0|2,0,1]=4 47 B19R2.4208 NC(=O)CC(=O)c1ccccc1c2ccccc2 1458a_100000211553_100000187820 [0,0,1,0,0,0|3,0,0]=4 48 B19R2.8685 CC(=O)NN=Cc1ccccc1c2ccccc2 4a_100000189765_100011219292 [0,0,1,0,0,0|3,0,0]=4 49 B21R4.2319793 c1ccc2c(c1)cc(c3c2cccc3)NC4CC4 34a_100000029970_100000211595 [0,0,0,1,0,0|2,0,1]=4 50 B19R3.631815 CC(=O)C=C1c2ccccc2-c3c1cccc3 1458a_200000010575_200000210301 [0,0,0,0,1,0|3,0,0]=4 51 B19R3.631815 CC(=O)NC1c2ccccc2-c3c1cccc3 11a_100000104097_100015343762 [0,0,0,0,1,0|2,0,1]=4 52 B19R3.631815 CC(=O)NC1c2ccccc2-c3c1cccc3 1626a_100000104097_100015343762 [0,0,0,0,1,0|2,0,1]=4 53 B19R3.631815 CC(=O)NC1c2ccccc2-c3c1cccc3 240690a_100000104097_100015343762 [0,0,0,0,1,0|2,0,1]=4 54 B19R3.631815 [13CH3]C(=O)C=C1c2ccccc2-c3c1cccc3 1458a_200000010575_200025704644 [0,0,0,0,1,0|3,0,0]=4 55 B19R3.657184 C=C(C)c1cc2ccccc2c3c1cccc3 271570a_100000694244_100009813645 [0,0,0,0,1,0|2,0,0]=3 56 B19R3.657184 C=C(C)c1cc2cccnc2c3c1cccc3 271570a_100000694244_100050056114 [0,0,0,0,1,0|3,0,0]=4 57 B19R3.657184 C=C(C)c1nc2ccccc2c3c1cccc3 271570a_100000694244_100000028652 [0,0,0,0,1,0|3,0,0]=4 58 B19R3.657184 CC(=O)c1cc2ccccc2c3c1cccc3 1458a_100020586880_200000210301 [0,0,0,0,1,0|2,0,0]=3 59 B19R3.657184 [13CH3]C(=O)c1cc2ccccc2c3c1cccc3 1458a_100020586880_200025704644 [0,0,0,0,1,0|2,0,0]=3 60 B21R3.7888781 C=C(C)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000748629 [0,0,0,0,0,1|2,0,0]=3 61 B21R3.7888781 C=C(C)CNc1nc2ccccc2c3c1cccc3 27a_100000765925_100000028652 [0,0,0,0,0,1|3,0,0]=4 62 B21R3.7888781 C=C(C)COc1cc2ccccc2c3c1cccc3 34a_100000036577_100000748629 [0,0,0,0,0,1|3,0,0]=4 63 B21R3.7888781 C=C(C)COc1cc2ccccc2c3c1cccc3 7a_100000036577_100000748629 [0,0,0,0,0,1|3,0,0]=4 64 B21R3.7888781 C=C(C)CSc1cc2ccccc2c3c1cccc3 62a_100000748629_100009813645 [0,0,0,0,0,1|3,0,0]=4 65 B21R3.7888781 C=C(F)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100009893438 [0,0,0,0,0,1|2,0,0]=3 66 B21R3.7888781 C=C(F)COc1cc2ccccc2c3c1cccc3 34a_100000036577_100009893438 [0,0,0,0,0,1|3,0,0]=4 67 B21R3.7888781 C=C(F)COc1cc2ccccc2c3c1cccc3 7a_100000036577_100000042424 [0,0,0,0,0,1|3,0,0]=4 68 B21R3.7888781 C=C(F)CSc1cc2ccccc2c3c1cccc3 62a_100000042424_100009813645 [0,0,0,0,0,1|3,0,0]=4 69 B21R3.7888781 CC(C)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000210624 [0,0,0,0,0,1|2,0,1]=4 70 B21R3.7888781 CC(C)NCc1cc2ccccc2c3c1cccc3 207a_100138425928_100000033530 [0,0,0,0,0,1|2,0,1]=4 71 B21R3.7888781 CC(O)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100011218427 [0,0,0,0,0,1|2,0,1]=4 72 B21R3.7888781 C[C@@H](O)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100009817552 [0,0,0,0,0,1|2,0,1]=4 73 B21R3.7888781 FC(F)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100011934356 [0,0,0,0,0,1|2,0,1]=4 74 B21R3.7888781 NC(=O)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000187820 [0,0,0,0,0,1|1,0,0]=2 75 B21R3.7888781 NC(=O)COc1cc2ccccc2c3c1cccc3 34a_100000036577_100000187820 [0,0,0,0,0,1|2,0,0]=3 76 B21R3.7888781 NC(=O)COc1cc2ccccc2c3c1cccc3 7a_100000036577_100000187820 [0,0,0,0,0,1|2,0,0]=3 77 B21R3.7888781 NC(=O)CSc1cc2ccccc2c3c1cccc3 62a_100000747473_100009813645 [0,0,0,0,0,1|2,0,0]=3 78 B21R3.7888781 NC(=O)CSc1cc2cccnc2c3c1cccc3 62a_100000747473_100050056114 [0,0,0,0,0,1|3,0,0]=4 79 B21R3.7888781 NC(=O)CSc1nc2ccccc2c3c1cccc3 62a_100000747473_100000028652 [0,0,0,0,0,1|3,0,0]=4 80 B21R3.7888781 O=C([O-])CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100020667443 [0,0,0,0,0,1|2,0,0]=3 81 B21R3.7888781 O=C([O-])COc1cc2ccccc2c3c1cccc3 34a_100000036577_100020667443 [0,0,0,0,0,1|3,0,0]=4 82 B21R3.7888781 O=C([O-])CSc1cc2ccccc2c3c1cccc3 62a_100020667443_100009813645 [0,0,0,0,0,1|3,0,0]=4 83 B21R3.7888781 O=[N+]([O-])CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000761209 [0,0,0,0,0,1|3,0,0]=4 84 B18R3.159486 C=Cc1cc2ccccc2c3c1cccc3 271570a_100011290941_100009813645 [2,0,0,0,0,0|1,0,0]=3 85 B18R3.159486 C=Cc1cc2cccnc2c3c1cccc3 271570a_100011290941_100050056114 [2,0,0,0,0,0|2,0,0]=4 86 B18R3.159486 C=Cc1nc2ccccc2c3c1cccc3 271570a_100011290941_100000028652 [2,0,0,0,0,0|2,0,0]=4 87 B18R3.159486 CNc1cc2ccccc2c3c1cccc3 34a_100000029970_200000210301 [2,0,0,0,0,0|0,0,1]=3 88 B18R3.159486 CNc1nc2ccccc2c3c1cccc3 27a_100102657272_100000028652 [2,0,0,0,0,0|1,0,1]=4 89 B18R3.159486 COc1cc2ccccc2c3c1cccc3 34a_100000036577_200000210301 [2,0,0,0,0,0|1,0,1]=4 90 B18R3.159486 COc1cc2ccccc2c3c1cccc3 7a_100000036577_200000210301 [2,0,0,0,0,0|1,0,1]=4 91 B18R3.159486 CSc1cc2ccccc2c3c1cccc3 62a_200000210301_100009813645 [2,0,0,0,0,0|1,0,1]=4 92 B18R3.159486 [13CH3]Nc1cc2ccccc2c3c1cccc3 34a_100000029970_200025704644 [2,0,0,0,0,0|0,0,1]=3 93 B18R3.159486 [13CH3]Oc1cc2ccccc2c3c1cccc3 34a_100000036577_200025704644 [2,0,0,0,0,0|1,0,1]=4 94 B18R3.159486 [13CH3]Oc1cc2ccccc2c3c1cccc3 7a_100000036577_200025704644 [2,0,0,0,0,0|1,0,1]=4 95 B18R3.159486 [13CH3]Sc1cc2ccccc2c3c1cccc3 62a_200025704644_100009813645 [2,0,0,0,0,0|1,0,1]=4 96 B20R3.401958 C#CCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000184674 [1,1,0,0,0,0|1,0,1]=4 97 B20R3.401958 C=CCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100015514636 [1,1,0,0,0,0|1,0,0]=3 98 B20R3.401958 C=CCNc1nc2ccccc2c3c1cccc3 27a_100020586998_100000028652 [1,1,0,0,0,0|2,0,0]=4 99 B20R3.401958 C=CCOc1cc2ccccc2c3c1cccc3 34a_100000036577_100015514636 [1,1,0,0,0,0|2,0,0]=4 100 B20R3.401958 C=CCOc1cc2ccccc2c3c1cccc3 7a_100000036577_100015514636 [1,1,0,0,0,0|2,0,0]=4 101 B20R3.401958 C=CCSc1cc2ccccc2c3c1cccc3 62a_100000210623_100009813645 [1,1,0,0,0,0|2,0,0]=4 102 B20R3.401958 CCCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000210303 [1,1,0,0,0,0|1,0,1]=4 103 B20R3.401958 CCNCc1cc2ccccc2c3c1cccc3 207a_100015525214_100000033530 [1,1,0,0,0,0|1,0,1]=4 104 B20R3.401958 CCNCc1cc2ccccc2c3c1cccc3 270004a_100015525214_100000033530 [1,1,0,0,0,0|1,0,1]=4 105 B20R3.401958 CSCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100011218213 [1,1,0,0,0,0|1,0,1]=4 106 B20R3.401958 FCCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100011217306 [1,1,0,0,0,0|1,0,1]=4 107 B20R3.401958 O=CCNc1cc2ccccc2c3c1cccc3 34a_100000029970_200009817547 [1,1,0,0,0,0|1,0,0]=3 108 B20R3.401958 O=CCOc1cc2ccccc2c3c1cccc3 34a_100000036577_200009817547 [1,1,0,0,0,0|2,0,0]=4 109 B20R3.401958 O=CCOc1cc2ccccc2c3c1cccc3 7a_100000036577_200015260668 [1,1,0,0,0,0|2,0,0]=4 110 B20R3.401958 O=CCSc1cc2ccccc2c3c1cccc3 62a_200015260668_100009813645 [1,1,0,0,0,0|2,0,0]=4 111 B20R3.401958 OCCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000211926 [1,1,0,0,0,0|1,0,1]=4 112 B20R3.5882703 CNC(=O)C=C1c2ccccc2-c3c1cccc3 240690a_100102657272_200000010575 [0,1,0,0,1,0|2,0,0]=4 113 B20R3.5882703 CNC(=O)NC1c2ccccc2-c3c1cccc3 2708a_100102657272_100000104097 [0,1,0,0,1,0|1,0,1]=4 114 B20R3.5882703 CNC(=O)NC1c2ccccc2-c3c1cccc3 273464a_100102657272_100000104097 [0,1,0,0,1,0|1,0,1]=4 115 B20R3.5882703 CNC(=O)NC1c2ccccc2-c3c1cccc3 512a_106832991638_100000104097 [0,1,0,0,1,0|1,0,1]=4 116 B22R3.15517832 C=C(C#N)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000694840 [0,1,0,0,0,1|1,0,1]=4 117 B22R3.15517832 CNC(=O)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000183359 [0,1,0,0,0,1|1,0,0]=3 118 B22R3.15517832 CNC(=O)CNc1nc2ccccc2c3c1cccc3 27a_100000693194_100000028652 [0,1,0,0,0,1|2,0,0]=4 119 B22R3.15517832 CNC(=O)COc1cc2ccccc2c3c1cccc3 34a_100000036577_100000183359 [0,1,0,0,0,1|2,0,0]=4 120 B22R3.15517832 CNC(=O)COc1cc2ccccc2c3c1cccc3 7a_100000036577_100000183359 [0,1,0,0,0,1|2,0,0]=4 121 B22R3.15517832 CNC(=O)CSc1cc2ccccc2c3c1cccc3 62a_100000183359_100009813645 [0,1,0,0,0,1|2,0,0]=4 122 B22R3.15517832 COC(=O)CNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000747449 [0,1,0,0,0,1|2,0,0]=4 123 B22R3.23399385 C=C(Br)C(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100009813364 [0,1,0,0,0,1|2,0,0]=4 124 B22R3.23399385 C=C(Br)C(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100009813364 [0,1,0,0,0,1|2,0,0]=4 125 B22R3.23399385 C=C(C)C(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000185857 [0,1,0,0,0,1|2,0,0]=4 126 B22R3.23399385 C=C(C)C(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000185857 [0,1,0,0,0,1|2,0,0]=4 127 B22R3.23399385 C=C(C)C(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000185857 [0,1,0,0,0,1|2,0,0]=4 128 B22R3.23399385 C=C(Cl)C(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000039160 [0,1,0,0,0,1|2,0,0]=4 129 B22R3.23399385 C=C(Cl)C(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000039160 [0,1,0,0,0,1|2,0,0]=4 130 B22R3.23399385 C=C(Cl)C(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000039160 [0,1,0,0,0,1|2,0,0]=4 131 B22R3.23399385 C=C(F)C(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000036797 [0,1,0,0,0,1|2,0,0]=4 132 B22R3.23399385 C=C(F)C(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000036797 [0,1,0,0,0,1|2,0,0]=4 133 B22R3.23399385 C=C(F)C(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000036797 [0,1,0,0,0,1|2,0,0]=4 134 B22R3.23399385 CC(Nc1cc2ccccc2c3c1cccc3)C(=O)N 34a_100000029970_100000702099 [0,1,0,0,0,1|1,0,0]=3 135 B22R3.23399385 CC(Oc1cc2ccccc2c3c1cccc3)C(=O)N 34a_100000036577_100000702099 [0,1,0,0,0,1|2,0,0]=4 136 B22R3.23399385 CC(Oc1cc2ccccc2c3c1cccc3)C(=O)N 7a_100000036577_100000702099 [0,1,0,0,0,1|2,0,0]=4 137 B22R3.23399385 CC(Sc1cc2ccccc2c3c1cccc3)C(=O)N 62a_100000702099_100009813645 [0,1,0,0,0,1|2,0,0]=4 138 B22R3.23399385 C[C@@H](Nc1nc2ccccc2c3c1cccc3)C(=O)N 27a_100000119354_100000028652 [0,1,0,0,0,1|2,0,0]=4 139 B22R3.23399385 NC(=O)C(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100011215815 [0,1,0,0,0,1|1,0,0]=3 140 B22R3.23399385 NC(=O)C(F)Nc1cc2ccccc2c3c1cccc3 34a_100000029970_100009813875 [0,1,0,0,0,1|1,0,0]=3 141 B22R3.23399385 NC(=O)C(F)Oc1cc2ccccc2c3c1cccc3 34a_100000036577_100009813875 [0,1,0,0,0,1|2,0,0]=4 142 B22R3.23399385 NC(=O)C(F)Oc1cc2ccccc2c3c1cccc3 7a_100000036577_100009813875 [0,1,0,0,0,1|2,0,0]=4 143 B22R3.23399385 NC(=O)C(F)Sc1cc2ccccc2c3c1cccc3 62a_100009813875_100009813645 [0,1,0,0,0,1|2,0,0]=4 144 B22R3.23399385 O=C([O-])C(F)Nc1cc2ccccc2c3c1cccc3 34a_100000029970_100020610796 [0,1,0,0,0,1|2,0,0]=4 145 B22R3.41086425 CN(CC(=O)N)c1nc2ccccc2c3c1cccc3 27a_100000739694_100000028652 [0,1,0,0,0,1|2,0,0]=4 146 B22R3.41086425 NC(=O)CC(=O)c1cc2ccccc2c3c1cccc3 1458a_100020586880_100000187820 [0,1,0,0,0,1|2,0,0]=4 147 B22R3.2264810 C#CCC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100011220946 [0,2,0,0,0,0|2,0,0]=4 148 B22R3.2264810 C=CCC(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000210193 [0,2,0,0,0,0|2,0,0]=4 149 B22R3.2264810 C=CCC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000210193 [0,2,0,0,0,0|2,0,0]=4 150 B22R3.2264810 C=CCC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000210193 [0,2,0,0,0,0|2,0,0]=4 151 B22R3.2264810 CC#CC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000763181 [0,2,0,0,0,0|2,0,0]=4 152 B22R3.2264810 CC=CC(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000210699 [0,2,0,0,0,0|2,0,0]=4 153 B22R3.2264810 CC=CC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000210699 [0,2,0,0,0,0|2,0,0]=4 154 B22R3.2264810 CC=CC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000210699 [0,2,0,0,0,0|2,0,0]=4 155 B22R3.2264810 CCCC(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000211992 [0,2,0,0,0,0|2,0,0]=4 156 B22R3.2264810 CCCC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000211992 [0,2,0,0,0,0|2,0,0]=4 157 B22R3.2264810 CCCC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000211992 [0,2,0,0,0,0|2,0,0]=4 158 B22R3.2264810 CCNC(=O)Nc1cc2ccccc2c3c1cccc3 2430a_100000029970_100015525214 [0,2,0,0,0,0|1,0,0]=3 159 B22R3.2264810 COCC(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000210968 [0,2,0,0,0,0|2,0,0]=4 160 B22R3.2264810 COCC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000210968 [0,2,0,0,0,0|2,0,0]=4 161 B22R3.2264810 COCC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000210968 [0,2,0,0,0,0|2,0,0]=4 162 B22R3.2264810 CSCC(=O)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_100000184570 [0,2,0,0,0,0|2,0,0]=4 163 B22R3.2264810 CSCC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100000184570 [0,2,0,0,0,0|2,0,0]=4 164 B22R3.2264810 CSCC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100000184570 [0,2,0,0,0,0|2,0,0]=4 165 B22R3.2264810 N#CCC(=O)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100051588842 [0,2,0,0,0,0|1,0,1]=4 166 B22R3.2264810 N#CCC(=O)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100051588842 [0,2,0,0,0,0|1,0,1]=4 167 B22R3.2264810 O=C(C=CBr)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100016273825 [0,2,0,0,0,0|2,0,0]=4 168 B22R3.2264810 O=C(C=CCl)Nc1cc2ccccc2c3c1cccc3 11a_100000029970_200016279998 [0,2,0,0,0,0|2,0,0]=4 169 B22R3.2264810 O=C(C=CCl)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_200016279998 [0,2,0,0,0,0|2,0,0]=4 170 B22R3.2264810 O=C(C=CI)Nc1cc2ccccc2c3c1cccc3 1626a_100000029970_100016256311 [0,2,0,0,0,0|2,0,0]=4 171 B22R3.2264810 O=C(CCO)Nc1cc2ccccc2c3c1cccc3 22a_100000029970_100011216618 [0,2,0,0,0,0|2,0,0]=4 172 B20R3.11933 Cc1nc(c(s1)c2ccccc2)c3ccccc3 271570a_100011218836_200009828155 [0,0,1,1,0,0|2,0,0]=4 173 B20R3.11933 Nc1nc(c(s1)c2ccccc2)c3ccccc3 271570a_100011218836_100000689622 [0,0,1,1,0,0|1,0,0]=3 174 B20R3.11933 Nc1nc(c(s1)c2ccccn2)c3ccccc3 271570a_100011264011_100000689622 [0,0,1,1,0,0|2,0,0]=4 175 B20R3.11933 Nc1nc(c(s1)c2cccnc2)c3ccccc3 271570a_100000757648_100000689622 [0,0,1,1,0,0|2,0,0]=4 176 B20R3.11933 Nc1nc(c(s1)c2ccncc2)c3ccccc3 271570a_100000752145_100000689622 [0,0,1,1,0,0|2,0,0]=4 177 B20R3.144 Cc1nc(c[nH]1)c2ccccc2c3ccccc3 271570a_100000036471_100009814057 [0,0,1,1,0,0|1,0,1]=4 178 B20R3.144 Cc1ncc(s1)c2ccccc2c3ccccc3 271570a_100000036471_100000764884 [0,0,1,1,0,0|2,0,0]=4 179 B20R3.144 Cc1ncc(s1)c2ccccc2c3ccccc3 271570a_100000696845_100000033479 [0,0,1,1,0,0|2,0,0]=4 180 B20R3.144 Nc1nc(cs1)c2ccccc2c3ccccc3 271570a_100000036471_100011998049 [0,0,1,1,0,0|1,0,1]=4 181 B20R3.144 Nc1nc(cs1)c2ccccc2c3ccccc3 271570a_100011218836_200000168896 [0,0,1,1,0,0|1,0,1]=4 182 B20R3.144 Nc1nnc(o1)c2ccccc2c3ccccc3 271570a_100011218836_100011209138 [0,0,1,1,0,0|2,0,0]=4 183 B20R3.144 Nc1nnc(s1)c2ccccc2c3ccccc3 271570a_100000036471_100000738278 [0,0,1,1,0,0|2,0,0]=4 184 B20R3.8685 Nc1nc(c2c(cccc2n1)c3ccccc3)N 271570a_100011218836_200011217714 [0,0,1,1,0,0|1,0,1]=4 185 B20R3.5963 Cc1ccccc1c2cccc3c2ccc(n3)N 271570a_100000747142_100000723655 [0,0,1,1,0,0|1,0,1]=4 186 B20R3.5963 Cc1ccccc1c2cccc3c2cnc(n3)N 271570a_100000747142_100010209551 [0,0,1,1,0,0|0,0,2]=4 187 B20R3.5963 Nc1ccc2c(cccc2n1)c3ccccc3Cl 271570a_100011934419_100000723655 [0,0,1,1,0,0|2,0,0]=4 188 B20R3.5963 Nc1ccc2c(cccc2n1)c3ccccc3F 271570a_100000761933_100000723655 [0,0,1,1,0,0|2,0,0]=4 189 B20R3.5963 Nc1ccc2c(cccc2n1)c3ccccc3I 271570a_100000069755_100000723655 [0,0,1,1,0,0|2,0,0]=4 190 B20R3.5963 Nc1ccc2c(cccc2n1)c3ccccc3N 271570a_100000034411_100000723655 [0,0,1,1,0,0|2,0,0]=4 191 B20R3.5963 Nc1ccc2c(cccc2n1)c3ccccc3O 271570a_100000035170_100000723655 [0,0,1,1,0,0|2,0,0]=4 192 B20R3.5963 Nc1ncc2c(cccc2n1)c3ccccc3Cl 271570a_100011934419_100010209551 [0,0,1,1,0,0|1,0,1]=4 193 B20R3.5963 Nc1ncc2c(cccc2n1)c3ccccc3F 271570a_100000761933_100010209551 [0,0,1,1,0,0|1,0,1]=4 194 B20R3.5963 Nc1ncc2c(cccc2n1)c3ccccc3I 271570a_100000069755_100010209551 [0,0,1,1,0,0|1,0,1]=4 195 B20R3.5963 Nc1ncc2c(cccc2n1)c3ccccc3N 271570a_100000034411_100010209551 [0,0,1,1,0,0|1,0,1]=4 196 B20R3.5963 Nc1ncc2c(cccc2n1)c3ccccc3O 271570a_100000035170_100010209551 [0,0,1,1,0,0|1,0,1]=4 197 B20R3.5148346 CC(=O)Nc1c2ccccc2cc3c1cccc3 11a_100009882017_100015343762 [0,0,1,1,0,0|2,0,0]=4 198 B20R3.5148346 CC(=O)Nc1c2ccccc2cc3c1cccc3 1626a_100009882017_100015343762 [0,0,1,1,0,0|2,0,0]=4 199 B20R3.5148346 CC(=O)Nc1c2ccccc2cc3c1cccc3 22a_100009882017_100000070787 [0,0,1,1,0,0|2,0,0]=4 200 B18R2.4111 CC(=O)/C(=C/c1ccccc1)/c2ccccc2 1458a_100020600812_200000210301 [0,0,1,0,1,0|2,0,0]=4 201 B18R2.4111 [13CH3]C(=O)/C(=C/c1ccccc1)/c2ccccc2 1458a_100020600812_200025704644 [0,0,1,0,1,0|2,0,0]=4 202 B18R2.4011 Cc1ccccc1c2ccccc2NC(=O)N 271570a_100000747142_100000742221 [0,0,1,0,1,0|1,0,1]=4 203 B18R2.4011 NC(=O)Nc1ccccc1c2ccccc2Cl 271570a_100011934419_100000742221 [0,0,1,0,1,0|2,0,0]=4 204 B18R2.4011 NC(=O)Nc1ccccc1c2ccccc2F 271570a_100000761933_100000742221 [0,0,1,0,1,0|2,0,0]=4 205 B18R2.4011 NC(=O)Nc1ccccc1c2ccccc2I 271570a_100000069755_100000742221 [0,0,1,0,1,0|2,0,0]=4 206 B18R2.4011 NC(=O)Nc1ccccc1c2ccccc2N 271570a_100000034411_100000742221 [0,0,1,0,1,0|2,0,0]=4 207 B18R2.4011 NC(=O)Nc1ccccc1c2ccccc2O 271570a_100000035170_100000742221 [0,0,1,0,1,0|2,0,0]=4 208 B22R3.12390641 C=C(C)CCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000730704 [0,0,0,0,0,2|2,0,0]=4 209 B22R3.12390641 CC(=CCNc1cc2ccccc2c3c1cccc3)C 34a_100000029970_100000761012 [0,0,0,0,0,2|2,0,0]=4 210 B22R3.12390641 CC(=O)NN=Cc1cc2ccccc2c3c1cccc3 4a_100000189765_100000033530 [0,0,0,0,0,2|2,0,0]=4 211 B22R3.12390641 CC(=O)OCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100009813279 [0,0,0,0,0,2|2,0,0]=4 212 B22R3.12390641 NC(=O)CCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000731001 [0,0,0,0,0,2|1,0,0]=3 213 B22R3.12390641 NC(=O)CCNc1nc2ccccc2c3c1cccc3 27a_100000740010_100000028652 [0,0,0,0,0,2|2,0,0]=4 214 B22R3.12390641 NC(=O)CCOc1cc2ccccc2c3c1cccc3 34a_100000036577_100000731001 [0,0,0,0,0,2|2,0,0]=4 215 B22R3.12390641 NC(=O)CCOc1cc2ccccc2c3c1cccc3 7a_100000036577_100000744528 [0,0,0,0,0,2|2,0,0]=4 216 B22R3.12390641 NC(=O)CCSc1cc2ccccc2c3c1cccc3 62a_100000744528_100009813645 [0,0,0,0,0,2|2,0,0]=4