0 B14R2.2 C=C(C)Cn1cnc2ccccc21 Amb1149104 [0,0,0,0,0,0|2,0,2]=4 1 B14R2.2 CC(=O)Cc1cnc2ccccn12 Amb24082608 [0,0,0,0,0,0|2,0,2]=4 2 B14R2.2 CC(=O)Cc1cnn2ccccc12 Amb33147713 [0,0,0,0,0,0|2,0,2]=4 3 B14R2.2 CC(=O)Cc1coc2ccccc12 Amb25861273 [0,0,0,0,0,0|2,0,1]=3 4 B14R2.2 CC(=O)Cc1csc2ccccc12 Amb17594971 [0,0,0,0,0,0|2,0,1]=3 5 B14R2.2 CC(=O)Cn1ccc2ccccc21 Amb18185769 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.2 CC(=O)Cn1cnc2ccccc21 Amb9215880 [0,0,0,0,0,0|2,0,2]=4 7 B14R2.2 CC(=O)NC1=CCc2ccccc21 Amb22270448 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.2 CC(=O)Nc1coc2ccccc12 Amb1102596 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.2 CC(=O)Nc1csc2ccccc12 Amb10810744 [0,0,0,0,0,0|3,0,1]=4 10 B14R2.2 CC(=O)Oc1coc2ccccc12 Amb6357855 [0,0,0,0,0,0|3,0,1]=4 11 B14R2.2 CC(Br)CC1CCc2ccccc21 Amb33430894 [0,0,0,0,0,0|2,0,2]=4 12 B14R2.2 CC(Br)Cc1cnc2ccccn12 Amb33432399 [0,0,0,0,0,0|2,0,1]=3 13 B14R2.2 CC(Br)Cc1cnc2cnccn12 Amb33435666 [0,0,0,0,0,0|3,0,1]=4 14 B14R2.2 CC(Br)Cc1cnn2ccccc12 Amb33435087 [0,0,0,0,0,0|2,0,1]=3 15 B14R2.2 CC(Br)Cc1csc2ccccc12 Amb27670238 [0,0,0,0,0,0|2,0,0]=2 16 B14R2.2 CC(C)CN1CCc2ccccc21 Amb17233127 [0,0,0,0,0,0|3,0,1]=4 17 B14R2.2 CC(C)Cc1ncc2ccccn12 Amb17138743 [0,0,0,0,0,0|4,0,0]=4 18 B14R2.2 CC(C)Cn1cnc2ccccc21 Amb1104115 [0,0,0,0,0,0|2,0,1]=3 19 B14R2.2 CC(C)Nc1coc2ccccc12 Amb25158272 [0,0,0,0,0,0|3,0,0]=3 20 B14R2.2 CC(C)Nc1csc2ccccc12 Amb27448120 [0,0,0,0,0,0|3,0,0]=3 21 B14R2.2 CC(C)Nc1nsc2ccccc12 Amb26564228 [0,0,0,0,0,0|4,0,0]=4 22 B14R2.2 CC(C)Nc1snc2ccccc12 Amb27490566 [0,0,0,0,0,0|3,0,1]=4 23 B14R2.2 CC(C)Oc1cnc2ccccn12 Amb27217591 [0,0,0,0,0,0|3,0,1]=4 24 B14R2.2 CC(N)CC1CCc2ccccc21 Amb33745573 [0,0,0,0,0,0|1,0,2]=3 25 B14R2.2 CC(N)CC1CCc2cccnc21 Amb27210649 [0,0,0,0,0,0|2,0,2]=4 26 B14R2.2 CC(N)Cc1cnc2ccccn12 Amb29083478 [0,0,0,0,0,0|1,0,1]=2 27 B14R2.2 CC(N)Cc1cnn2ccccc12 Amb22718739 [0,0,0,0,0,0|1,0,1]=2 28 B14R2.2 CC(N)Cc1csc2ccccc12 Amb2237287 [0,0,0,0,0,0|1,0,0]=1 29 B14R2.2 CC(N)Cc1ncc2ccccn12 Amb17060839 [0,0,0,0,0,0|3,0,0]=3 30 B14R2.2 CC(N)Cc1nnc2cccnn12 Amb27765390 [0,0,0,0,0,0|3,0,1]=4 31 B14R2.2 CC(N)Cc1noc2ccccc12 Amb28125710 [0,0,0,0,0,0|2,0,0]=2 32 B14R2.2 CC(N)Cn1ccc2ccccc21 Amb15701214 [0,0,0,0,0,0|2,0,0]=2 33 B14R2.2 CC(O)CC1=CCc2ccccc21 Amb27970563 [0,0,0,0,0,0|2,0,0]=2 34 B14R2.2 CC(O)CC1CCc2ccccc21 Amb33145769 [0,0,0,0,0,0|2,0,2]=4 35 B14R2.2 CC(O)CC1CNc2ccccc21 Amb27433910 [0,0,0,0,0,0|1,0,2]=3 36 B14R2.2 CC(O)CN1CCc2ccccc21 Amb17138823 [0,0,0,0,0,0|3,0,1]=4 37 B14R2.2 CC(O)Cc1cnc2ccccn12 Amb33274401 [0,0,0,0,0,0|2,0,1]=3 38 B14R2.2 CC(O)Cc1cnc2cnccn12 Amb32724414 [0,0,0,0,0,0|3,0,1]=4 39 B14R2.2 CC(O)Cc1cnn2ccccc12 Amb33147913 [0,0,0,0,0,0|2,0,1]=3 40 B14R2.2 CC(O)Cc1coc2ccccc12 Amb28061306 [0,0,0,0,0,0|2,0,0]=2 41 B14R2.2 CC(O)Cc1csc2ccccc12 Amb26944427 [0,0,0,0,0,0|2,0,0]=2 42 B14R2.2 CC(O)Cn1cnc2ccccc21 Amb2720664 [0,0,0,0,0,0|2,0,1]=3 43 B14R2.2 CC(O)Cn1nnc2ccccc21 Amb27179528 [0,0,0,0,0,0|3,0,1]=4 44 B14R2.2 CC(O)\C=C1\CCc2ccccc21 Amb27651997 [0,0,0,0,0,0|2,0,2]=4 45 B14R2.2 CN(C)Cc1cnc2ccccn12 Amb32718816 [0,0,0,0,0,0|3,0,1]=4 46 B14R2.2 CN(C)Cc1cnc2ccccn12 Amb8397240 [0,0,0,0,0,0|3,0,1]=4 47 B14R2.2 CN(C)Cc1coc2ccccc12 Amb27631487 [0,0,0,0,0,0|3,0,0]=3 48 B14R2.2 CN(C)Cc1csc2ccccc12 Amb4056962 [0,0,0,0,0,0|3,0,0]=3 49 B14R2.2 CN(C)Cn1ccc2ccccc21 Amb10558642 [0,0,0,0,0,0|4,0,0]=4 50 B14R2.2 CN(C)Cn1cnc2ccccc21 Amb10566664 [0,0,0,0,0,0|3,0,1]=4 51 B14R2.2 CN(O)Cc1cnc2ccccn12 Amb33274536 [0,0,0,0,0,0|3,0,1]=4 52 B14R2.2 CN(O)Cc1cnn2ccccc12 Amb33148244 [0,0,0,0,0,0|3,0,1]=4 53 B14R2.2 CN(O)Cc1csc2ccccc12 Amb33313045 [0,0,0,0,0,0|3,0,0]=3 54 B14R2.2 C[C@@H](N)CC1CCc2ccccc21 Amb33145119 [0,0,0,0,0,0|1,0,2]=3 55 B14R2.2 C[C@@H](N)CN1CCc2ccccc21 Amb18014358 [0,0,0,0,0,0|2,0,1]=3 56 B14R2.2 C[C@@H](N)Cc1cnc2ccccn12 Amb33274049 [0,0,0,0,0,0|1,0,1]=2 57 B14R2.2 C[C@@H](N)Cc1cnc2cnccn12 Amb32724737 [0,0,0,0,0,0|2,0,1]=3 58 B14R2.2 C[C@@H](N)Cc1cnn2ccccc12 Amb33147409 [0,0,0,0,0,0|1,0,1]=2 59 B14R2.2 C[C@@H](N)Cc1csc2ccccc12 Amb33312707 [0,0,0,0,0,0|1,0,0]=1 60 B14R2.2 C[C@@H](O)CC1CCc2ccccc21 Amb33226439 [0,0,0,0,0,0|2,0,2]=4 61 B14R2.2 C[C@@H](O)CN1CCc2ccccc21 Amb27483687 [0,0,0,0,0,0|3,0,1]=4 62 B14R2.2 C[C@@H](O)Cc1cnc2ccccn12 Amb33274046 [0,0,0,0,0,0|2,0,1]=3 63 B14R2.2 C[C@@H](O)Cc1cnc2cnccn12 Amb32724734 [0,0,0,0,0,0|3,0,1]=4 64 B14R2.2 C[C@@H](O)Cc1cnn2ccccc12 Amb33147406 [0,0,0,0,0,0|2,0,1]=3 65 B14R2.2 C[C@@H](O)Cc1csc2ccccc12 Amb33312704 [0,0,0,0,0,0|2,0,0]=2 66 B14R2.2 C[C@@H](O)Cn1cnc2ccccc21 Amb27979541 [0,0,0,0,0,0|2,0,1]=3 67 B14R2.2 C[C@H](N)CC1CCc2ccccc21 Amb33145118 [0,0,0,0,0,0|1,0,2]=3 68 B14R2.2 C[C@H](N)CN1CCc2ccccc21 Amb5782046 [0,0,0,0,0,0|2,0,1]=3 69 B14R2.2 C[C@H](N)Cc1cnc2ccccn12 Amb33274048 [0,0,0,0,0,0|1,0,1]=2 70 B14R2.2 C[C@H](N)Cc1cnc2cnccn12 Amb32724736 [0,0,0,0,0,0|2,0,1]=3 71 B14R2.2 C[C@H](N)Cc1cnn2ccccc12 Amb33147408 [0,0,0,0,0,0|1,0,1]=2 72 B14R2.2 C[C@H](N)Cc1csc2ccccc12 Amb33312706 [0,0,0,0,0,0|1,0,0]=1 73 B14R2.2 C[C@H](N)Cn1cnc2ccccc21 Amb27808045 [0,0,0,0,0,0|1,0,1]=2 74 B14R2.2 C[C@H](N)Cn1ncc2ccccc21 Amb28349023 [0,0,0,0,0,0|3,0,0]=3 75 B14R2.2 C[C@H](O)CC1CCc2ccccc21 Amb33145117 [0,0,0,0,0,0|2,0,2]=4 76 B14R2.2 C[C@H](O)Cc1cnc2ccccn12 Amb33274047 [0,0,0,0,0,0|2,0,1]=3 77 B14R2.2 C[C@H](O)Cc1cnc2cnccn12 Amb32724735 [0,0,0,0,0,0|3,0,1]=4 78 B14R2.2 C[C@H](O)Cc1cnn2ccccc12 Amb33147407 [0,0,0,0,0,0|2,0,1]=3 79 B14R2.2 C[C@H](O)Cc1csc2ccccc12 Amb33312705 [0,0,0,0,0,0|2,0,0]=2 80 B14R2.2 C[C@H](O)Cn1cnc2ccccc21 Amb28456800 [0,0,0,0,0,0|2,0,1]=3 81 B14R2.2 C\C(N)=N\c1nsc2ccccc12 Amb26965564 [0,0,0,0,0,0|3,0,1]=4 82 B14R2.2 N=C(N)Cc1cnc2ccccn12 Amb33146245 [0,0,0,0,0,0|2,0,2]=4 83 B14R2.2 N=C(N)Cc1cnn2ccccc12 Amb33146756 [0,0,0,0,0,0|2,0,2]=4 84 B14R2.2 N=C(N)Cc1csc2ccccc12 Amb25708051 [0,0,0,0,0,0|2,0,1]=3 85 B14R2.2 N=C(N)Cn1cnc2ccccc21 Amb19149364 [0,0,0,0,0,0|2,0,2]=4 86 B14R2.2 NC(=O)CC1=CNC2C=CC=CN12 Amb22491825 [0,0,0,0,0,0|2,0,2]=4 87 B14R2.2 NC(=O)Cc1cnc2ccccn12 Amb22235446 [0,0,0,0,0,0|2,0,2]=4 88 B14R2.2 NC(=O)Cc1coc2ccccc12 Amb22039467 [0,0,0,0,0,0|2,0,1]=3 89 B14R2.2 NC(=O)Cc1coc2ccncc12 Amb27974522 [0,0,0,0,0,0|3,0,1]=4 90 B14R2.2 NC(=O)Cc1csc2ccccc12 Amb25322207 [0,0,0,0,0,0|2,0,1]=3 91 B14R2.2 NC(=O)Cc1noc2ccccc12 Amb8858552 [0,0,0,0,0,0|3,0,1]=4 92 B14R2.2 NC(=O)Cc1nsc2ccccc12 Amb2608950 [0,0,0,0,0,0|3,0,1]=4 93 B14R2.2 NC(=O)Cn1ccc2ccccc21 Amb1951914 [0,0,0,0,0,0|3,0,1]=4 94 B14R2.2 NC(=O)Cn1cnc2ccccc21 Amb1227783 [0,0,0,0,0,0|2,0,2]=4 95 B14R2.2 NC(=O)Nc1csc2ccccc12 Amb28182833 [0,0,0,0,0,0|3,0,1]=4 96 B14R2.2 NC(=S)Cc1cnc2ccccn12 Amb17115528 [0,0,0,0,0,0|2,0,2]=4 97 B14R2.2 NC(=S)Cc1cnn2ccccc12 Amb33146755 [0,0,0,0,0,0|2,0,2]=4 98 B14R2.2 NC(=S)Cc1csc2ccccc12 Amb26512313 [0,0,0,0,0,0|2,0,1]=3 99 B14R2.2 NC(=S)Cc1nsc2ccccc12 Amb27229226 [0,0,0,0,0,0|3,0,1]=4 100 B14R2.2 NC(=S)Cn1cnc2ccccc21 Amb6263368 [0,0,0,0,0,0|2,0,2]=4 101 B14R2.2 O=C(Cl)Cc1coc2ccccc12 Amb2723678 [0,0,0,0,0,0|3,0,1]=4 102 B14R2.2 O=C(O)Cc1coc2ccccc12 Amb2723677 [0,0,0,0,0,0|3,0,1]=4 103 B14R2.2 O=C(O)Cc1csc2ccccc12 Amb2725408 [0,0,0,0,0,0|3,0,1]=4 104 B14R2.2 O=[N+]([O-])Cc1csc2ccccc12 Amb33312692 [0,0,0,0,0,0|4,0,0]=4 105 B13R2.1 BrCCC1=CCc2ccccc21 Amb27808546 [1,0,0,0,0,0|2,0,0]=3 106 B13R2.1 BrCCc1cnc2ccccn12 Amb33432397 [1,0,0,0,0,0|2,0,1]=4 107 B13R2.1 BrCCc1cnn2ccccc12 Amb33435085 [1,0,0,0,0,0|2,0,1]=4 108 B13R2.1 BrCCc1coc2ccccc12 Amb25679155 [1,0,0,0,0,0|2,0,0]=3 109 B13R2.1 BrCCc1csc2ccccc12 Amb25353248 [1,0,0,0,0,0|2,0,0]=3 110 B13R2.1 BrCCc1noc2ccccc12 Amb17108211 [1,0,0,0,0,0|3,0,0]=4 111 B13R2.1 BrCCc1nsc2ccccc12 Amb27475297 [1,0,0,0,0,0|3,0,0]=4 112 B13R2.1 BrCCc1onc2ccccc12 Amb28051589 [1,0,0,0,0,0|2,0,1]=4 113 B13R2.1 BrCCn1cnc2ccccc21 Amb21960006 [1,0,0,0,0,0|2,0,1]=4 114 B13R2.1 BrCCn1cnc2ccccc21 Amb6255282 [1,0,0,0,0,0|2,0,1]=4 115 B13R2.1 C#CCc1csc2ccccc12 Amb33312702 [1,0,0,0,0,0|1,0,2]=4 116 B13R2.1 CCCC1CNc2ccccc21 Amb25882717 [1,0,0,0,0,0|0,0,2]=3 117 B13R2.1 CCCN1CCc2ccccc21 Amb4036579 [1,0,0,0,0,0|2,0,1]=4 118 B13R2.1 CCC[n+]1csc2ccccc21 Amb3984862 [1,0,0,0,0,0|2,0,0]=3 119 B13R2.1 CCCc1ccc2ccccn12 Amb28145853 [1,0,0,0,0,0|2,0,0]=3 120 B13R2.1 CCCc1ncc2ccccn12 Amb17138510 [1,0,0,0,0,0|3,0,0]=4 121 B13R2.1 CCCc1noc2ccccc12 Amb27225179 [1,0,0,0,0,0|2,0,0]=3 122 B13R2.1 CCCn1ccc2cccnc21 Amb28051588 [1,0,0,0,0,0|3,0,0]=4 123 B13R2.1 CCCn1ccc2ccncc21 Amb27613219 [1,0,0,0,0,0|3,0,0]=4 124 B13R2.1 CCCn1cnc2ccccc21 Amb1104096 [1,0,0,0,0,0|1,0,1]=3 125 B13R2.1 CCCn1cnc2cccnc21 Amb30021067 [1,0,0,0,0,0|2,0,1]=4 126 B13R2.1 CCCn1cnc2cnccc21 Amb30021066 [1,0,0,0,0,0|2,0,1]=4 127 B13R2.1 CCCn1nnc2ccccc21 Amb10560208 [1,0,0,0,0,0|2,0,1]=4 128 B13R2.1 CCNC1CNc2ccccc21 Amb27642737 [1,0,0,0,0,0|1,0,2]=4 129 B13R2.1 CCNc1coc2ccccc12 Amb25119969 [1,0,0,0,0,0|2,0,0]=3 130 B13R2.1 CCNc1csc2ccccc12 Amb25820242 [1,0,0,0,0,0|2,0,0]=3 131 B13R2.1 CCNc1noc2ccccc12 Amb27454266 [1,0,0,0,0,0|3,0,0]=4 132 B13R2.1 CCNc1nsc2ccccc12 Amb24066790 [1,0,0,0,0,0|3,0,0]=4 133 B13R2.1 CCNc1nsc2ccccc12 Amb24488581 [1,0,0,0,0,0|3,0,0]=4 134 B13R2.1 CCNn1cnc2ccccc21 Amb27641833 [1,0,0,0,0,0|2,0,1]=4 135 B13R2.1 CCOc1coc2cccnc12 Amb27954718 [1,0,0,0,0,0|3,0,0]=4 136 B13R2.1 CCOc1nsc2ccccc12 Amb27962492 [1,0,0,0,0,0|3,0,0]=4 137 B13R2.1 CCSc1snc2ccccc12 Amb28436328 [1,0,0,0,0,0|2,0,1]=4 138 B13R2.1 CNCC1C=Cc2ccccc21 Amb27463630 [1,0,0,0,0,0|2,0,1]=4 139 B13R2.1 CNCC1CNc2ccccc21 Amb27864740 [1,0,0,0,0,0|1,0,2]=4 140 B13R2.1 CNCc1ccc2cccoc12 Amb25915335 [1,0,0,0,0,0|3,0,0]=4 141 B13R2.1 CNCc1ccc2ccocc12 Amb26035297 [1,0,0,0,0,0|3,0,0]=4 142 B13R2.1 CNCc1ccc2coccc12 Amb24473156 [1,0,0,0,0,0|3,0,0]=4 143 B13R2.1 CNCc1cnc2ccccn12 Amb22587616 [1,0,0,0,0,0|2,0,1]=4 144 B13R2.1 CNCc1cnc2ccccn12 Amb22587686 [1,0,0,0,0,0|2,0,1]=4 145 B13R2.1 CNCc1cnc2ccccn12 Amb8503485 [1,0,0,0,0,0|2,0,1]=4 146 B13R2.1 CNCc1cnn2ccccc12 Amb27412681 [1,0,0,0,0,0|2,0,1]=4 147 B13R2.1 CNCc1coc2ccccc12 Amb19649828 [1,0,0,0,0,0|2,0,0]=3 148 B13R2.1 CNCc1csc2ccccc12 Amb18286790 [1,0,0,0,0,0|2,0,0]=3 149 B13R2.1 CNCc1csc2ccccc12 Amb9147582 [1,0,0,0,0,0|2,0,0]=3 150 B13R2.1 CNCc1csc2ncccc12 Amb27959092 [1,0,0,0,0,0|3,0,0]=4 151 B13R2.1 COCc1coc2ncccc12 Amb27175694 [1,0,0,0,0,0|3,0,0]=4 152 B13R2.1 COCc1noc2ccccc12 Amb27185986 [1,0,0,0,0,0|3,0,0]=4 153 B13R2.1 COCn1ccc2ccccc21 Amb23401114 [1,0,0,0,0,0|3,0,0]=4 154 B13R2.1 COCn1cnc2ccccc21 Amb1162307 [1,0,0,0,0,0|2,0,1]=4 155 B13R2.1 ClCCc1noc2ccccc12 Amb17108104 [1,0,0,0,0,0|3,0,0]=4 156 B13R2.1 ClCCn1cnc2ccccc21 Amb5261381 [1,0,0,0,0,0|2,0,1]=4 157 B13R2.1 ICCC1CNc2ccccc21 Amb27463520 [1,0,0,0,0,0|1,0,2]=4 158 B13R2.1 ICCc1csc2ccccc12 Amb27239170 [1,0,0,0,0,0|2,0,0]=3 159 B13R2.1 ICCn1ccc2ccccc21 Amb27879704 [1,0,0,0,0,0|3,0,0]=4 160 B13R2.1 ICCn1cnc2ccccc21 Amb27764319 [1,0,0,0,0,0|2,0,1]=4 161 B13R2.1 N#CCc1coc2ccccc12 Amb2723682 [1,0,0,0,0,0|1,0,2]=4 162 B13R2.1 N#CCc1csc2ccccc12 Amb2781957 [1,0,0,0,0,0|1,0,2]=4 163 B13R2.1 NCCC1=CCc2ccccc21 Amb19149344 [1,0,0,0,0,0|1,0,0]=2 164 B13R2.1 NCCC1=CCc2ccccc21 Amb21811903 [1,0,0,0,0,0|1,0,0]=2 165 B13R2.1 NCCC1=NNC2=CC=CNN21 Amb18828266 [1,0,0,0,0,0|3,0,0]=4 166 B13R2.1 NCCC1C=Cc2ccccc21 Amb18199855 [1,0,0,0,0,0|1,0,1]=3 167 B13R2.1 NCCC1CCc2ccccc21 Amb17232390 [1,0,0,0,0,0|1,0,2]=4 168 B13R2.1 NCCC1CNc2ccccc21 Amb18560682 [1,0,0,0,0,0|0,0,2]=3 169 B13R2.1 NCCC1COc2ccccc21 Amb18829250 [1,0,0,0,0,0|1,0,2]=4 170 B13R2.1 NCCC1CSc2ccccc21 Amb18194201 [1,0,0,0,0,0|1,0,2]=4 171 B13R2.1 NCCC1OCc2ccccc21 Amb18829221 [1,0,0,0,0,0|2,0,1]=4 172 B13R2.1 NCCN1CCc2ccccc21 Amb1136098 [1,0,0,0,0,0|2,0,1]=4 173 B13R2.1 NCCN1CCc2ccccc21 Amb13948987 [1,0,0,0,0,0|2,0,1]=4 174 B13R2.1 NCCN1CCc2ccccc21 Amb33549124 [1,0,0,0,0,0|2,0,1]=4 175 B13R2.1 NCCN1CCc2ccccc21 Amb5794353 [1,0,0,0,0,0|2,0,1]=4 176 B13R2.1 NCCN1CCc2ccccc21 Amb8428137 [1,0,0,0,0,0|2,0,1]=4 177 B13R2.1 NCCc1ccc2ccccn12 Amb18830177 [1,0,0,0,0,0|2,0,0]=3 178 B13R2.1 NCCc1ccc2cnccn12 Amb18829887 [1,0,0,0,0,0|3,0,0]=4 179 B13R2.1 NCCc1ccc2occcc12 Amb28188766 [1,0,0,0,0,0|2,0,0]=3 180 B13R2.1 NCCc1cnc2ccccn12 Amb15701249 [1,0,0,0,0,0|1,0,1]=3 181 B13R2.1 NCCc1cnc2ccccn12 Amb22587044 [1,0,0,0,0,0|1,0,1]=3 182 B13R2.1 NCCc1cnc2cnccn12 Amb18829674 [1,0,0,0,0,0|2,0,1]=4 183 B13R2.1 NCCc1cnc2ncccn12 Amb8010293 [1,0,0,0,0,0|2,0,1]=4 184 B13R2.1 NCCc1cnn2ccccc12 Amb18126293 [1,0,0,0,0,0|1,0,1]=3 185 B13R2.1 NCCc1coc2ccccc12 Amb2723681 [1,0,0,0,0,0|1,0,0]=2 186 B13R2.1 NCCc1csc2ccccc12 Amb10603482 [1,0,0,0,0,0|1,0,0]=2 187 B13R2.1 NCCc1csc2ccccc12 Amb10609034 [1,0,0,0,0,0|1,0,0]=2 188 B13R2.1 NCCc1csc2ccncc12 Amb18195091 [1,0,0,0,0,0|2,0,0]=3 189 B13R2.1 NCCc1ncc2ccccn12 Amb17058864 [1,0,0,0,0,0|3,0,0]=4 190 B13R2.1 NCCc1ncn2ccccc12 Amb23560071 [1,0,0,0,0,0|3,0,0]=4 191 B13R2.1 NCCc1nnc2ccccn12 Amb31307229 [1,0,0,0,0,0|2,0,1]=4 192 B13R2.1 NCCc1nnc2ccccn12 Amb435645 [1,0,0,0,0,0|2,0,1]=4 193 B13R2.1 NCCc1nnc2ccccn12 Amb6891912 [1,0,0,0,0,0|2,0,1]=4 194 B13R2.1 NCCc1noc2ccccc12 Amb18251617 [1,0,0,0,0,0|2,0,0]=3 195 B13R2.1 NCCc1noc2ccccc12 Amb28600228 [1,0,0,0,0,0|2,0,0]=3 196 B13R2.1 NCCc1noc2cnccc12 Amb27200416 [1,0,0,0,0,0|3,0,0]=4 197 B13R2.1 NCCc1nsc2ccccc12 Amb25214793 [1,0,0,0,0,0|2,0,0]=3 198 B13R2.1 NCCc1nsc2ccccc12 Amb28556073 [1,0,0,0,0,0|2,0,0]=3 199 B13R2.1 NCCc1onc2ccccc12 Amb18829745 [1,0,0,0,0,0|1,0,1]=3 200 B13R2.1 NCCc1snc2ccccc12 Amb28042228 [1,0,0,0,0,0|1,0,1]=3 201 B13R2.1 NCCn1ccc2ccccc21 Amb1291613 [1,0,0,0,0,0|2,0,0]=3 202 B13R2.1 NCCn1ccc2ccccc21 Amb22489718 [1,0,0,0,0,0|2,0,0]=3 203 B13R2.1 NCCn1ccc2ccccc21 Amb31200118 [1,0,0,0,0,0|2,0,0]=3 204 B13R2.1 NCCn1ccc2ccccc21 Amb8503244 [1,0,0,0,0,0|2,0,0]=3 205 B13R2.1 NCCn1ccc2cccnc21 Amb18829906 [1,0,0,0,0,0|3,0,0]=4 206 B13R2.1 NCCn1cnc2ccccc21 Amb10071662 [1,0,0,0,0,0|1,0,1]=3 207 B13R2.1 NCCn1cnc2ccccc21 Amb10609491 [1,0,0,0,0,0|1,0,1]=3 208 B13R2.1 NCCn1cnc2ccccc21 Amb33543060 [1,0,0,0,0,0|1,0,1]=3 209 B13R2.1 NCCn1cnc2cccnc21 Amb18254843 [1,0,0,0,0,0|2,0,1]=4 210 B13R2.1 NCCn1cnc2ccncc21 Amb27441319 [1,0,0,0,0,0|2,0,1]=4 211 B13R2.1 NCCn1ncc2ccccc21 Amb18962464 [1,0,0,0,0,0|3,0,0]=4 212 B13R2.1 NCCn1nnc2ccccc21 Amb10607419 [1,0,0,0,0,0|2,0,1]=4 213 B13R2.1 NCCn1nnc2ccccc21 Amb22492337 [1,0,0,0,0,0|2,0,1]=4 214 B13R2.1 NCCn1nnc2ccccc21 Amb8503275 [1,0,0,0,0,0|2,0,1]=4 215 B13R2.1 NC\C=C1/CCc2ccccc21 Amb27482953 [1,0,0,0,0,0|1,0,2]=4 216 B13R2.1 NNCc1cnc2ccccn12 Amb33274065 [1,0,0,0,0,0|2,0,1]=4 217 B13R2.1 NNCc1cnn2ccccc12 Amb28124392 [1,0,0,0,0,0|2,0,1]=4 218 B13R2.1 NNCc1coc2ccccc12 Amb19664673 [1,0,0,0,0,0|2,0,0]=3 219 B13R2.1 NNCc1csc2ccccc12 Amb18796045 [1,0,0,0,0,0|2,0,0]=3 220 B13R2.1 NNCc1noc2ccccc12 Amb24736646 [1,0,0,0,0,0|3,0,0]=4 221 B13R2.1 NOCc1cnc2ccccn12 Amb33274063 [1,0,0,0,0,0|2,0,1]=4 222 B13R2.1 NOCc1cnn2ccccc12 Amb33147534 [1,0,0,0,0,0|2,0,1]=4 223 B13R2.1 NOCc1coc2ccccc12 Amb26406297 [1,0,0,0,0,0|2,0,0]=3 224 B13R2.1 NOCc1csc2ccccc12 Amb25791722 [1,0,0,0,0,0|2,0,0]=3 225 B13R2.1 NOCc1occ2ccccc12 Amb25319347 [1,0,0,0,0,0|3,0,0]=4 226 B13R2.1 N\N=C\c1coc2ccccc12 Amb27485719 [1,0,0,0,0,0|2,0,1]=4 227 B13R2.1 O=CCc1csc2ccccc12 Amb25736591 [1,0,0,0,0,0|2,0,1]=4 228 B13R2.1 OCCC1CNc2ccccc21 Amb9776213 [1,0,0,0,0,0|1,0,2]=4 229 B13R2.1 OCC[C@@H]1CNc2ccccc21 Amb28255652 [1,0,0,0,0,0|1,0,2]=4 230 B13R2.1 OCC[C@H]1CNc2ccccc21 Amb28137928 [1,0,0,0,0,0|1,0,2]=4 231 B13R2.1 OCCc1cnc2ccccn12 Amb24097754 [1,0,0,0,0,0|2,0,1]=4 232 B13R2.1 OCCc1cnn2ccccc12 Amb32992890 [1,0,0,0,0,0|2,0,1]=4 233 B13R2.1 OCCc1coc2ccccc12 Amb2723680 [1,0,0,0,0,0|2,0,0]=3 234 B13R2.1 OCCc1csc2ccccc12 Amb24066376 [1,0,0,0,0,0|2,0,0]=3 235 B13R2.1 OCCc1noc2ccccc12 Amb17108006 [1,0,0,0,0,0|3,0,0]=4 236 B13R2.1 OCCc1nsc2ccccc12 Amb26932497 [1,0,0,0,0,0|3,0,0]=4 237 B13R2.1 OCCn1ccc2ccccc21 Amb17480906 [1,0,0,0,0,0|3,0,0]=4 238 B13R2.1 OCCn1cnc2ccccc21 Amb4443505 [1,0,0,0,0,0|2,0,1]=4 239 B13R2.1 OC\C=C1\C=Cc2ccccc21 Amb27651915 [1,0,0,0,0,0|2,0,1]=4 240 B13R2.1 ONCc1csc2ccccc12 Amb27975174 [1,0,0,0,0,0|3,0,0]=4 241 B13R2.1 SCCc1cnc2ccccn12 Amb33146249 [1,0,0,0,0,0|2,0,1]=4 242 B13R2.1 SCCc1cnn2ccccc12 Amb33146760 [1,0,0,0,0,0|2,0,1]=4 243 B13R2.1 SCCc1coc2ccccc12 Amb26862256 [1,0,0,0,0,0|2,0,0]=3 244 B13R2.1 SCCc1csc2ccccc12 Amb25045544 [1,0,0,0,0,0|2,0,0]=3 245 B13R2.1 [C-]#[N+]Cc1csc2ccccc12 Amb33313009 [1,0,0,0,0,0|2,0,1]=4 246 B15R2.4 CC(C=O)Cc1coc2ccccc12 Amb35704267 [0,1,0,0,0,0|2,0,0]=3 247 B15R2.4 CC(CBr)Cc1coc2ccccc12 Amb35704105 [0,1,0,0,0,0|2,0,0]=3 248 B15R2.4 CC(CCl)Cc1coc2ccccc12 Amb35704103 [0,1,0,0,0,0|2,0,0]=3 249 B15R2.4 CC(CN)CC1CCc2ccccc21 Amb33746658 [0,1,0,0,0,0|1,0,2]=4 250 B15R2.4 CC(CN)CC1COc2ccccc21 Amb27402299 [0,1,0,0,0,0|1,0,2]=4 251 B15R2.4 CC(CN)Cc1coc2ccccc12 Amb35704256 [0,1,0,0,0,0|1,0,0]=2 252 B15R2.4 CC(CN)Nc1nsc2ccccc12 Amb35718000 [0,1,0,0,0,0|3,0,0]=4 253 B15R2.4 CC(CN)Nc1snc2ccccc12 Amb27586787 [0,1,0,0,0,0|2,0,1]=4 254 B15R2.4 CC(CO)Cc1coc2ccccc12 Amb35704264 [0,1,0,0,0,0|2,0,0]=3 255 B15R2.4 CC(Cc1csc2ccccc12)NN Amb28143218 [0,1,0,0,0,0|1,0,0]=2 256 B15R2.4 CCC(C)Cn1ccc2ccccc21 Amb28244485 [0,1,0,0,0,0|3,0,0]=4 257 B15R2.4 CCC(N)CC1CNc2ccccc21 Amb27165820 [0,1,0,0,0,0|0,0,2]=3 258 B15R2.4 CCC(N)Cc1csc2ccccc12 Amb19649477 [0,1,0,0,0,0|1,0,0]=2 259 B15R2.4 CCC(N)Cc1nnc2ccccn12 Amb27656292 [0,1,0,0,0,0|2,0,1]=4 260 B15R2.4 CCC(O)CC1CNc2ccccc21 Amb35624752 [0,1,0,0,0,0|1,0,2]=4 261 B15R2.4 CCC(O)Cn1ccc2ccccc21 Amb27660843 [0,1,0,0,0,0|3,0,0]=4 262 B15R2.4 CCC(O)Cn1cnc2ccccc21 Amb17606205 [0,1,0,0,0,0|2,0,1]=4 263 B15R2.4 CC[C@@H](N)CN1CCc2ccccc21 Amb27766889 [0,1,0,0,0,0|2,0,1]=4 264 B15R2.4 CC[C@H](O)Cn1cnc2ccccc21 Amb27602399 [0,1,0,0,0,0|2,0,1]=4 265 B15R2.4 CNC(=O)Cc1csc2ccccc12 Amb24724672 [0,1,0,0,0,0|2,0,1]=4 266 B15R2.4 CNC(C)CN1CCc2ccccc21 Amb18982021 [0,1,0,0,0,0|2,0,1]=4 267 B15R2.4 CNC(C)Cc1ncc2ccccn12 Amb17060840 [0,1,0,0,0,0|3,0,0]=4 268 B15R2.4 COC(=O)Cc1coc2ccccc12 Amb25354938 [0,1,0,0,0,0|2,0,1]=4 269 B15R2.4 C[C@@H](CN)CC1CCc2ccccc21 Amb33729614 [0,1,0,0,0,0|1,0,2]=4 270 B15R2.4 C[C@H](CN)CC1CCc2ccccc21 Amb33727710 [0,1,0,0,0,0|1,0,2]=4 271 B15R2.4 C\C(=C\c1coc2ccccc12)CN Amb27399952 [0,1,0,0,0,0|1,0,2]=4 272 B15R2.4 N#CC(N)Cn1cnc2ccccc21 Amb18957606 [0,1,0,0,0,0|1,0,2]=4 273 B15R2.4 N=C(Cc1coc2ccccc12)NO Amb26008301 [0,1,0,0,0,0|2,0,1]=4 274 B15R2.4 NC(CO)CC1CCc2ccccc21 Amb33145749 [0,1,0,0,0,0|1,0,2]=4 275 B15R2.4 NC(CO)Cc1cnc2ccccn12 Amb18818397 [0,1,0,0,0,0|1,0,1]=3 276 B15R2.4 NC(CO)Cc1cnc2cnccn12 Amb32724397 [0,1,0,0,0,0|2,0,1]=4 277 B15R2.4 NC(CO)Cc1cnn2ccccc12 Amb33147893 [0,1,0,0,0,0|1,0,1]=3 278 B15R2.4 NC(CO)Cc1csc2ccccc12 Amb26937238 [0,1,0,0,0,0|1,0,0]=2 279 B15R2.4 NCC(O)Cc1cnc2ccccn12 Amb33146749 [0,1,0,0,0,0|2,0,1]=4 280 B15R2.4 NCC(O)Cc1cnn2ccccc12 Amb33147124 [0,1,0,0,0,0|2,0,1]=4 281 B15R2.4 NCC(O)Cc1csc2ccccc12 Amb24736928 [0,1,0,0,0,0|2,0,0]=3 282 B15R2.4 NCC(O)Cn1cnc2ccccc21 Amb1139802 [0,1,0,0,0,0|2,0,1]=4 283 B15R2.4 O=C(CCl)Cc1coc2ccccc12 Amb27168104 [0,1,0,0,0,0|2,0,1]=4 284 B15R2.4 OC(CBr)Cn1cnc2ccccc21 Amb28314556 [0,1,0,0,0,0|2,0,1]=4 285 B15R2.4 OC(CCl)Cc1coc2ccccc12 Amb35704122 [0,1,0,0,0,0|2,0,0]=3 286 B15R2.4 OCC(O)Cn1ccc2ccccc21 Amb17594991 [0,1,0,0,0,0|3,0,0]=4 287 B15R2.11 CC(C)(N)CC1CCc2ccccc21 Amb27789083 [0,1,0,0,0,0|1,0,2]=4 288 B15R2.11 CC(C)(N)CN1CCc2ccccc21 Amb17082660 [0,1,0,0,0,0|2,0,1]=4 289 B15R2.11 CC(C)(N)Cc1cnc2ccccn12 Amb18819943 [0,1,0,0,0,0|1,0,1]=3 290 B15R2.11 CC(C)(N)Cc1cnc2cnccn12 Amb32724660 [0,1,0,0,0,0|2,0,1]=4 291 B15R2.11 CC(C)(N)Cc1cnn2ccccc12 Amb33147718 [0,1,0,0,0,0|1,0,1]=3 292 B15R2.11 CC(C)(N)Cc1csc2ccccc12 Amb25352969 [0,1,0,0,0,0|1,0,0]=2 293 B15R2.11 CC(C)(N)Cn1ccc2ccccc21 Amb17480902 [0,1,0,0,0,0|2,0,0]=3 294 B15R2.11 CC(C)(N)Cn1nnc2ccccc21 Amb17454169 [0,1,0,0,0,0|2,0,1]=4 295 B15R2.11 CC(C)(O)Cc1cnc2ccccn12 Amb33274400 [0,1,0,0,0,0|2,0,1]=4 296 B15R2.11 CC(C)(O)Cc1cnn2ccccc12 Amb33147912 [0,1,0,0,0,0|2,0,1]=4 297 B15R2.11 CC(C)(O)Cc1csc2ccccc12 Amb28185341 [0,1,0,0,0,0|2,0,0]=3 298 B15R2.11 NS(=O)(=O)Cc1coc2ccccc12 Amb27646297 [0,1,0,0,0,0|3,0,0]=4 299 B15R2.11 NS(=O)(=O)Cc1csc2ccccc12 Amb25753458 [0,1,0,0,0,0|3,0,0]=4 300 B15R2.377 CC(C)Cc1coc2cc(N)ncc12 Amb18819304 [0,1,0,0,0,0|3,0,0]=4 301 B15R2.377 CC(C)Cn1ccc2cc(Br)ccc21 Amb28119296 [0,1,0,0,0,0|3,0,0]=4 302 B15R2.377 CC(C)Cn1ccc2cc(F)ccc21 Amb27769860 [0,1,0,0,0,0|3,0,0]=4 303 B15R2.377 CC(C)Cn1ccc2cc(N)ccc21 Amb8855609 [0,1,0,0,0,0|3,0,0]=4 304 B15R2.377 CC(C)Cn1cnc2cc(Br)ccc21 Amb32708770 [0,1,0,0,0,0|2,0,1]=4 305 B15R2.377 CC(C)Cn1cnc2cc(Cl)ccc21 Amb30636844 [0,1,0,0,0,0|2,0,1]=4 306 B15R2.377 CC(C)Cn1cnc2cc(N)ccc21 Amb18961908 [0,1,0,0,0,0|2,0,1]=4 307 B15R2.377 CC(N)CN1CCc2cc(Cl)ccc21 Amb28072995 [0,1,0,0,0,0|2,0,1]=4 308 B15R2.377 CC(N)CN1CCc2cc(F)ccc21 Amb27747054 [0,1,0,0,0,0|2,0,1]=4 309 B15R2.377 CC(O)Cn1ccc2cc(Cl)ccc21 Amb27811414 [0,1,0,0,0,0|3,0,0]=4 310 B15R2.377 CC(O)Cn1ccc2cc(F)ccc21 Amb27865372 [0,1,0,0,0,0|3,0,0]=4 311 B15R2.377 CC(O)Cn1ccc2cc(N)ccc21 Amb26423055 [0,1,0,0,0,0|3,0,0]=4 312 B15R2.377 C[C@@H](N)Cn1ccc2cc(F)ccc21 Amb27667797 [0,1,0,0,0,0|2,0,0]=3 313 B15R2.377 C[C@@H](O)Cn1ccc2cc(F)ccc21 Amb27969138 [0,1,0,0,0,0|3,0,0]=4 314 B15R2.377 C[C@H](N)Cn1ncc2cc(F)ccc21 Amb27746877 [0,1,0,0,0,0|3,0,0]=4 315 B15R2.377 Cc1ccc2c(CC(C)N)csc2c1 Amb28423926 [0,1,0,0,0,0|1,0,0]=2 316 B15R2.377 Cc1ccc2c(CC(N)=O)coc2c1 Amb2968847 [0,1,0,0,0,0|2,0,1]=4 317 B15R2.377 Cc1ccn2c(CC(C)N)nnc2c1 Amb27182280 [0,1,0,0,0,0|2,0,1]=4 318 B15R2.377 NC(=O)Cc1coc2cc(O)ccc12 Amb27228893 [0,1,0,0,0,0|2,0,1]=4 319 B15R2.993 C=C(C)CN1C(=O)Nc2ccccc21 Amb20285704 [0,1,0,0,0,0|2,0,1]=4 320 B15R2.993 CC(=O)CC1C(=O)Nc2ccccc21 Amb6740589 [0,1,0,0,0,0|1,0,2]=4 321 B15R2.993 CC(=O)CN1C(=S)Nc2ccccc21 Amb28250989 [0,1,0,0,0,0|2,0,1]=4 322 B15R2.993 CC(=O)\C=C1/C(=O)Nc2ccccc21 Amb2731591 [0,1,0,0,0,0|1,0,2]=4 323 B15R2.993 CC(=O)\C=C1\C(=O)Nc2ccccc21 Amb20038307 [0,1,0,0,0,0|1,0,2]=4 324 B15R2.993 CC(Br)Cc1c(Cl)oc2ccccc12 Amb33433624 [0,1,0,0,0,0|2,0,0]=3 325 B15R2.993 CC(Br)Cc1c2ccccc2nn1C Amb33336590 [0,1,0,0,0,0|2,0,1]=4 326 B15R2.993 CC(Br)Cn1c(N)nc2ccccc21 Amb28400905 [0,1,0,0,0,0|2,0,1]=4 327 B15R2.993 CC(C)CC1C(=O)Nc2ccccc21 Amb10070218 [0,1,0,0,0,0|1,0,1]=3 328 B15R2.993 CC(C)CN1C(=S)Nc2ccccc21 Amb19815964 [0,1,0,0,0,0|2,0,0]=3 329 B15R2.993 CC(C)Cn1c(N)nc2ccccc21 Amb1887649 [0,1,0,0,0,0|2,0,1]=4 330 B15R2.993 CC(C)Cn1c(S)nc2ccccc21 Amb1148790 [0,1,0,0,0,0|2,0,1]=4 331 B15R2.993 CC(C)\C=C1/c2ccccc2NC1C Amb27170408 [0,1,0,0,0,0|1,0,2]=4 332 B15R2.993 CC(C)\C=C1\C(=O)Nc2ccccc21 Amb27443549 [0,1,0,0,0,0|1,0,1]=3 333 B15R2.993 CC(N)CC1C(=O)Nc2ccccc21 Amb27803787 [0,1,0,0,0,0|0,0,1]=2 334 B15R2.993 CC(N)CN1C(=O)Oc2ccccc21 Amb18949317 [0,1,0,0,0,0|2,0,0]=3 335 B15R2.993 CC(N)CN1C(=O)Oc2ccccc21 Amb21955881 [0,1,0,0,0,0|2,0,0]=3 336 B15R2.993 CC(O)CN1C(=N)Oc2ccccc21 Amb27981777 [0,1,0,0,0,0|3,0,0]=4 337 B15R2.993 CC(O)Cc1c2ccccc2nn1C Amb33312009 [0,1,0,0,0,0|2,0,1]=4 338 B15R2.993 CC(O)Cn1c(O)nc2ccccc21 Amb26619865 [0,1,0,0,0,0|2,0,1]=4 339 B15R2.993 CC(O)Cn1c(S)nc2ccccc21 Amb22539830 [0,1,0,0,0,0|2,0,1]=4 340 B15R2.993 CC1Cc2ccccc2N1C[C@@H](C)N Amb27765211 [0,1,0,0,0,0|2,0,1]=4 341 B15R2.993 CN(C)\C=C1/C(=O)Nc2ccccc21 Amb2418023 [0,1,0,0,0,0|2,0,1]=4 342 B15R2.993 CN(C)\C=C1\C(=O)Nc2ccccc21 Amb589801 [0,1,0,0,0,0|2,0,1]=4 343 B15R2.993 CN(C)\N=C1/C(=O)Nc2ccccc21 Amb4289351 [0,1,0,0,0,0|3,0,0]=4 344 B15R2.993 CN(O)\C=C1/C(=O)Nc2ccccc21 Amb21932255 [0,1,0,0,0,0|2,0,1]=4 345 B15R2.993 CN(O)\C=C1\C(=O)Nc2ccccc21 Amb28247284 [0,1,0,0,0,0|2,0,1]=4 346 B15R2.993 C[C@@H](N)CN1C(=O)Oc2ccccc21 Amb27834382 [0,1,0,0,0,0|2,0,0]=3 347 B15R2.993 C[C@@H](N)Cc1c2ccccc2nn1C Amb33312141 [0,1,0,0,0,0|1,0,1]=3 348 B15R2.993 C[C@@H](O)Cc1c2ccccc2nn1C Amb33311696 [0,1,0,0,0,0|2,0,1]=4 349 B15R2.993 C[C@H](N)CN1C(=O)Oc2ccccc21 Amb20018766 [0,1,0,0,0,0|2,0,0]=3 350 B15R2.993 C[C@H](N)Cc1c2ccccc2nn1C Amb33312140 [0,1,0,0,0,0|1,0,1]=3 351 B15R2.993 C[C@H](O)Cc1c2ccccc2nn1C Amb33311697 [0,1,0,0,0,0|2,0,1]=4 352 B15R2.993 Cc1nc2ccccc2n1CC(C)C Amb1097861 [0,1,0,0,0,0|2,0,1]=4 353 B15R2.993 Cc1nc2ccccc2n1CC(C)O Amb10976508 [0,1,0,0,0,0|2,0,1]=4 354 B15R2.993 Cc1nc2ccccc2n1C[C@H](C)N Amb27852959 [0,1,0,0,0,0|1,0,1]=3 355 B15R2.993 Cc1nc2ccccc2n1C[C@H](C)O Amb27669699 [0,1,0,0,0,0|2,0,1]=4 356 B15R2.993 Cc1nc2ccccn2c1CC(C)C Amb28189736 [0,1,0,0,0,0|2,0,1]=4 357 B15R2.993 Cc1oc2ccccc2c1CC(C)N Amb27748354 [0,1,0,0,0,0|1,0,0]=2 358 B15R2.993 Cc1sc2ccccc2[n+]1CC(C)C Amb3984914 [0,1,0,0,0,0|3,0,0]=4 359 B15R2.993 Cc1sc2ccccc2c1CC(C)N Amb27462598 [0,1,0,0,0,0|1,0,0]=2 360 B15R2.993 Cc1sc2ccccc2c1CC(N)=O Amb27259899 [0,1,0,0,0,0|2,0,1]=4 361 B15R2.993 NC(=O)CC1C(=O)Nc2ccccc21 Amb28250080 [0,1,0,0,0,0|1,0,2]=4 362 B15R2.993 NC(=S)CC1C(=O)Nc2ccccc21 Amb23571283 [0,1,0,0,0,0|1,0,2]=4 363 B15R2.993 NC(=S)CN1C(=O)Nc2ccccc21 Amb28120219 [0,1,0,0,0,0|2,0,1]=4 364 B15R2.1255 C=C(C)C(N)c1csc2ccccc12 Amb27196119 [0,1,0,0,0,0|2,0,1]=4 365 B15R2.1255 CC(=O)C(N)c1csc2ccccc12 Amb27239947 [0,1,0,0,0,0|2,0,1]=4 366 B15R2.1255 CC(Br)C(C)c1coc2ccccc12 Amb35704099 [0,1,0,0,0,0|2,0,0]=3 367 B15R2.1255 CC(C)C(=O)c1coc2ccccc12 Amb27979870 [0,1,0,0,0,0|2,0,1]=4 368 B15R2.1255 CC(C)C(Cl)c1coc2ccccc12 Amb35704191 [0,1,0,0,0,0|2,0,0]=3 369 B15R2.1255 CC(C)C(N)c1coc2ccccc12 Amb27196222 [0,1,0,0,0,0|2,0,0]=3 370 B15R2.1255 CC(C)C(O)C1CNc2ccccc21 Amb35622377 [0,1,0,0,0,0|1,0,2]=4 371 B15R2.1255 CC(C)C(O)c1cnn2ccccc12 Amb27828368 [0,1,0,0,0,0|2,0,1]=4 372 B15R2.1255 CC(C)[C@@H](N)c1csc2ccccc12 Amb27238679 [0,1,0,0,0,0|2,0,0]=3 373 B15R2.1255 CC(C)[C@@H](O)n1ccc2ccccc21 Amb27405309 [0,1,0,0,0,0|3,0,0]=4 374 B15R2.1255 CC(C)[C@H](N)c1coc2ccccc12 Amb28046879 [0,1,0,0,0,0|2,0,0]=3 375 B15R2.1255 CC(Cl)C(C)c1coc2ccccc12 Amb35704098 [0,1,0,0,0,0|2,0,0]=3 376 B15R2.1255 CC(N)C(=O)c1cnc2ccccn12 Amb18820295 [0,1,0,0,0,0|1,0,2]=4 377 B15R2.1255 CC(N)C(=O)c1cnn2ccccc12 Amb33147712 [0,1,0,0,0,0|1,0,2]=4 378 B15R2.1255 CC(N)C(=O)c1coc2ccccc12 Amb30009591 [0,1,0,0,0,0|1,0,1]=3 379 B15R2.1255 CC(N)C(=O)c1csc2ccccc12 Amb33195463 [0,1,0,0,0,0|1,0,1]=3 380 B15R2.1255 CC(N)C(C)c1coc2ccccc12 Amb35704123 [0,1,0,0,0,0|1,0,0]=2 381 B15R2.1255 CC(N)C(C)c1nnc2ccccn12 Amb28409524 [0,1,0,0,0,0|2,0,1]=4 382 B15R2.1255 CC(N)C(O)c1csc2ccccc12 Amb18963398 [0,1,0,0,0,0|1,0,0]=2 383 B15R2.1255 CC(N)C(O)c1nsc2ccccc12 Amb27772931 [0,1,0,0,0,0|2,0,0]=3 384 B15R2.1255 CC(O)C(=O)c1coc2ccccc12 Amb24534902 [0,1,0,0,0,0|2,0,1]=4 385 B15R2.1255 CC(O)C(=O)c1csc2ccccc12 Amb26081036 [0,1,0,0,0,0|2,0,1]=4 386 B15R2.1255 CC(O)C(C)c1coc2ccccc12 Amb35704263 [0,1,0,0,0,0|2,0,0]=3 387 B15R2.1255 CC(O)C(N)c1coc2ccccc12 Amb27750442 [0,1,0,0,0,0|2,0,0]=3 388 B15R2.1255 CC(O)C(O)c1coc2ccccc12 Amb35704239 [0,1,0,0,0,0|2,0,0]=3 389 B15R2.1255 CC(O)[C@@H](N)c1csc2ccccc12 Amb27182832 [0,1,0,0,0,0|2,0,0]=3 390 B15R2.1255 C[C@@H](N)C(=O)c1coc2ccccc12 Amb35738262 [0,1,0,0,0,0|1,0,1]=3 391 B15R2.1255 C[C@@H](N)C(O)c1coc2ccccc12 Amb30024403 [0,1,0,0,0,0|1,0,0]=2 392 B15R2.1255 C[C@@H]([C@@H](C)O)n1cnc2ccccc21 Amb27594752 [0,1,0,0,0,0|2,0,1]=4 393 B15R2.1255 C[C@H](N)C(=O)c1coc2ccccc12 Amb30024796 [0,1,0,0,0,0|1,0,1]=3 394 B15R2.1255 C[C@H](N)C(O)c1coc2ccccc12 Amb35617917 [0,1,0,0,0,0|1,0,0]=2 395 B15R2.1255 C[C@H](O)[C@@H](N)c1csc2ccccc12 Amb28241092 [0,1,0,0,0,0|2,0,0]=3 396 B15R2.1255 NC(=O)C(Cl)c1csc2ccccc12 Amb27795422 [0,1,0,0,0,0|2,0,1]=4 397 B15R2.1255 NC(=O)C(O)c1csc2ccccc12 Amb27759799 [0,1,0,0,0,0|2,0,1]=4 398 B15R2.1255 NC(c1coc2ccccc12)C(F)F Amb35686385 [0,1,0,0,0,0|3,0,0]=4 399 B15R2.1255 NC(c1csc2ccccc12)C(F)F Amb7808652 [0,1,0,0,0,0|3,0,0]=4 400 B15R2.1255 N[C@H](c1csc2ccccc12)C(F)F Amb27273452 [0,1,0,0,0,0|3,0,0]=4 401 B15R2.1255 OC(c1coc2ccccc12)C(F)F Amb27418328 [0,1,0,0,0,0|3,0,0]=4 402 B15R2.1255 OC(c1csc2ccccc12)C(F)F Amb25733682 [0,1,0,0,0,0|3,0,0]=4 403 B15R2.9410 CC(=O)Cc1csc2ccc(Br)cc12 Amb27191808 [0,1,0,0,0,0|2,0,1]=4 404 B15R2.9410 CC(=O)Cc1csc2ccc(C)cc12 Amb27193515 [0,1,0,0,0,0|2,0,1]=4 405 B15R2.9410 CC(C)Cc1csc2ccc(Cl)cc12 Amb27804256 [0,1,0,0,0,0|2,0,0]=3 406 B15R2.9410 CC(C)Cc1noc2ccc(N)cc12 Amb24507119 [0,1,0,0,0,0|3,0,0]=4 407 B15R2.9410 CC(C)Cn1ccc2ccc(N)cc21 Amb8941053 [0,1,0,0,0,0|3,0,0]=4 408 B15R2.9410 CC(C)Cn1cnc2ccc(Br)cc21 Amb26358312 [0,1,0,0,0,0|2,0,1]=4 409 B15R2.9410 CC(C)Cn1cnc2ccc(Cl)cc21 Amb30636845 [0,1,0,0,0,0|2,0,1]=4 410 B15R2.9410 CC(C)Cn1cnc2ccc(N)cc21 Amb23114112 [0,1,0,0,0,0|2,0,1]=4 411 B15R2.9410 CC(N)Cc1csc2ccc(Br)cc12 Amb27964319 [0,1,0,0,0,0|1,0,0]=2 412 B15R2.9410 CC(N)Cc1nnc2ccc(Cl)cn12 Amb29879903 [0,1,0,0,0,0|2,0,1]=4 413 B15R2.9410 CC(N)Cn1ccc2ccc(F)cc21 Amb27387014 [0,1,0,0,0,0|2,0,0]=3 414 B15R2.9410 CC(N)Cn1ncc2ccc(I)cc21 Amb27968145 [0,1,0,0,0,0|3,0,0]=4 415 B15R2.9410 CC(O)Cn1ccc2ccc(N)cc21 Amb25814987 [0,1,0,0,0,0|3,0,0]=4 416 B15R2.9410 C[C@@H](N)Cn1ncc2ccc(O)cc21 Amb27814386 [0,1,0,0,0,0|3,0,0]=4 417 B15R2.9410 C[C@H](N)CN1CCc2ccc(Br)cc21 Amb26897659 [0,1,0,0,0,0|2,0,1]=4 418 B15R2.9410 C[C@H](N)Cn1ccc2ccc(O)cc21 Amb28318730 [0,1,0,0,0,0|2,0,0]=3 419 B15R2.9410 Cc1ccc2ccn(CC(C)O)c2c1 Amb27857652 [0,1,0,0,0,0|3,0,0]=4 420 B15R2.9410 Cc1ccc2occ(CC(N)=O)c2c1 Amb2968953 [0,1,0,0,0,0|2,0,1]=4 421 B15R2.9410 Cc1ccc2scc(CC(N)=O)c2c1 Amb28072151 [0,1,0,0,0,0|2,0,1]=4 422 B15R2.9410 N=C(N)Cc1csc2ccc(Cl)cc12 Amb28255641 [0,1,0,0,0,0|2,0,1]=4 423 B15R2.9410 NC(=O)CC1=CCc2ccc(F)cc21 Amb27955114 [0,1,0,0,0,0|2,0,1]=4 424 B15R2.9410 NC(=O)Cc1csc2ccc(Cl)cc12 Amb27613156 [0,1,0,0,0,0|2,0,1]=4 425 B15R2.13587 CC(C)CC1CNc2c(F)cccc21 Amb27982375 [0,1,0,0,0,0|1,0,2]=4 426 B15R2.13587 CC(C)Cn1ccc2c(Br)cccc21 Amb25184082 [0,1,0,0,0,0|3,0,0]=4 427 B15R2.13587 CC(C)Cn1ccc2c(Cl)cccc21 Amb27183090 [0,1,0,0,0,0|3,0,0]=4 428 B15R2.13587 CC(C)Cn1ccc2c(N)cccc21 Amb19134322 [0,1,0,0,0,0|3,0,0]=4 429 B15R2.13587 CC(C)Cn1ccc2c(N)cccc21 Amb22723460 [0,1,0,0,0,0|3,0,0]=4 430 B15R2.13587 CC(N)Cc1nnc2c(Cl)cccn12 Amb29879856 [0,1,0,0,0,0|2,0,1]=4 431 B15R2.13587 CC(N)Cc1noc2c(F)cccc12 Amb28251411 [0,1,0,0,0,0|2,0,0]=3 432 B15R2.13587 CC(N)Cn1ccc2c(F)cccc21 Amb27772286 [0,1,0,0,0,0|2,0,0]=3 433 B15R2.13587 CC(O)Cn1ccc2c(N)cccc21 Amb28190951 [0,1,0,0,0,0|3,0,0]=4 434 B15R2.13587 Cc1cccc2c1NCC2CC(C)C Amb27836353 [0,1,0,0,0,0|1,0,2]=4 435 B15R2.13587 Cc1cccc2c1ccn2CC(C)N Amb27386766 [0,1,0,0,0,0|2,0,0]=3 436 B15R2.13624 CC(C)Cn1ccc2cccc(Cl)c21 Amb28197697 [0,1,0,0,0,0|3,0,0]=4 437 B15R2.13624 CC(C)Cn1ccc2cccc(N)c21 Amb27402769 [0,1,0,0,0,0|3,0,0]=4 438 B15R2.13624 CC(C)Cn1cnc2cccc(Br)c21 Amb32708828 [0,1,0,0,0,0|2,0,1]=4 439 B15R2.13624 CC(N)Cc1ncc2cccc(F)n12 Amb28368689 [0,1,0,0,0,0|3,0,0]=4 440 B15R2.13624 CC(O)Cn1ccc2cccc(N)c21 Amb26942285 [0,1,0,0,0,0|3,0,0]=4 441 B15R2.13624 Cc1cccc2c1N(CC(C)N)CC2 Amb27394699 [0,1,0,0,0,0|2,0,1]=4 442 B15R2.53147 CC(=O)Cc1cn(C)c2ccccc12 Amb18893746 [0,1,0,0,0,0|1,0,1]=3 443 B15R2.53147 CC(=O)Cc1cn(C)c2ncccc12 Amb32881134 [0,1,0,0,0,0|2,0,1]=4 444 B15R2.53147 CC(=O)Cc1nn(C)c2ccccc12 Amb24459698 [0,1,0,0,0,0|2,0,1]=4 445 B15R2.53147 CC(=O)Oc1cn(C)c2ccccc12 Amb6317764 [0,1,0,0,0,0|2,0,1]=4 446 B15R2.53147 CC(Br)Cc1cn(C)c2ccccc12 Amb33431897 [0,1,0,0,0,0|1,0,0]=2 447 B15R2.53147 CC(Br)Cc1cn(C)c2ncccc12 Amb33432205 [0,1,0,0,0,0|2,0,0]=3 448 B15R2.53147 CC(Br)Cc1nn(C)c2ccccc12 Amb33336635 [0,1,0,0,0,0|2,0,0]=3 449 B15R2.53147 CC(C)Nc1cn(C)c2ccccc12 Amb26346628 [0,1,0,0,0,0|2,0,0]=3 450 B15R2.53147 CC(C)Oc1nn(C)c2ccccc12 Amb23560580 [0,1,0,0,0,0|3,0,0]=4 451 B15R2.53147 CC(N)CN1CC(C)c2ccccc21 Amb27852135 [0,1,0,0,0,0|2,0,1]=4 452 B15R2.53147 CC(N)Cc1cn(C)c2ccccc12 Amb18562305 [0,1,0,0,0,0|0,0,0]=1 453 B15R2.53147 CC(N)Cc1cn(C)c2ccccc12 Amb33330398 [0,1,0,0,0,0|0,0,0]=1 454 B15R2.53147 CC(N)Cc1cn(C)c2ncccc12 Amb27267784 [0,1,0,0,0,0|1,0,0]=2 455 B15R2.53147 CC(O)Cc1cn(C)c2ccccc12 Amb24345901 [0,1,0,0,0,0|1,0,0]=2 456 B15R2.53147 CC(O)Cc1cn(C)c2ncccc12 Amb32880444 [0,1,0,0,0,0|2,0,0]=3 457 B15R2.53147 CC(O)Cc1nn(C)c2ccccc12 Amb24644322 [0,1,0,0,0,0|2,0,0]=3 458 B15R2.53147 CC1CN(C[C@@H](C)N)c2ccccc21 Amb28344028 [0,1,0,0,0,0|2,0,1]=4 459 B15R2.53147 CN(C)Cc1cn(C)c2ccccc12 Amb25672584 [0,1,0,0,0,0|2,0,0]=3 460 B15R2.53147 CN(C)Cc1cn(C)c2ncccc12 Amb24500014 [0,1,0,0,0,0|3,0,0]=4 461 B15R2.53147 CN(O)Cc1cn(C)c2ccccc12 Amb33319793 [0,1,0,0,0,0|2,0,0]=3 462 B15R2.53147 CN(O)Cc1cn(C)c2ncccc12 Amb32881118 [0,1,0,0,0,0|3,0,0]=4 463 B15R2.53147 CN(O)Cc1nn(C)c2ccccc12 Amb33197030 [0,1,0,0,0,0|3,0,0]=4 464 B15R2.53147 C[C@@H](N)Cc1cn(C)c2ccccc12 Amb28341022 [0,1,0,0,0,0|0,0,0]=1 465 B15R2.53147 C[C@@H](N)Cc1cn(C)c2ncccc12 Amb32880050 [0,1,0,0,0,0|1,0,0]=2 466 B15R2.53147 C[C@@H](N)Cc1nn(C)c2ccccc12 Amb33197217 [0,1,0,0,0,0|1,0,0]=2 467 B15R2.53147 C[C@@H](O)Cc1cn(C)c2ccccc12 Amb33319515 [0,1,0,0,0,0|1,0,0]=2 468 B15R2.53147 C[C@@H](O)Cc1cn(C)c2ncccc12 Amb33224595 [0,1,0,0,0,0|2,0,0]=3 469 B15R2.53147 C[C@@H](O)Cc1nn(C)c2ccccc12 Amb33197215 [0,1,0,0,0,0|2,0,0]=3 470 B15R2.53147 C[C@H](N)Cc1cn(C)c2ccccc12 Amb26657805 [0,1,0,0,0,0|0,0,0]=1 471 B15R2.53147 C[C@H](N)Cc1cn(C)c2ncccc12 Amb32879799 [0,1,0,0,0,0|1,0,0]=2 472 B15R2.53147 C[C@H](N)Cc1nn(C)c2ccccc12 Amb33198504 [0,1,0,0,0,0|1,0,0]=2 473 B15R2.53147 C[C@H](O)Cc1cn(C)c2ccccc12 Amb33319516 [0,1,0,0,0,0|1,0,0]=2 474 B15R2.53147 C[C@H](O)Cc1cn(C)c2ncccc12 Amb32879798 [0,1,0,0,0,0|2,0,0]=3 475 B15R2.53147 C[C@H](O)Cc1nn(C)c2ccccc12 Amb33197216 [0,1,0,0,0,0|2,0,0]=3 476 B15R2.53147 Cc1nc(CC(C)N)c2ccccn12 Amb17060889 [0,1,0,0,0,0|3,0,0]=4 477 B15R2.53147 Cn1cc(CC(=N)N)c2ccccc21 Amb33319451 [0,1,0,0,0,0|1,0,1]=3 478 B15R2.53147 Cn1cc(CC(=N)N)c2cccnc21 Amb32879611 [0,1,0,0,0,0|2,0,1]=4 479 B15R2.53147 Cn1cc(CC(=O)Cl)c2ccccc21 Amb27241123 [0,1,0,0,0,0|2,0,1]=4 480 B15R2.53147 Cn1cc(CC(=O)O)c2ccccc21 Amb2434788 [0,1,0,0,0,0|2,0,1]=4 481 B15R2.53147 Cn1cc(CC(N)=O)c2ccccc21 Amb8395718 [0,1,0,0,0,0|1,0,1]=3 482 B15R2.53147 Cn1cc(CC(N)=S)c2ccccc21 Amb33319450 [0,1,0,0,0,0|1,0,1]=3 483 B15R2.53147 Cn1cc(CC(N)=S)c2cccnc21 Amb32878642 [0,1,0,0,0,0|2,0,1]=4 484 B15R2.53147 Cn1cc(C[N+](=O)[O-])c2ccccc21 Amb33319504 [0,1,0,0,0,0|3,0,0]=4 485 B15R2.53147 Cn1cc(NC(N)=O)c2ccccc21 Amb25114478 [0,1,0,0,0,0|2,0,1]=4 486 B15R2.53147 Cn1cc(SC(=N)N)c2ccccc21 Amb18024001 [0,1,0,0,0,0|2,0,1]=4 487 B15R2.53147 Cn1cc(SC(=N)N)c2ccccc21 Amb3318813 [0,1,0,0,0,0|2,0,1]=4 488 B15R2.53147 Cn1nc(CC(=N)N)c2ccccc21 Amb27947932 [0,1,0,0,0,0|2,0,1]=4 489 B15R2.53147 Cn1nc(CC(N)=O)c2ccccc21 Amb27670008 [0,1,0,0,0,0|2,0,1]=4 490 B15R2.53147 Cn1nc(CC(N)=S)c2ccccc21 Amb25122193 [0,1,0,0,0,0|2,0,1]=4 491 B15R2.53147 O=C(O)Cc1cn(O)c2ccccc12 Amb18818906 [0,1,0,0,0,0|2,0,1]=4 492 B13R1.90 C#Cc1ccccc1CCC(C)N Amb33203590 [0,0,1,0,0,0|1,0,2]=4 493 B13R1.90 C#Cc1ccccc1CC[C@@H](C)N Amb33203585 [0,0,1,0,0,0|1,0,2]=4 494 B13R1.90 C#Cc1ccccc1CC[C@H](C)N Amb33203584 [0,0,1,0,0,0|1,0,2]=4 495 B13R1.90 C#Cc1ccccc1\C=C\C(C)N Amb33373868 [0,0,1,0,0,0|1,0,2]=4 496 B13R1.90 CC(N)CCc1ccccc1C#N Amb26375283 [0,0,1,0,0,0|2,0,1]=4 497 B13R1.90 CC(N)CNc1ccccc1C#N Amb25859392 [0,0,1,0,0,0|3,0,0]=4 498 B13R1.90 CC(N)\C=C\c1ccccc1C#N Amb33449947 [0,0,1,0,0,0|2,0,1]=4 499 B13R1.90 CCc1ccccc1CCC(C)N Amb33474276 [0,0,1,0,0,0|1,0,2]=4 500 B13R1.90 CCc1ccccc1CC[C@@H](C)N Amb33449220 [0,0,1,0,0,0|1,0,2]=4 501 B13R1.90 CCc1ccccc1CC[C@H](C)N Amb32954758 [0,0,1,0,0,0|1,0,2]=4 502 B13R1.90 CCc1ccccc1OCC(C)N Amb8867407 [0,0,1,0,0,0|2,0,1]=4 503 B13R1.90 CCc1ccccc1OC[C@@H](C)N Amb18035943 [0,0,1,0,0,0|2,0,1]=4 504 B13R1.90 CCc1ccccc1\C=C\C(C)N Amb33079617 [0,0,1,0,0,0|1,0,2]=4 505 B13R1.90 CNc1ccccc1OCC(C)C Amb18316375 [0,0,1,0,0,0|2,0,1]=4 506 B13R1.90 COc1ccccc1CCC(C)N Amb17507289 [0,0,1,0,0,0|1,0,2]=4 507 B13R1.90 COc1ccccc1CC[C@@H](C)N Amb33359274 [0,0,1,0,0,0|1,0,2]=4 508 B13R1.90 COc1ccccc1CC[C@H](C)N Amb33359070 [0,0,1,0,0,0|1,0,2]=4 509 B13R1.90 COc1ccccc1OCC(C)N Amb10609793 [0,0,1,0,0,0|2,0,1]=4 510 B13R1.90 COc1ccccc1OCC(C)N Amb9756360 [0,0,1,0,0,0|2,0,1]=4 511 B13R1.90 COc1ccccc1OC[C@@H](C)N Amb18035955 [0,0,1,0,0,0|2,0,1]=4 512 B13R1.90 COc1ccccc1\C=C\C(C)N Amb33450168 [0,0,1,0,0,0|1,0,2]=4 513 B13R1.90 CSc1ccccc1CCC(C)N Amb33223792 [0,0,1,0,0,0|1,0,2]=4 514 B13R1.90 CSc1ccccc1CC[C@@H](C)N Amb33449930 [0,0,1,0,0,0|1,0,2]=4 515 B13R1.90 CSc1ccccc1CC[C@H](C)N Amb33358733 [0,0,1,0,0,0|1,0,2]=4 516 B13R1.90 CSc1ccccc1\C=C\C(C)N Amb32876713 [0,0,1,0,0,0|1,0,2]=4 517 B13R1.90 C[C@@H](N)CCc1ccccc1C#N Amb27817737 [0,0,1,0,0,0|2,0,1]=4 518 B13R1.90 C[C@@H](N)COc1ccccc1C#N Amb35714362 [0,0,1,0,0,0|3,0,0]=4 519 B13R1.90 C[C@H](N)CCc1ccccc1C#N Amb27196185 [0,0,1,0,0,0|2,0,1]=4 520 B13R1.90 C[C@H](N)COc1ccccc1C#N Amb35714361 [0,0,1,0,0,0|3,0,0]=4 521 B13R1.201 C=C(SC(C)C)c1ccccc1N Amb27179273 [0,0,1,0,0,0|2,0,0]=3 522 B13R1.201 CC(C)CC(=O)c1ccccc1Br Amb17348647 [0,0,1,0,0,0|3,0,0]=4 523 B13R1.201 CC(C)CC(=O)c1ccccc1Cl Amb17198753 [0,0,1,0,0,0|3,0,0]=4 524 B13R1.201 CC(C)CC(=O)c1ccccc1F Amb17198742 [0,0,1,0,0,0|3,0,0]=4 525 B13R1.201 CC(C)CC(=O)c1ccccc1I Amb27397914 [0,0,1,0,0,0|3,0,0]=4 526 B13R1.201 CC(C)CC(=O)c1ccccc1O Amb17233429 [0,0,1,0,0,0|3,0,0]=4 527 B13R1.201 CC(C)CC(=O)c1ncccc1N Amb27866593 [0,0,1,0,0,0|3,0,0]=4 528 B13R1.201 CC(C)CC(C)c1ccccc1N Amb27152226 [0,0,1,0,0,0|1,0,2]=4 529 B13R1.201 CC(C)CC(N)c1ccccc1N Amb17608154 [0,0,1,0,0,0|2,0,1]=4 530 B13R1.201 CC(C)CS(=O)c1ccccc1N Amb18987643 [0,0,1,0,0,0|3,0,0]=4 531 B13R1.201 CC(C)NC(=O)c1ccccc1N Amb6315940 [0,0,1,0,0,0|3,0,0]=4 532 B13R1.201 CC(C)OC(=O)c1ccccc1N Amb2688998 [0,0,1,0,0,0|3,0,0]=4 533 B13R1.201 CC(N)CC(=O)c1ccncc1F Amb27831752 [0,0,1,0,0,0|3,0,0]=4 534 B13R1.201 CC(N)CC(C)c1cccnc1N Amb28318830 [0,0,1,0,0,0|1,0,2]=4 535 B13R1.201 CC(N)CC(C)c1cnccc1N Amb27606098 [0,0,1,0,0,0|1,0,2]=4 536 B13R1.201 CC(N)CC(O)c1ccccc1Br Amb28122640 [0,0,1,0,0,0|2,0,1]=4 537 B13R1.201 CC(N)CC(O)c1ccccc1Cl Amb27609230 [0,0,1,0,0,0|2,0,1]=4 538 B13R1.201 CC(N)CC(O)c1cccnc1N Amb35583751 [0,0,1,0,0,0|2,0,1]=4 539 B13R1.201 CC(N)CC(O)c1cnccc1N Amb35583750 [0,0,1,0,0,0|2,0,1]=4 540 B13R1.201 CC(N)CN(C)c1ccccc1Br Amb26907335 [0,0,1,0,0,0|2,0,1]=4 541 B13R1.201 CC(N)CN(C)c1ccccc1Cl Amb17059703 [0,0,1,0,0,0|2,0,1]=4 542 B13R1.201 CC(N)CN(C)c1ccccc1F Amb17059700 [0,0,1,0,0,0|2,0,1]=4 543 B13R1.201 CC(O)CC(=O)c1ccccc1O Amb28144189 [0,0,1,0,0,0|3,0,0]=4 544 B13R1.201 CN(C)CC(=O)c1ccccc1N Amb27954261 [0,0,1,0,0,0|3,0,0]=4 545 B13R1.201 C[C@@H](N)CN(C)c1ccccc1F Amb27772489 [0,0,1,0,0,0|2,0,1]=4 546 B13R1.201 C[C@H](N)CN(C)c1ccccc1F Amb27411667 [0,0,1,0,0,0|2,0,1]=4 547 B13R1.201 Cc1ccccc1C(=O)CC(C)C Amb17198736 [0,0,1,0,0,0|3,0,0]=4 548 B13R1.201 Cc1ccccc1C(=O)CC(C)N Amb28350743 [0,0,1,0,0,0|2,0,0]=3 549 B13R1.201 Cc1ccccc1C(O)CC(C)N Amb28201410 [0,0,1,0,0,0|2,0,1]=4 550 B13R1.201 Cc1ccccc1N(C)CC(C)N Amb17059697 [0,0,1,0,0,0|2,0,1]=4 551 B13R1.201 Cc1ccncc1C(=O)CC(C)N Amb27253799 [0,0,1,0,0,0|3,0,0]=4 552 B13R1.337 CC(C)\C=C\CNc1ccccc1 Amb26397215 [0,0,1,0,0,0|1,0,2]=4 553 B13R1.337 CC(N)CCOCc1ccccc1 Amb18180974 [0,0,1,0,0,0|2,0,1]=4 554 B13R1.337 CC(N)CC\C=C\c1ccccc1 Amb32954844 [0,0,1,0,0,0|1,0,1]=3 555 B13R1.337 CC(N)\C=C\C=C\c1ccccc1 Amb27986103 [0,0,1,0,0,0|1,0,1]=3 556 B13R1.337 CC(N)\C=C\CCc1ccccc1 Amb33082113 [0,0,1,0,0,0|1,0,2]=4 557 B13R1.337 CC(O)CC\C=C\c1ccccc1 Amb18808901 [0,0,1,0,0,0|2,0,1]=4 558 B13R1.337 C[C@@H](N)CC\C=C\c1ccccc1 Amb33080794 [0,0,1,0,0,0|1,0,1]=3 559 B13R1.337 C[C@@H](O)CC\C=C\c1ccccc1 Amb33080791 [0,0,1,0,0,0|2,0,1]=4 560 B13R1.337 C[C@H](N)CC\C=C\c1ccccc1 Amb33080760 [0,0,1,0,0,0|1,0,1]=3 561 B13R1.337 C[C@H](O)CC\C=C\c1ccccc1 Amb33081535 [0,0,1,0,0,0|2,0,1]=4 562 B13R1.713 CC(C)CC(C=O)c1ccccc1 Amb33362241 [0,0,1,0,0,0|2,0,1]=4 563 B13R1.713 CC(C)CC(CN)c1ccccc1 Amb8950167 [0,0,1,0,0,0|1,0,2]=4 564 B13R1.713 CC(C)\C=C(/C=O)c1ccccc1 Amb21618696 [0,0,1,0,0,0|2,0,1]=4 565 B13R1.713 CC(N)CC(C#N)c1ccccc1 Amb18825228 [0,0,1,0,0,0|0,0,3]=4 566 B13R1.713 CC(O)CC(CN)c1ccccc1 Amb20668981 [0,0,1,0,0,0|1,0,2]=4 567 B13R1.713 CC(O)C\C(=N\O)c1ccccc1 Amb27753088 [0,0,1,0,0,0|3,0,0]=4 568 B13R1.713 CCN(CC(C)N)c1ccccc1 Amb1136881 [0,0,1,0,0,0|2,0,1]=4 569 B13R1.713 C\C=C(\CC(C)N)c1ccccc1 Amb27607649 [0,0,1,0,0,0|1,0,0]=2 570 B15R3.520 OC1CC2(C=Cc3ccccc32)C1 Amb27593935 [0,0,0,1,0,0|2,0,1]=4 571 B15R3.1681 NC1CC1C2CCc3ccccc32 Amb33146091 [0,0,0,1,0,0|1,0,2]=4 572 B15R3.1681 NC1CC1c2cnc3ccccn23 Amb25178692 [0,0,0,1,0,0|1,0,1]=3 573 B15R3.1681 NC1CC1c2cnc3cnccn23 Amb32724512 [0,0,0,1,0,0|2,0,1]=4 574 B15R3.1681 NC1CC1c2cnn3ccccc23 Amb33147954 [0,0,0,1,0,0|1,0,1]=3 575 B15R3.1681 NC1CC1c2csc3ccccc23 Amb19072479 [0,0,0,1,0,0|1,0,0]=2 576 B15R3.1681 N[C@@H]1C[C@H]1C2CCc3ccccc32 Amb33146092 [0,0,0,1,0,0|1,0,2]=4 577 B15R3.1681 N[C@@H]1C[C@H]1c2cnc3ccccn23 Amb33274410 [0,0,0,1,0,0|1,0,1]=3 578 B15R3.1681 N[C@@H]1C[C@H]1c2cnc3cnccn23 Amb32724513 [0,0,0,1,0,0|2,0,1]=4 579 B15R3.1681 N[C@@H]1C[C@H]1c2cnn3ccccc23 Amb33147955 [0,0,0,1,0,0|1,0,1]=3 580 B15R3.1681 N[C@@H]1C[C@H]1c2csc3ccccc23 Amb26967065 [0,0,0,1,0,0|1,0,0]=2 581 B15R3.1737 c1ccc2c(CC3CO3)coc2c1 Amb35704187 [0,0,0,1,0,0|2,0,0]=3 582 B15R3.1737 c1ccc2c(CC3CO3)csc2c1 Amb33195504 [0,0,0,1,0,0|2,0,0]=3 583 B15R3.1737 c1ccc2c(NC3CC3)coc2c1 Amb26040184 [0,0,0,1,0,0|3,0,0]=4 584 B15R3.1737 c1ccc2c(NC3CC3)csc2c1 Amb25225950 [0,0,0,1,0,0|3,0,0]=4 585 B15R3.1737 c1ccc2c(c1)ncn2C[C@@H]3CO3 Amb27805777 [0,0,0,1,0,0|2,0,1]=4 586 B15R3.1737 c1ccn2c(CC3CO3)cnc2c1 Amb33274038 [0,0,0,1,0,0|2,0,1]=4 587 B15R3.1737 c1ccn2ncc(CC3CO3)c2c1 Amb33147817 [0,0,0,1,0,0|2,0,1]=4 588 B15R3.2009 CC1Cn2c(nc3ccccc32)O1 Amb27226007 [0,0,0,1,0,0|2,0,1]=4 589 B15R3.2009 CC1Cn2c(nc3ccccc32)S1 Amb31293834 [0,0,0,1,0,0|2,0,1]=4 590 B15R3.2009 NC1CC2c3ccccc3CN2C1 Amb18197528 [0,0,0,1,0,0|2,0,1]=4 591 B15R3.2009 NC1Cc2cc3ccccc3n2C1 Amb27646907 [0,0,0,1,0,0|2,0,0]=3 592 B15R3.2009 NC1Cc2nc3ccccc3n2C1 Amb27428983 [0,0,0,1,0,0|1,0,1]=3 593 B15R3.2025 N[C@H]1C[C@@H]2C[C@H](C1)c3ccccc32 Amb27790946 [0,0,0,1,0,0|1,0,2]=4 594 B15R3.14764 NC1Cc2cccc3c2C(CC3)C1 Amb27878693 [0,0,0,1,0,0|1,0,2]=4 595 B15R3.14764 NC1Cc2cccc3c2C(CO3)C1 Amb27481835 [0,0,0,1,0,0|1,0,2]=4 596 B13R2.72 C=C(C)c1csc2ccccc12 Amb27669983 [0,0,0,0,1,0|2,0,1]=4 597 B13R2.72 CC(=N)c1csc2ccccc12 Amb28323588 [0,0,0,0,1,0|1,0,2]=4 598 B13R2.72 CC(=O)c1coc2ccccc12 Amb19887568 [0,0,0,0,1,0|2,0,1]=4 599 B13R2.72 CC(=O)c1csc2ccccc12 Amb33528908 [0,0,0,0,1,0|2,0,1]=4 600 B13R2.72 CC(Br)c1csc2ccccc12 Amb28140303 [0,0,0,0,1,0|2,0,0]=3 601 B13R2.72 CC(C)=C1ONc2ccccc21 Amb27209784 [0,0,0,0,1,0|2,0,1]=4 602 B13R2.72 CC(C)C1CNc2ccccc21 Amb18063410 [0,0,0,0,1,0|1,0,2]=4 603 B13R2.72 CC(C)c1onc2ccccc12 Amb27666336 [0,0,0,0,1,0|2,0,1]=4 604 B13R2.72 CC(C)n1ccc2ccccc21 Amb19515839 [0,0,0,0,1,0|3,0,0]=4 605 B13R2.72 CC(Cl)C1C=Cc2ccccc21 Amb27777224 [0,0,0,0,1,0|2,0,1]=4 606 B13R2.72 CC(Cl)c1cnc2ccccn12 Amb17115501 [0,0,0,0,1,0|2,0,1]=4 607 B13R2.72 CC(Cl)c1coc2ccccc12 Amb35704189 [0,0,0,0,1,0|2,0,0]=3 608 B13R2.72 CC(Cl)c1csc2ccccc12 Amb19053947 [0,0,0,0,1,0|2,0,0]=3 609 B13R2.72 CC(N)C1CCc2ccccc21 Amb27810846 [0,0,0,0,1,0|1,0,2]=4 610 B13R2.72 CC(N)C1COc2ccccc21 Amb22157282 [0,0,0,0,1,0|1,0,2]=4 611 B13R2.72 CC(N)C1CSc2ccccc21 Amb27216571 [0,0,0,0,1,0|1,0,2]=4 612 B13R2.72 CC(N)C1OCc2ccccc21 Amb33745574 [0,0,0,0,1,0|2,0,1]=4 613 B13R2.72 CC(N)c1cnc2ccccn12 Amb17112793 [0,0,0,0,1,0|1,0,1]=3 614 B13R2.72 CC(N)c1cnc2ccccn12 Amb22886494 [0,0,0,0,1,0|1,0,1]=3 615 B13R2.72 CC(N)c1cnc2cnccn12 Amb18829630 [0,0,0,0,1,0|2,0,1]=4 616 B13R2.72 CC(N)c1cnn2ccccc12 Amb25121822 [0,0,0,0,1,0|1,0,1]=3 617 B13R2.72 CC(N)c1cnn2ccncc12 Amb27760939 [0,0,0,0,1,0|2,0,1]=4 618 B13R2.72 CC(N)c1coc2ccccc12 Amb18829962 [0,0,0,0,1,0|1,0,0]=2 619 B13R2.72 CC(N)c1csc2ccccc12 Amb33097419 [0,0,0,0,1,0|1,0,0]=2 620 B13R2.72 CC(N)c1csc2ccccc12 Amb9212784 [0,0,0,0,1,0|1,0,0]=2 621 B13R2.72 CC(N)c1ncc2ccccn12 Amb17060785 [0,0,0,0,1,0|3,0,0]=4 622 B13R2.72 CC(N)c1ncn2ccccc12 Amb27638877 [0,0,0,0,1,0|3,0,0]=4 623 B13R2.72 CC(N)c1nnc2ccccn12 Amb2357873 [0,0,0,0,1,0|2,0,1]=4 624 B13R2.72 CC(N)c1nnc2ccccn12 Amb31291635 [0,0,0,0,1,0|2,0,1]=4 625 B13R2.72 CC(N)c1nnc2ccccn12 Amb9729354 [0,0,0,0,1,0|2,0,1]=4 626 B13R2.72 CC(O)C1=CCc2ccccc21 Amb28244189 [0,0,0,0,1,0|2,0,0]=3 627 B13R2.72 CC(O)C1C=Cc2ccccc21 Amb27478522 [0,0,0,0,1,0|2,0,1]=4 628 B13R2.72 CC(O)c1cnc2ccccn12 Amb17115478 [0,0,0,0,1,0|2,0,1]=4 629 B13R2.72 CC(O)c1coc2ccccc12 Amb24061891 [0,0,0,0,1,0|2,0,0]=3 630 B13R2.72 CC(O)c1csc2ccccc12 Amb18180840 [0,0,0,0,1,0|2,0,0]=3 631 B13R2.72 CC(O)c1occ2ccccc12 Amb25899169 [0,0,0,0,1,0|3,0,0]=4 632 B13R2.72 CN(C)c1csc2ccccc12 Amb23403656 [0,0,0,0,1,0|3,0,0]=4 633 B13R2.72 C[C@@H](N)C1CCc2ccccc21 Amb25259826 [0,0,0,0,1,0|1,0,2]=4 634 B13R2.72 C[C@@H](N)C1COc2ccccc21 Amb25824319 [0,0,0,0,1,0|1,0,2]=4 635 B13R2.72 C[C@@H](N)C1OCc2ccccc21 Amb33747720 [0,0,0,0,1,0|2,0,1]=4 636 B13R2.72 C[C@@H](N)c1cnc2ccccn12 Amb25238464 [0,0,0,0,1,0|1,0,1]=3 637 B13R2.72 C[C@@H](N)c1cnc2cnccn12 Amb32724530 [0,0,0,0,1,0|2,0,1]=4 638 B13R2.72 C[C@@H](N)c1cnn2ccccc12 Amb26423269 [0,0,0,0,1,0|1,0,1]=3 639 B13R2.72 C[C@@H](N)c1coc2ccccc12 Amb25871849 [0,0,0,0,1,0|1,0,0]=2 640 B13R2.72 C[C@@H](N)c1coc2ccccc12 Amb33331001 [0,0,0,0,1,0|1,0,0]=2 641 B13R2.72 C[C@@H](N)c1csc2ccccc12 Amb26326680 [0,0,0,0,1,0|1,0,0]=2 642 B13R2.72 C[C@@H](N)c1csc2ccccc12 Amb33189113 [0,0,0,0,1,0|1,0,0]=2 643 B13R2.72 C[C@@H](N)c1ncc2ccccn12 Amb28071218 [0,0,0,0,1,0|3,0,0]=4 644 B13R2.72 C[C@@H](N)c1nnc2ccccn12 Amb5759176 [0,0,0,0,1,0|2,0,1]=4 645 B13R2.72 C[C@@H](O)c1cnc2ccccn12 Amb33274525 [0,0,0,0,1,0|2,0,1]=4 646 B13R2.72 C[C@@H](O)c1cnn2ccccc12 Amb33147964 [0,0,0,0,1,0|2,0,1]=4 647 B13R2.72 C[C@@H](O)c1coc2ccccc12 Amb25675222 [0,0,0,0,1,0|2,0,0]=3 648 B13R2.72 C[C@@H](O)c1csc2ccccc12 Amb27247039 [0,0,0,0,1,0|2,0,0]=3 649 B13R2.72 C[C@H](N)C1CCc2ccccc21 Amb28072910 [0,0,0,0,1,0|1,0,2]=4 650 B13R2.72 C[C@H](N)C1COc2ccccc21 Amb24698420 [0,0,0,0,1,0|1,0,2]=4 651 B13R2.72 C[C@H](N)C1OCc2ccccc21 Amb33731424 [0,0,0,0,1,0|2,0,1]=4 652 B13R2.72 C[C@H](N)c1cnc2ccccn12 Amb24701387 [0,0,0,0,1,0|1,0,1]=3 653 B13R2.72 C[C@H](N)c1cnc2cnccn12 Amb32724529 [0,0,0,0,1,0|2,0,1]=4 654 B13R2.72 C[C@H](N)c1cnn2ccccc12 Amb25998879 [0,0,0,0,1,0|1,0,1]=3 655 B13R2.72 C[C@H](N)c1csc2ccccc12 Amb26019506 [0,0,0,0,1,0|1,0,0]=2 656 B13R2.72 C[C@H](N)c1csc2ccccc12 Amb33457455 [0,0,0,0,1,0|1,0,0]=2 657 B13R2.72 C[C@H](N)c1ncc2ccccn12 Amb27872393 [0,0,0,0,1,0|3,0,0]=4 658 B13R2.72 C[C@H](N)c1nnc2ccccn12 Amb2371357 [0,0,0,0,1,0|2,0,1]=4 659 B13R2.72 C[C@H](O)[C@@H]1C=Cc2ccccc21 Amb27880668 [0,0,0,0,1,0|2,0,1]=4 660 B13R2.72 C[C@H](O)c1cnc2ccccn12 Amb33274524 [0,0,0,0,1,0|2,0,1]=4 661 B13R2.72 C[C@H](O)c1cnn2ccccc12 Amb33148737 [0,0,0,0,1,0|2,0,1]=4 662 B13R2.72 C[C@H](O)c1coc2ccccc12 Amb27766105 [0,0,0,0,1,0|2,0,0]=3 663 B13R2.72 C[C@H](O)c1csc2ccccc12 Amb25132352 [0,0,0,0,1,0|2,0,0]=3 664 B13R2.72 FC(F)c1coc2ccccc12 Amb27774852 [0,0,0,0,1,0|3,0,0]=4 665 B13R2.72 N=C(N)c1csc2ccccc12 Amb17850833 [0,0,0,0,1,0|2,0,1]=4 666 B13R2.72 N=C(N)c1csc2ccccc12 Amb18184081 [0,0,0,0,1,0|2,0,1]=4 667 B13R2.72 N=C(N)c1csc2ccccc12 Amb2723186 [0,0,0,0,1,0|2,0,1]=4 668 B13R2.72 NC(=O)c1coc2ccccc12 Amb23401825 [0,0,0,0,1,0|2,0,1]=4 669 B13R2.72 NC(=O)c1csc2ccccc12 Amb18808969 [0,0,0,0,1,0|2,0,1]=4 670 B13R2.72 NC(=S)c1coc2ccccc12 Amb26346315 [0,0,0,0,1,0|2,0,1]=4 671 B13R2.72 NC(=S)c1csc2ccccc12 Amb2723185 [0,0,0,0,1,0|2,0,1]=4 672 B13R2.72 NC(N)=C1C=Nc2ccccc21 Amb27804019 [0,0,0,0,1,0|1,0,2]=4 673 B13R2.5881 O=C(O)CC1=Cc2ccccc21 Amb25148617 [0,0,0,0,1,0|2,0,1]=4 674 B15R2.6 C=C(C)CNc1csc2ccccc12 Amb28140449 [0,0,0,0,0,1|2,0,1]=4 675 B15R2.6 CC(=O)CCc1csc2ccccc12 Amb27146067 [0,0,0,0,0,1|2,0,1]=4 676 B15R2.6 CC(Br)CCc1coc2ccccc12 Amb35704104 [0,0,0,0,0,1|2,0,0]=3 677 B15R2.6 CC(C)CCn1cnc2ccccc21 Amb355762 [0,0,0,0,0,1|2,0,1]=4 678 B15R2.6 CC(C)CNc1noc2ccccc12 Amb28410138 [0,0,0,0,0,1|3,0,0]=4 679 B15R2.6 CC(C)CNc1nsc2ccccc12 Amb24347307 [0,0,0,0,0,1|3,0,0]=4 680 B15R2.6 CC(C)CNc1snc2ccccc12 Amb27595719 [0,0,0,0,0,1|2,0,1]=4 681 B15R2.6 CC(C)NCc1cnn2ccccc12 Amb27414112 [0,0,0,0,0,1|2,0,1]=4 682 B15R2.6 CC(C)NCc1coc2ccccc12 Amb19649833 [0,0,0,0,0,1|2,0,0]=3 683 B15R2.6 CC(C)NCc1csc2ccccc12 Amb19649474 [0,0,0,0,0,1|2,0,0]=3 684 B15R2.6 CC(C)OCn1cnc2ccccc21 Amb27479769 [0,0,0,0,0,1|2,0,1]=4 685 B15R2.6 CC(Cl)CNc1snc2ccccc12 Amb27947389 [0,0,0,0,0,1|2,0,1]=4 686 B15R2.6 CC(Cl)\C=C\c1csc2ccccc12 Amb27397189 [0,0,0,0,0,1|2,0,1]=4 687 B15R2.6 CC(N)C#Cc1coc2ccccc12 Amb30013997 [0,0,0,0,0,1|1,0,1]=3 688 B15R2.6 CC(N)CCC1CCc2ccccc21 Amb33145400 [0,0,0,0,0,1|1,0,2]=4 689 B15R2.6 CC(N)CCC1CNc2ccccc21 Amb32674597 [0,0,0,0,0,1|0,0,2]=3 690 B15R2.6 CC(N)CCN1CCc2ccccc21 Amb18979443 [0,0,0,0,0,1|2,0,1]=4 691 B15R2.6 CC(N)CCc1cnc2ccccn12 Amb33274052 [0,0,0,0,0,1|1,0,1]=3 692 B15R2.6 CC(N)CCc1cnc2cnccn12 Amb32724743 [0,0,0,0,0,1|2,0,1]=4 693 B15R2.6 CC(N)CCc1cnn2ccccc12 Amb33227126 [0,0,0,0,0,1|1,0,1]=3 694 B15R2.6 CC(N)CCc1csc2ccccc12 Amb26597936 [0,0,0,0,0,1|1,0,0]=2 695 B15R2.6 CC(N)CNc1noc2ccccc12 Amb27167355 [0,0,0,0,0,1|2,0,0]=3 696 B15R2.6 CC(N)CNc1nsc2ccccc12 Amb35718002 [0,0,0,0,0,1|2,0,0]=3 697 B15R2.6 CC(N)COc1snc2ccccc12 Amb35663568 [0,0,0,0,0,1|1,0,1]=3 698 B15R2.6 CC(N)\C=C\c1cnc2ccccn12 Amb33147738 [0,0,0,0,0,1|1,0,2]=4 699 B15R2.6 CC(N)\C=C\c1cnn2ccccc12 Amb33146819 [0,0,0,0,0,1|1,0,2]=4 700 B15R2.6 CC(N)\C=C\c1coc2ccccc12 Amb27629946 [0,0,0,0,0,1|1,0,1]=3 701 B15R2.6 CC(N)\C=C\c1csc2ccccc12 Amb33475313 [0,0,0,0,0,1|1,0,1]=3 702 B15R2.6 CC(O)CCc1cnc2ccccn12 Amb33473563 [0,0,0,0,0,1|2,0,1]=4 703 B15R2.6 CC(O)CCc1cnn2ccccc12 Amb33147787 [0,0,0,0,0,1|2,0,1]=4 704 B15R2.6 CC(O)CCc1csc2ccccc12 Amb24401820 [0,0,0,0,0,1|2,0,0]=3 705 B15R2.6 CC(O)CCn1ccc2ccccc21 Amb27189413 [0,0,0,0,0,1|3,0,0]=4 706 B15R2.6 CC(O)CCn1cnc2ccccc21 Amb19078264 [0,0,0,0,0,1|2,0,1]=4 707 B15R2.6 CC(O)CNc1csc2cccnc12 Amb27230297 [0,0,0,0,0,1|3,0,0]=4 708 B15R2.6 CC(O)CNc1snc2ccccc12 Amb27425599 [0,0,0,0,0,1|2,0,1]=4 709 B15R2.6 CN(C)CCc1csc2ccccc12 Amb27841437 [0,0,0,0,0,1|3,0,0]=4 710 B15R2.6 C[C@@H](N)CCC1CCc2ccccc21 Amb33145121 [0,0,0,0,0,1|1,0,2]=4 711 B15R2.6 C[C@@H](N)CCc1cnc2ccccn12 Amb33274051 [0,0,0,0,0,1|1,0,1]=3 712 B15R2.6 C[C@@H](N)CCc1cnc2cnccn12 Amb32724739 [0,0,0,0,0,1|2,0,1]=4 713 B15R2.6 C[C@@H](N)CCc1cnn2ccccc12 Amb33147514 [0,0,0,0,0,1|1,0,1]=3 714 B15R2.6 C[C@@H](N)CCc1csc2ccccc12 Amb33312709 [0,0,0,0,0,1|1,0,0]=2 715 B15R2.6 C[C@@H](O)CCc1cnc2ccccn12 Amb33274482 [0,0,0,0,0,1|2,0,1]=4 716 B15R2.6 C[C@@H](O)CCc1cnn2ccccc12 Amb33147500 [0,0,0,0,0,1|2,0,1]=4 717 B15R2.6 C[C@@H](O)CCc1csc2ccccc12 Amb33312710 [0,0,0,0,0,1|2,0,0]=3 718 B15R2.6 C[C@H](N)CCC1CCc2ccccc21 Amb33145120 [0,0,0,0,0,1|1,0,2]=4 719 B15R2.6 C[C@H](N)CCc1cnc2ccccn12 Amb33274050 [0,0,0,0,0,1|1,0,1]=3 720 B15R2.6 C[C@H](N)CCc1cnc2cnccn12 Amb32724738 [0,0,0,0,0,1|2,0,1]=4 721 B15R2.6 C[C@H](N)CCc1cnn2ccccc12 Amb33147513 [0,0,0,0,0,1|1,0,1]=3 722 B15R2.6 C[C@H](N)CCc1csc2ccccc12 Amb33312708 [0,0,0,0,0,1|1,0,0]=2 723 B15R2.6 C[C@H](O)CCc1cnc2ccccn12 Amb33274483 [0,0,0,0,0,1|2,0,1]=4 724 B15R2.6 C[C@H](O)CCc1cnn2ccccc12 Amb33147501 [0,0,0,0,0,1|2,0,1]=4 725 B15R2.6 C[C@H](O)CCc1csc2ccccc12 Amb33225760 [0,0,0,0,0,1|2,0,0]=3 726 B15R2.6 N=C(N)NCc1coc2ccccc12 Amb24671452 [0,0,0,0,0,1|2,0,1]=4 727 B15R2.6 N=C(N)NCc1csc2ccccc12 Amb26051196 [0,0,0,0,0,1|2,0,1]=4 728 B15R2.6 NC(=O)CCc1coc2ccccc12 Amb27847228 [0,0,0,0,0,1|2,0,1]=4 729 B15R2.6 NC(=O)OCc1coc2ccccc12 Amb27647621 [0,0,0,0,0,1|2,0,1]=4 730 B15R2.1668 C=C(C)Cc1cnc2ccccc2c1 Amb28067703 [0,0,0,0,0,1|1,0,2]=4 731 B15R2.1668 CC(=O)Cc1ccc2ccccc2c1 Amb6674796 [0,0,0,0,0,1|2,0,1]=4 732 B15R2.1668 CC(=O)Cc1ccc2ccccc2n1 Amb9205983 [0,0,0,0,0,1|2,0,1]=4 733 B15R2.1668 CC(=O)Cc1cnc2ccccc2c1 Amb25819490 [0,0,0,0,0,1|1,0,2]=4 734 B15R2.1668 CC(=O)Cc1cnc2ccccc2n1 Amb18822199 [0,0,0,0,0,1|1,0,2]=4 735 B15R2.1668 CC(Br)Cc1ccc2ccccc2c1 Amb27836098 [0,0,0,0,0,1|2,0,0]=3 736 B15R2.1668 CC(Br)Cc1ccc2ccccc2n1 Amb25731490 [0,0,0,0,0,1|2,0,0]=3 737 B15R2.1668 CC(Br)Cc1ccc2cccnc2c1 Amb33433336 [0,0,0,0,0,1|3,0,0]=4 738 B15R2.1668 CC(Br)Cc1ccc2ncccc2c1 Amb33435497 [0,0,0,0,0,1|3,0,0]=4 739 B15R2.1668 CC(Br)Cc1cnc2ccccc2c1 Amb33434153 [0,0,0,0,0,1|1,0,1]=3 740 B15R2.1668 CC(Br)Cc1cnc2ccccc2n1 Amb33242994 [0,0,0,0,0,1|1,0,1]=3 741 B15R2.1668 CC(C)CC1CNc2ccccc2C1 Amb27644361 [0,0,0,0,0,1|1,0,2]=4 742 B15R2.1668 CC(C)CC1CNc2ccccc2N1 Amb28396532 [0,0,0,0,0,1|1,0,2]=4 743 B15R2.1668 CC(C)Cc1ccc2ccccc2n1 Amb8629133 [0,0,0,0,0,1|2,0,0]=3 744 B15R2.1668 CC(C)Cc1ccc2ncccc2c1 Amb8629132 [0,0,0,0,0,1|3,0,0]=4 745 B15R2.1668 CC(C)Nc1cnc2ccccc2c1 Amb9556883 [0,0,0,0,0,1|2,0,1]=4 746 B15R2.1668 CC(C)Nc1cnc2ccccc2n1 Amb18285467 [0,0,0,0,0,1|2,0,1]=4 747 B15R2.1668 CC(C)Oc1ccc2ccccc2c1 Amb24358848 [0,0,0,0,0,1|3,0,0]=4 748 B15R2.1668 CC(C)Oc1ccc2ccccc2n1 Amb28206293 [0,0,0,0,0,1|3,0,0]=4 749 B15R2.1668 CC(C)Oc1cnc2ccccc2c1 Amb27657092 [0,0,0,0,0,1|2,0,1]=4 750 B15R2.1668 CC(C)Sc1ccc2ccccc2n1 Amb10665721 [0,0,0,0,0,1|3,0,0]=4 751 B15R2.1668 CC(N)CC1CCc2ccccc2C1 Amb27462376 [0,0,0,0,0,1|1,0,2]=4 752 B15R2.1668 CC(N)CN1CCc2ccccc2C1 Amb1126792 [0,0,0,0,0,1|2,0,1]=4 753 B15R2.1668 CC(N)Cc1cc2ccccc2cn1 Amb27964318 [0,0,0,0,0,1|2,0,0]=3 754 B15R2.1668 CC(N)Cc1cc2ccccc2nn1 Amb27968211 [0,0,0,0,0,1|1,0,1]=3 755 B15R2.1668 CC(N)Cc1ccc2ccccc2c1 Amb9716016 [0,0,0,0,0,1|1,0,0]=2 756 B15R2.1668 CC(N)Cc1ccc2ccccc2n1 Amb33550317 [0,0,0,0,0,1|1,0,0]=2 757 B15R2.1668 CC(N)Cc1ccc2ccccc2n1 Amb9206046 [0,0,0,0,0,1|1,0,0]=2 758 B15R2.1668 CC(N)Cc1ccc2cccnc2c1 Amb19105928 [0,0,0,0,0,1|2,0,0]=3 759 B15R2.1668 CC(N)Cc1ccc2ccncc2c1 Amb19105763 [0,0,0,0,0,1|2,0,0]=3 760 B15R2.1668 CC(N)Cc1ccc2cnccc2c1 Amb18353767 [0,0,0,0,0,1|2,0,0]=3 761 B15R2.1668 CC(N)Cc1ccc2ncccc2c1 Amb19105926 [0,0,0,0,0,1|2,0,0]=3 762 B15R2.1668 CC(N)Cc1ccc2nccnc2c1 Amb8011412 [0,0,0,0,0,1|3,0,0]=4 763 B15R2.1668 CC(N)Cc1cnc2ccccc2c1 Amb24377651 [0,0,0,0,0,1|0,0,1]=2 764 B15R2.1668 CC(N)Cc1cnc2ccccc2n1 Amb35686614 [0,0,0,0,0,1|0,0,1]=2 765 B15R2.1668 CC(O)Cc1ccc2ccccc2c1 Amb18319261 [0,0,0,0,0,1|2,0,0]=3 766 B15R2.1668 CC(O)Cc1ccc2ccccc2n1 Amb20623273 [0,0,0,0,0,1|2,0,0]=3 767 B15R2.1668 CC(O)Cc1ccc2cccnc2c1 Amb32879493 [0,0,0,0,0,1|3,0,0]=4 768 B15R2.1668 CC(O)Cc1ccc2ncccc2c1 Amb33143325 [0,0,0,0,0,1|3,0,0]=4 769 B15R2.1668 CC(O)Cc1cnc2ccccc2c1 Amb28048145 [0,0,0,0,0,1|1,0,1]=3 770 B15R2.1668 CC(O)Cc1cnc2ccccc2n1 Amb33448724 [0,0,0,0,0,1|1,0,1]=3 771 B15R2.1668 CN(C)Cc1ccc2ccccc2c1 Amb26522356 [0,0,0,0,0,1|3,0,0]=4 772 B15R2.1668 CN(C)Cc1ccc2ccccc2n1 Amb25672416 [0,0,0,0,0,1|3,0,0]=4 773 B15R2.1668 CN(C)Cc1cnc2ccccc2c1 Amb27848429 [0,0,0,0,0,1|2,0,1]=4 774 B15R2.1668 CN(C)Cc1cnc2ccccc2n1 Amb35670935 [0,0,0,0,0,1|2,0,1]=4 775 B15R2.1668 CN(O)Cc1ccc2ccccc2c1 Amb33362186 [0,0,0,0,0,1|3,0,0]=4 776 B15R2.1668 CN(O)Cc1ccc2ccccc2n1 Amb33201930 [0,0,0,0,0,1|3,0,0]=4 777 B15R2.1668 CN(O)Cc1cnc2ccccc2c1 Amb33325132 [0,0,0,0,0,1|2,0,1]=4 778 B15R2.1668 CN(O)Cc1cnc2ccccc2n1 Amb33377842 [0,0,0,0,0,1|2,0,1]=4 779 B15R2.1668 C[C@@H](N)CC1COc2ccccc2C1 Amb33423152 [0,0,0,0,0,1|1,0,2]=4 780 B15R2.1668 C[C@@H](N)CC1COc2ccccc2O1 Amb33321103 [0,0,0,0,0,1|1,0,2]=4 781 B15R2.1668 C[C@@H](N)CN1CCc2ccccc2C1 Amb18527670 [0,0,0,0,0,1|2,0,1]=4 782 B15R2.1668 C[C@@H](N)Cc1ccc2ccccc2c1 Amb25213558 [0,0,0,0,0,1|1,0,0]=2 783 B15R2.1668 C[C@@H](N)Cc1ccc2ccccc2n1 Amb33080324 [0,0,0,0,0,1|1,0,0]=2 784 B15R2.1668 C[C@@H](N)Cc1ccc2cccnc2c1 Amb32878875 [0,0,0,0,0,1|2,0,0]=3 785 B15R2.1668 C[C@@H](N)Cc1ccc2ncccc2c1 Amb33148693 [0,0,0,0,0,1|2,0,0]=3 786 B15R2.1668 C[C@@H](N)Cc1cnc2ccccc2c1 Amb33428980 [0,0,0,0,0,1|0,0,1]=2 787 B15R2.1668 C[C@@H](N)Cc1cnc2ccccc2n1 Amb33377327 [0,0,0,0,0,1|0,0,1]=2 788 B15R2.1668 C[C@@H](O)Cc1ccc2ccccc2c1 Amb33361949 [0,0,0,0,0,1|2,0,0]=3 789 B15R2.1668 C[C@@H](O)Cc1ccc2ccccc2n1 Amb33201374 [0,0,0,0,0,1|2,0,0]=3 790 B15R2.1668 C[C@@H](O)Cc1ccc2cccnc2c1 Amb32878872 [0,0,0,0,0,1|3,0,0]=4 791 B15R2.1668 C[C@@H](O)Cc1ccc2ncccc2c1 Amb33148691 [0,0,0,0,0,1|3,0,0]=4 792 B15R2.1668 C[C@@H](O)Cc1cnc2ccccc2c1 Amb33323982 [0,0,0,0,0,1|1,0,1]=3 793 B15R2.1668 C[C@@H](O)Cc1cnc2ccccc2n1 Amb33377323 [0,0,0,0,0,1|1,0,1]=3 794 B15R2.1668 C[C@H](N)CC1COc2ccccc2C1 Amb33423151 [0,0,0,0,0,1|1,0,2]=4 795 B15R2.1668 C[C@H](N)CC1COc2ccccc2O1 Amb33321157 [0,0,0,0,0,1|1,0,2]=4 796 B15R2.1668 C[C@H](N)Cc1ccc2ccccc2c1 Amb28246444 [0,0,0,0,0,1|1,0,0]=2 797 B15R2.1668 C[C@H](N)Cc1ccc2ccccc2n1 Amb33448716 [0,0,0,0,0,1|1,0,0]=2 798 B15R2.1668 C[C@H](N)Cc1ccc2cccnc2c1 Amb32878874 [0,0,0,0,0,1|2,0,0]=3 799 B15R2.1668 C[C@H](N)Cc1ccc2ncccc2c1 Amb33148745 [0,0,0,0,0,1|2,0,0]=3 800 B15R2.1668 C[C@H](N)Cc1cnc2ccccc2c1 Amb33080151 [0,0,0,0,0,1|0,0,1]=2 801 B15R2.1668 C[C@H](N)Cc1cnc2ccccc2n1 Amb33377326 [0,0,0,0,0,1|0,0,1]=2 802 B15R2.1668 C[C@H](O)Cc1ccc2ccccc2c1 Amb33361951 [0,0,0,0,0,1|2,0,0]=3 803 B15R2.1668 C[C@H](O)Cc1ccc2ccccc2n1 Amb33201375 [0,0,0,0,0,1|2,0,0]=3 804 B15R2.1668 C[C@H](O)Cc1ccc2cccnc2c1 Amb32878873 [0,0,0,0,0,1|3,0,0]=4 805 B15R2.1668 C[C@H](O)Cc1ccc2ncccc2c1 Amb33148692 [0,0,0,0,0,1|3,0,0]=4 806 B15R2.1668 C[C@H](O)Cc1cnc2ccccc2c1 Amb33323983 [0,0,0,0,0,1|1,0,1]=3 807 B15R2.1668 C[C@H](O)Cc1cnc2ccccc2n1 Amb33377325 [0,0,0,0,0,1|1,0,1]=3 808 B15R2.1668 N=C(N)Cc1ccc2ccccc2c1 Amb25072757 [0,0,0,0,0,1|2,0,1]=4 809 B15R2.1668 N=C(N)Cc1ccc2ccccc2n1 Amb19342940 [0,0,0,0,0,1|2,0,1]=4 810 B15R2.1668 N=C(N)Cc1cnc2ccccc2c1 Amb25220710 [0,0,0,0,0,1|1,0,2]=4 811 B15R2.1668 N=C(N)Cc1cnc2ccccc2n1 Amb33358274 [0,0,0,0,0,1|1,0,2]=4 812 B15R2.1668 NC(=O)Cc1ccc2ccccc2c1 Amb33551576 [0,0,0,0,0,1|2,0,1]=4 813 B15R2.1668 NC(=S)Cc1ccc2ccccc2c1 Amb28248765 [0,0,0,0,0,1|2,0,1]=4 814 B15R2.1668 NC(=S)Cc1ccc2ccccc2n1 Amb6742678 [0,0,0,0,0,1|2,0,1]=4 815 B15R2.1668 NC(=S)Cc1cnc2ccccc2c1 Amb27604829 [0,0,0,0,0,1|1,0,2]=4 816 B15R2.1668 NC(=S)Cc1cnc2ccccc2n1 Amb29854179 [0,0,0,0,0,1|1,0,2]=4 817 B15R2.68122 CC(=O)Cc1cccc2ccccc12 Amb6674795 [0,0,0,0,0,1|2,0,1]=4 818 B15R2.68122 CC(=O)Cc1ccnc2ccccc12 Amb27952210 [0,0,0,0,0,1|1,0,2]=4 819 B15R2.68122 CC(=O)Cc1cncc2ccccc12 Amb27246500 [0,0,0,0,0,1|1,0,2]=4 820 B15R2.68122 CC(=O)Cc1ncnc2ccccc12 Amb31030926 [0,0,0,0,0,1|1,0,2]=4 821 B15R2.68122 CC(Br)Cc1cccc2ccccc12 Amb25164839 [0,0,0,0,0,1|2,0,0]=3 822 B15R2.68122 CC(Br)Cc1cccc2cnccc12 Amb33435687 [0,0,0,0,0,1|3,0,0]=4 823 B15R2.68122 CC(Br)Cc1ccnc2ccccc12 Amb33242649 [0,0,0,0,0,1|1,0,1]=3 824 B15R2.68122 CC(C)CC1CCNc2ccccc21 Amb24458954 [0,0,0,0,0,1|1,0,2]=4 825 B15R2.68122 CC(C)CC1CNCc2ccccc21 Amb17401348 [0,0,0,0,0,1|1,0,2]=4 826 B15R2.68122 CC(C)CN1CCNc2ccccc21 Amb2383681 [0,0,0,0,0,1|2,0,1]=4 827 B15R2.68122 CC(C)Nc1cccc2ccccc12 Amb6687893 [0,0,0,0,0,1|3,0,0]=4 828 B15R2.68122 CC(C)Nc1cnnc2ccccc12 Amb26938264 [0,0,0,0,0,1|2,0,1]=4 829 B15R2.68122 CC(C)Nc1ncnc2ccccc12 Amb25164669 [0,0,0,0,0,1|2,0,1]=4 830 B15R2.68122 CC(C)Oc1cccc2ccccc12 Amb28043598 [0,0,0,0,0,1|3,0,0]=4 831 B15R2.68122 CC(C)Oc1nccc2ccccc12 Amb28455939 [0,0,0,0,0,1|3,0,0]=4 832 B15R2.68122 CC(Cl)Cc1cccc2ccccc12 Amb17477173 [0,0,0,0,0,1|2,0,0]=3 833 B15R2.68122 CC(N)CC1CCOc2ccccc21 Amb27455651 [0,0,0,0,0,1|1,0,2]=4 834 B15R2.68122 CC(N)CC1OCCc2ccccc21 Amb30010778 [0,0,0,0,0,1|1,0,2]=4 835 B15R2.68122 CC(N)CN1CCCc2ccccc21 Amb1124136 [0,0,0,0,0,1|2,0,1]=4 836 B15R2.68122 CC(N)CN1CCOc2ccccc21 Amb26970148 [0,0,0,0,0,1|2,0,1]=4 837 B15R2.68122 CC(N)Cc1cccc2ccccc12 Amb6245088 [0,0,0,0,0,1|1,0,0]=2 838 B15R2.68122 CC(N)Cc1cccc2nccnc12 Amb8011411 [0,0,0,0,0,1|3,0,0]=4 839 B15R2.68122 CC(N)Cc1ccnc2ccccc12 Amb25183252 [0,0,0,0,0,1|0,0,1]=2 840 B15R2.68122 CC(N)Cc1cncc2ccccc12 Amb18353673 [0,0,0,0,0,1|0,0,1]=2 841 B15R2.68122 CC(N)Cc1nccc2ccccc12 Amb18353814 [0,0,0,0,0,1|1,0,0]=2 842 B15R2.68122 CC(O)Cc1cccc2ccccc12 Amb17477169 [0,0,0,0,0,1|2,0,0]=3 843 B15R2.68122 CC(O)Cc1cccc2cnccc12 Amb32724591 [0,0,0,0,0,1|3,0,0]=4 844 B15R2.68122 CC(O)Cc1ccnc2ccccc12 Amb24389699 [0,0,0,0,0,1|1,0,1]=3 845 B15R2.68122 CN(C)Cc1cccc2ccccc12 Amb17663826 [0,0,0,0,0,1|3,0,0]=4 846 B15R2.68122 CN(C)Cc1ccnc2ccccc12 Amb26054400 [0,0,0,0,0,1|2,0,1]=4 847 B15R2.68122 CN(O)Cc1cccc2ccccc12 Amb33196698 [0,0,0,0,0,1|3,0,0]=4 848 B15R2.68122 CN(O)Cc1ccnc2ccccc12 Amb33146315 [0,0,0,0,0,1|2,0,1]=4 849 B15R2.68122 CN(O)Cc1cncc2ccccc12 Amb27813483 [0,0,0,0,0,1|2,0,1]=4 850 B15R2.68122 C[C@@H](N)CC1CCCc2ccccc21 Amb33379637 [0,0,0,0,0,1|1,0,2]=4 851 B15R2.68122 C[C@@H](N)CN1CCCc2ccccc21 Amb18014362 [0,0,0,0,0,1|2,0,1]=4 852 B15R2.68122 C[C@@H](N)Cc1cccc2ccccc12 Amb26845664 [0,0,0,0,0,1|1,0,0]=2 853 B15R2.68122 C[C@@H](N)Cc1cccc2cnccc12 Amb32724464 [0,0,0,0,0,1|2,0,0]=3 854 B15R2.68122 C[C@@H](N)Cc1ccnc2ccccc12 Amb32954771 [0,0,0,0,0,1|0,0,1]=2 855 B15R2.68122 C[C@@H](N)Cc1cncc2ccccc12 Amb33737734 [0,0,0,0,0,1|0,0,1]=2 856 B15R2.68122 C[C@@H](O)Cc1cccc2ccccc12 Amb33196043 [0,0,0,0,0,1|2,0,0]=3 857 B15R2.68122 C[C@@H](O)Cc1cccc2cnccc12 Amb32724461 [0,0,0,0,0,1|3,0,0]=4 858 B15R2.68122 C[C@@H](O)Cc1ccnc2ccccc12 Amb33145688 [0,0,0,0,0,1|1,0,1]=3 859 B15R2.68122 C[C@H](N)CC1CCCc2ccccc21 Amb33379636 [0,0,0,0,0,1|1,0,2]=4 860 B15R2.68122 C[C@H](N)CN1CCCc2ccccc21 Amb5782047 [0,0,0,0,0,1|2,0,1]=4 861 B15R2.68122 C[C@H](N)Cc1cccc2ccccc12 Amb25814679 [0,0,0,0,0,1|1,0,0]=2 862 B15R2.68122 C[C@H](N)Cc1cccc2cnccc12 Amb32724463 [0,0,0,0,0,1|2,0,0]=3 863 B15R2.68122 C[C@H](N)Cc1ccnc2ccccc12 Amb33079118 [0,0,0,0,0,1|0,0,1]=2 864 B15R2.68122 C[C@H](N)Cc1cncc2ccccc12 Amb33737496 [0,0,0,0,0,1|0,0,1]=2 865 B15R2.68122 C[C@H](O)Cc1cccc2ccccc12 Amb33196044 [0,0,0,0,0,1|2,0,0]=3 866 B15R2.68122 C[C@H](O)Cc1cccc2cnccc12 Amb32724462 [0,0,0,0,0,1|3,0,0]=4 867 B15R2.68122 C[C@H](O)Cc1ccnc2ccccc12 Amb33146027 [0,0,0,0,0,1|1,0,1]=3 868 B15R2.68122 N=C(N)Cc1cccc2ccccc12 Amb2696344 [0,0,0,0,0,1|2,0,1]=4 869 B15R2.68122 N=C(N)Cc1cccc2ccccc12 Amb8630192 [0,0,0,0,0,1|2,0,1]=4 870 B15R2.68122 N=C(N)Cc1ccnc2ccccc12 Amb25275987 [0,0,0,0,0,1|1,0,2]=4 871 B15R2.68122 NC(=O)CC1=CCCc2ccccc21 Amb28436788 [0,0,0,0,0,1|2,0,1]=4 872 B15R2.68122 NC(=O)Cc1cccc2ccccc12 Amb3738390 [0,0,0,0,0,1|2,0,1]=4 873 B15R2.68122 NC(=O)Cc1cncc2ccccc12 Amb18352880 [0,0,0,0,0,1|1,0,2]=4 874 B15R2.68122 NC(=O)Cc1nccc2ccccc12 Amb19104175 [0,0,0,0,0,1|2,0,1]=4 875 B15R2.68122 NC(=O)\C=C1\C=CNc2ccccc21 Amb28410059 [0,0,0,0,0,1|1,0,2]=4 876 B15R2.68122 NC(=S)Cc1cccc2ccccc12 Amb6247743 [0,0,0,0,0,1|2,0,1]=4 877 B15R2.68122 NC(=S)Cc1ccnc2ccccc12 Amb27619114 [0,0,0,0,0,1|1,0,2]=4 878 B12R1.121 CCCCc1ccccc1NN Amb3942594 [1,0,1,0,0,0|1,0,1]=4 879 B12R1.121 CCCOc1ccccc1NC Amb18316381 [1,0,1,0,0,0|1,0,1]=4 880 B12R1.125 CC(C)CCc1ccccc1N Amb13951566 [1,0,1,0,0,0|1,0,1]=4 881 B12R1.125 CC(C)CNc1ccccc1N Amb7767494 [1,0,1,0,0,0|2,0,0]=4 882 B12R1.125 CC(C)COc1ccccc1N Amb1137660 [1,0,1,0,0,0|2,0,0]=4 883 B12R1.125 CC(C)COc1ccccc1N Amb2140563 [1,0,1,0,0,0|2,0,0]=4 884 B12R1.125 CC(N)CCc1ccccc1Br Amb9031766 [1,0,1,0,0,0|1,0,1]=4 885 B12R1.125 CC(N)CCc1ccccc1Cl Amb2721943 [1,0,1,0,0,0|1,0,1]=4 886 B12R1.125 CC(N)CCc1ccccc1F Amb9031774 [1,0,1,0,0,0|1,0,1]=4 887 B12R1.125 CC(N)CCc1ccccc1O Amb17507315 [1,0,1,0,0,0|1,0,1]=4 888 B12R1.125 CC(N)CNc1ccccc1Br Amb27399526 [1,0,1,0,0,0|2,0,0]=4 889 B12R1.125 CC(N)CNc1ccccc1Cl Amb26923176 [1,0,1,0,0,0|2,0,0]=4 890 B12R1.125 CC(N)CNc1ccccc1F Amb27756404 [1,0,1,0,0,0|2,0,0]=4 891 B12R1.125 CC(N)COc1ccccc1Br Amb17062516 [1,0,1,0,0,0|2,0,0]=4 892 B12R1.125 CC(N)COc1ccccc1Cl Amb9756354 [1,0,1,0,0,0|2,0,0]=4 893 B12R1.125 CC(N)COc1ccccc1F Amb1134402 [1,0,1,0,0,0|2,0,0]=4 894 B12R1.125 CC(N)COc1ccccc1O Amb27814458 [1,0,1,0,0,0|2,0,0]=4 895 B12R1.125 CC(N)CSc1ccccc1N Amb18648678 [1,0,1,0,0,0|1,0,0]=3 896 B12R1.125 CC(N)\C=C\c1ccccc1Br Amb33242295 [1,0,1,0,0,0|1,0,1]=4 897 B12R1.125 CC(N)\C=C\c1ccccc1Cl Amb33406514 [1,0,1,0,0,0|1,0,1]=4 898 B12R1.125 CC(N)\C=C\c1ccccc1F Amb33448885 [1,0,1,0,0,0|1,0,1]=4 899 B12R1.125 CC(N)\C=C\c1ccccc1O Amb33429328 [1,0,1,0,0,0|1,0,1]=4 900 B12R1.125 CC(O)CNc1ccccc1N Amb9359006 [1,0,1,0,0,0|2,0,0]=4 901 B12R1.125 CC(O)COc1ccccc1N Amb18971553 [1,0,1,0,0,0|2,0,0]=4 902 B12R1.125 C[C@@H](N)CCc1ccccc1Br Amb33242308 [1,0,1,0,0,0|1,0,1]=4 903 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb24117939 [1,0,1,0,0,0|1,0,1]=4 904 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb32750188 [1,0,1,0,0,0|1,0,1]=4 905 B12R1.125 C[C@@H](N)CCc1ccccc1F Amb27817738 [1,0,1,0,0,0|1,0,1]=4 906 B12R1.125 C[C@@H](N)CCc1ccccc1O Amb27830642 [1,0,1,0,0,0|1,0,1]=4 907 B12R1.125 C[C@@H](N)COc1ccccc1Br Amb18036081 [1,0,1,0,0,0|2,0,0]=4 908 B12R1.125 C[C@@H](N)COc1ccccc1Cl Amb18538518 [1,0,1,0,0,0|2,0,0]=4 909 B12R1.125 C[C@@H](N)COc1ccccc1F Amb18538499 [1,0,1,0,0,0|2,0,0]=4 910 B12R1.125 C[C@@H](N)COc1ccccc1I Amb29850634 [1,0,1,0,0,0|2,0,0]=4 911 B12R1.125 C[C@@H](N)CSc1ccccc1Br Amb27847418 [1,0,1,0,0,0|2,0,0]=4 912 B12R1.125 C[C@@H](N)CSc1ccccc1Cl Amb28430384 [1,0,1,0,0,0|2,0,0]=4 913 B12R1.125 C[C@@H](N)CSc1ccccc1F Amb27663015 [1,0,1,0,0,0|2,0,0]=4 914 B12R1.125 C[C@H](N)CCc1ccccc1Br Amb27812499 [1,0,1,0,0,0|1,0,1]=4 915 B12R1.125 C[C@H](N)CCc1ccccc1Cl Amb24470862 [1,0,1,0,0,0|1,0,1]=4 916 B12R1.125 C[C@H](N)CCc1ccccc1F Amb26946665 [1,0,1,0,0,0|1,0,1]=4 917 B12R1.125 C[C@H](N)CCc1ccccc1N Amb28201211 [1,0,1,0,0,0|0,0,1]=3 918 B12R1.125 C[C@H](N)CCc1ccccc1O Amb25149919 [1,0,1,0,0,0|1,0,1]=4 919 B12R1.125 C[C@H](N)COc1ccccc1I Amb29850633 [1,0,1,0,0,0|2,0,0]=4 920 B12R1.125 Cc1ccccc1CCC(C)N Amb9031759 [1,0,1,0,0,0|0,0,2]=4 921 B12R1.125 Cc1ccccc1CC[C@@H](C)N Amb33225585 [1,0,1,0,0,0|0,0,2]=4 922 B12R1.125 Cc1ccccc1CC[C@H](C)N Amb26611454 [1,0,1,0,0,0|0,0,2]=4 923 B12R1.125 Cc1ccccc1NCC(C)N Amb25913696 [1,0,1,0,0,0|1,0,1]=4 924 B12R1.125 Cc1ccccc1OCC(C)N Amb9756347 [1,0,1,0,0,0|1,0,1]=4 925 B12R1.125 Cc1ccccc1OC[C@@H](C)N Amb18538491 [1,0,1,0,0,0|1,0,1]=4 926 B12R1.125 Cc1ccccc1SC[C@@H](C)N Amb27879389 [1,0,1,0,0,0|1,0,1]=4 927 B12R1.125 Cc1ccccc1\C=C\C(C)N Amb33475216 [1,0,1,0,0,0|0,0,2]=4 928 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [1,0,1,0,0,0|1,0,1]=4 929 B12R1.107 C=C(CC(C)O)c1ccccc1 Amb27486292 [1,0,1,0,0,0|1,0,0]=3 930 B12R1.107 CC(C)CC(=O)c1ccccc1 Amb4017884 [1,0,1,0,0,0|2,0,0]=4 931 B12R1.107 CC(C)CC(N)c1ccccc1 Amb6892355 [1,0,1,0,0,0|1,0,1]=4 932 B12R1.107 CC(C)CC(N)c1ccccc1 Amb9703509 [1,0,1,0,0,0|1,0,1]=4 933 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [1,0,1,0,0,0|1,0,1]=4 934 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb27175567 [1,0,1,0,0,0|1,0,1]=4 935 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [1,0,1,0,0,0|1,0,1]=4 936 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb27249677 [1,0,1,0,0,0|1,0,1]=4 937 B12R1.107 CC(C[C@@H](C)N)c1ccccc1 Amb33081852 [1,0,1,0,0,0|0,0,2]=4 938 B12R1.107 CC(C[C@H](C)N)c1ccccc1 Amb33081854 [1,0,1,0,0,0|0,0,2]=4 939 B12R1.107 CC(Cl)CC(=O)c1ccccc1 Amb28042789 [1,0,1,0,0,0|2,0,0]=4 940 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [1,0,1,0,0,0|1,0,0]=3 941 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [1,0,1,0,0,0|1,0,0]=3 942 B12R1.107 CC(N)CC(=O)c1ccccn1 Amb27623071 [1,0,1,0,0,0|2,0,0]=4 943 B12R1.107 CC(N)CC(C)c1ccccc1 Amb27831891 [1,0,1,0,0,0|0,0,2]=4 944 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [1,0,1,0,0,0|1,0,1]=4 945 B12R1.107 CC(N)CN(C)c1ccccc1 Amb10610213 [1,0,1,0,0,0|1,0,1]=4 946 B12R1.107 CC(N)CN(C)c1ccccc1 Amb1137929 [1,0,1,0,0,0|1,0,1]=4 947 B12R1.107 CC(N)CS(=O)c1ccccc1 Amb27165944 [1,0,1,0,0,0|2,0,0]=4 948 B12R1.107 CC(N)NC(=O)c1ccccc1 Amb27792210 [1,0,1,0,0,0|2,0,0]=4 949 B12R1.107 CC(O)CC(=O)c1ccccc1 Amb27177964 [1,0,1,0,0,0|2,0,0]=4 950 B12R1.107 C[C@@H](N)C[C@@H](O)c1ccccc1 Amb27592173 [1,0,1,0,0,0|1,0,1]=4 951 B12R1.107 C[C@H](N)CN(C)c1ccccc1 Amb5782045 [1,0,1,0,0,0|1,0,1]=4 952 B12R1.107 C[C@H](N)C[C@H](O)c1ccccc1 Amb27217333 [1,0,1,0,0,0|1,0,1]=4 953 B12R1.107 C[C@H](O)CC(=O)c1ccccc1 Amb27178049 [1,0,1,0,0,0|2,0,0]=4 954 B12R1.107 C[C@H](O)C[C@H](N)c1ccccc1 Amb27646110 [1,0,1,0,0,0|1,0,1]=4 955 B12R1.308 C=C(CCN)c1ccccc1Br Amb33388000 [1,0,1,0,0,0|1,0,0]=3 956 B12R1.308 C=C(CCN)c1ccccc1C Amb33362533 [1,0,1,0,0,0|1,0,0]=3 957 B12R1.308 C=C(CCN)c1ccccc1Cl Amb33052606 [1,0,1,0,0,0|1,0,0]=3 958 B12R1.308 C=C(CCN)c1ccccc1F Amb33361195 [1,0,1,0,0,0|1,0,0]=3 959 B12R1.308 C=C(CCN)c1ccccc1O Amb33195783 [1,0,1,0,0,0|1,0,0]=3 960 B12R1.308 C=C(CCN)c1cccnc1Br Amb33388162 [1,0,1,0,0,0|2,0,0]=4 961 B12R1.308 C=C(CCN)c1cccnc1C Amb32878332 [1,0,1,0,0,0|2,0,0]=4 962 B12R1.308 C=C(CCN)c1cccnc1Cl Amb33257375 [1,0,1,0,0,0|2,0,0]=4 963 B12R1.308 C=C(CCN)c1cccnc1F Amb33376812 [1,0,1,0,0,0|2,0,0]=4 964 B12R1.308 C=C(CCN)c1ccncc1Br Amb33388673 [1,0,1,0,0,0|2,0,0]=4 965 B12R1.308 C=C(CCN)c1ccncc1C Amb33426418 [1,0,1,0,0,0|2,0,0]=4 966 B12R1.308 C=C(CCN)c1ccncc1Cl Amb33413791 [1,0,1,0,0,0|2,0,0]=4 967 B12R1.308 C=C(CCN)c1ccncc1F Amb33316808 [1,0,1,0,0,0|2,0,0]=4 968 B12R1.308 C=C(CCN)c1cnccc1C Amb33375275 [1,0,1,0,0,0|2,0,0]=4 969 B12R1.308 C=C(CCN)c1ncccc1Br Amb33336388 [1,0,1,0,0,0|2,0,0]=4 970 B12R1.308 C=C(CCN)c1ncccc1C Amb33360197 [1,0,1,0,0,0|2,0,0]=4 971 B12R1.308 C=C(CCN)c1ncccc1F Amb33418413 [1,0,1,0,0,0|2,0,0]=4 972 B12R1.308 C=C(CCO)c1ccccc1F Amb27980568 [1,0,1,0,0,0|2,0,0]=4 973 B12R1.308 C=C(OCC)c1ccccc1N Amb33136058 [1,0,1,0,0,0|1,0,0]=3 974 B12R1.308 C=C(OCC)c1ccccc1O Amb33136251 [1,0,1,0,0,0|2,0,0]=4 975 B12R1.308 C=C(OCC)c1cccnc1N Amb33136323 [1,0,1,0,0,0|2,0,0]=4 976 B12R1.308 C=C(OCC)c1ccncc1N Amb33135833 [1,0,1,0,0,0|2,0,0]=4 977 B12R1.308 C=C(OCC)c1cnccc1N Amb33136013 [1,0,1,0,0,0|2,0,0]=4 978 B12R1.308 C=C(OCC)c1ncccc1N Amb33135937 [1,0,1,0,0,0|2,0,0]=4 979 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [1,0,1,0,0,0|2,0,0]=4 980 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [1,0,1,0,0,0|2,0,0]=4 981 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [1,0,1,0,0,0|2,0,0]=4 982 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [1,0,1,0,0,0|2,0,0]=4 983 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [1,0,1,0,0,0|1,0,0]=3 984 B12R1.308 CCCC(=O)c1ccccc1O Amb8629040 [1,0,1,0,0,0|2,0,0]=4 985 B12R1.308 CCCC(=O)c1ncccc1N Amb27472806 [1,0,1,0,0,0|2,0,0]=4 986 B12R1.308 CCCN(C)c1ccccc1N Amb8898676 [1,0,1,0,0,0|1,0,1]=4 987 B12R1.308 CCNC(=O)c1ccccc1N Amb1120573 [1,0,1,0,0,0|2,0,0]=4 988 B12R1.308 CCOC(=O)c1ccccc1N Amb1229845 [1,0,1,0,0,0|2,0,0]=4 989 B12R1.308 Cc1ccccc1C(=O)CCN Amb25062867 [1,0,1,0,0,0|2,0,0]=4 990 B12R1.308 NCCC(=O)c1ccccc1Br Amb33389465 [1,0,1,0,0,0|2,0,0]=4 991 B12R1.308 NCCC(=O)c1ccccc1Cl Amb25709180 [1,0,1,0,0,0|2,0,0]=4 992 B12R1.308 NCCC(=O)c1ccccc1Cl Amb32674762 [1,0,1,0,0,0|2,0,0]=4 993 B12R1.308 NCCC(=O)c1ccccc1F Amb27881481 [1,0,1,0,0,0|2,0,0]=4 994 B12R1.308 NCCC(=O)c1ccccc1N Amb21855941 [1,0,1,0,0,0|1,0,0]=3 995 B12R1.308 NCCC(=O)c1ccccc1N Amb28555772 [1,0,1,0,0,0|1,0,0]=3 996 B12R1.308 NCCC(=O)c1ccccc1N Amb32652605 [1,0,1,0,0,0|1,0,0]=3 997 B12R1.308 NCCC(=O)c1ccccc1O Amb24346596 [1,0,1,0,0,0|2,0,0]=4 998 B12R1.308 NCCC(O)c1ccccc1N Amb28249964 [1,0,1,0,0,0|1,0,1]=4 999 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [1,0,1,0,0,0|1,0,1]=4 1000 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [1,0,1,0,0,0|1,0,0]=3 1001 B12R1.8 CCC\C=N\Nc1cccnc1 Amb27178805 [1,0,1,0,0,0|2,0,0]=4 1002 B12R1.8 CCC\C=N\Nc1ccncc1 Amb28206946 [1,0,1,0,0,0|2,0,0]=4 1003 B12R1.8 NCCC\C=C\c1ccccc1 Amb18563531 [1,0,1,0,0,0|1,0,1]=4 1004 B12R1.8 NC\C=C\C=C\c1ccccc1 Amb32953332 [1,0,1,0,0,0|1,0,1]=4 1005 B12R1.3 CCCC(C=O)c1ccccc1 Amb17594046 [1,0,1,0,0,0|1,0,1]=4 1006 B12R1.3 CCCC(CN)c1ccccc1 Amb8950183 [1,0,1,0,0,0|0,0,2]=4 1007 B12R1.3 CCC\C(=N\N)c1ccccc1 Amb27649935 [1,0,1,0,0,0|1,0,0]=3 1008 B12R1.3 CCC\C(=N\N)c1ccccn1 Amb28201662 [1,0,1,0,0,0|2,0,0]=4 1009 B12R1.3 CCC\C(=N\O)c1ccccc1 Amb27979178 [1,0,1,0,0,0|2,0,0]=4 1010 B12R1.3 CCO\C(=C/Cl)c1ccccc1 Amb28365649 [1,0,1,0,0,0|2,0,0]=4 1011 B12R1.3 CCO\C(=C\Cl)c1ccccc1 Amb28052050 [1,0,1,0,0,0|2,0,0]=4 1012 B12R1.3 CC\C=C(\C=O)c1ccccc1 Amb10807890 [1,0,1,0,0,0|1,0,1]=4 1013 B12R1.3 CSC\C(=N\N)c1ccccc1 Amb28316277 [1,0,1,0,0,0|2,0,0]=4 1014 B12R1.3 NCCC(CN)c1ccccc1 Amb1111605 [1,0,1,0,0,0|0,0,2]=4 1015 B12R1.3 NNC\C(=C/F)c1ccccc1 Amb8391753 [1,0,1,0,0,0|2,0,0]=4 1016 B12R2.1 BrCc1coc2ccccc12 Amb23401826 [2,0,0,0,0,0|2,0,0]=4 1017 B12R2.1 BrCc1csc2ccccc12 Amb10609548 [2,0,0,0,0,0|2,0,0]=4 1018 B12R2.1 CCC1=CCc2ccccc21 Amb27227340 [2,0,0,0,0,0|1,0,0]=3 1019 B12R2.1 CCC1CNc2ccccc21 Amb32661135 [2,0,0,0,0,0|0,0,2]=4 1020 B12R2.1 CCC1CNc2ccccc21 Amb9776196 [2,0,0,0,0,0|0,0,2]=4 1021 B12R2.1 CC[n+]1csc2ccccc21 Amb2610544 [2,0,0,0,0,0|2,0,0]=4 1022 B12R2.1 CCc1ccn2ccccc12 Amb27977884 [2,0,0,0,0,0|2,0,0]=4 1023 B12R2.1 CCc1coc2ccccc12 Amb27792683 [2,0,0,0,0,0|1,0,0]=3 1024 B12R2.1 CCn1ccc2ccccc21 Amb3708000 [2,0,0,0,0,0|2,0,0]=4 1025 B12R2.1 CCn1cnc2ccccc21 Amb1104116 [2,0,0,0,0,0|1,0,1]=4 1026 B12R2.1 CNc1coc2ccccc12 Amb26039834 [2,0,0,0,0,0|2,0,0]=4 1027 B12R2.1 CNc1csc2ccccc12 Amb23403655 [2,0,0,0,0,0|2,0,0]=4 1028 B12R2.1 COC1=CCc2ccccc21 Amb17778910 [2,0,0,0,0,0|2,0,0]=4 1029 B12R2.1 COc1csc2ccccc12 Amb28320302 [2,0,0,0,0,0|2,0,0]=4 1030 B12R2.1 C\C=C1\C=Cc2ccccc21 Amb25322411 [2,0,0,0,0,0|1,0,1]=4 1031 B12R2.1 C\C=C1\CNc2ccccc21 Amb27967275 [2,0,0,0,0,0|0,0,2]=4 1032 B12R2.1 ClCc1coc2ccccc12 Amb5716310 [2,0,0,0,0,0|2,0,0]=4 1033 B12R2.1 ClCc1csc2ccccc12 Amb7808742 [2,0,0,0,0,0|2,0,0]=4 1034 B12R2.1 FCc1coc2ccccc12 Amb27186252 [2,0,0,0,0,0|2,0,0]=4 1035 B12R2.1 NCC1=CCc2ccccc21 Amb18560208 [2,0,0,0,0,0|1,0,0]=3 1036 B12R2.1 NCC1C=Cc2ccccc21 Amb17470375 [2,0,0,0,0,0|1,0,1]=4 1037 B12R2.1 NCC1CNc2ccccc21 Amb18063038 [2,0,0,0,0,0|0,0,2]=4 1038 B12R2.1 NCC1CNc2ccccc21 Amb30588549 [2,0,0,0,0,0|0,0,2]=4 1039 B12R2.1 NCc1cnc2ccccn12 Amb10067697 [2,0,0,0,0,0|1,0,1]=4 1040 B12R2.1 NCc1cnc2ccccn12 Amb10608545 [2,0,0,0,0,0|1,0,1]=4 1041 B12R2.1 NCc1cnc2ccccn12 Amb20413753 [2,0,0,0,0,0|1,0,1]=4 1042 B12R2.1 NCc1cnc2ccccn12 Amb22492384 [2,0,0,0,0,0|1,0,1]=4 1043 B12R2.1 NCc1cnn2ccccc12 Amb15701392 [2,0,0,0,0,0|1,0,1]=4 1044 B12R2.1 NCc1cnn2ccccc12 Amb22491668 [2,0,0,0,0,0|1,0,1]=4 1045 B12R2.1 NCc1coc2ccccc12 Amb19373967 [2,0,0,0,0,0|1,0,0]=3 1046 B12R2.1 NCc1coc2ccccc12 Amb19649824 [2,0,0,0,0,0|1,0,0]=3 1047 B12R2.1 NCc1csc2ccccc12 Amb2723184 [2,0,0,0,0,0|1,0,0]=3 1048 B12R2.1 NCc1csc2ccccc12 Amb3941423 [2,0,0,0,0,0|1,0,0]=3 1049 B12R2.1 NCc1csc2ncccc12 Amb27847946 [2,0,0,0,0,0|2,0,0]=4 1050 B12R2.1 NCc1noc2ccccc12 Amb33531498 [2,0,0,0,0,0|2,0,0]=4 1051 B12R2.1 NCc1noc2ccccc12 Amb33536485 [2,0,0,0,0,0|2,0,0]=4 1052 B12R2.1 NCc1nsc2ccccc12 Amb18646122 [2,0,0,0,0,0|2,0,0]=4 1053 B12R2.1 NCc1nsc2ccccc12 Amb28872324 [2,0,0,0,0,0|2,0,0]=4 1054 B12R2.1 NNc1coc2ccccc12 Amb35704215 [2,0,0,0,0,0|2,0,0]=4 1055 B12R2.1 OCc1coc2ccccc12 Amb10572402 [2,0,0,0,0,0|2,0,0]=4 1056 B12R2.1 OCc1csc2ccccc12 Amb2723182 [2,0,0,0,0,0|2,0,0]=4 1057 B12R2.1 SCc1coc2ccccc12 Amb24405838 [2,0,0,0,0,0|2,0,0]=4 1058 B12R2.1 SCc1csc2ccccc12 Amb3429654 [2,0,0,0,0,0|2,0,0]=4 1059 B14R1.4522 CC(N)CCc1ccccc1N(C)C Amb33172396 [0,1,1,0,0,0|0,0,2]=4 1060 B14R1.4522 CC(N)\C=C\c1ccccc1N(C)C Amb32879272 [0,1,1,0,0,0|0,0,2]=4 1061 B14R1.4522 C[C@@H](N)CCc1ccccc1N(C)C Amb33360409 [0,1,1,0,0,0|0,0,2]=4 1062 B14R1.4522 C[C@H](N)CCc1ccccc1N(C)C Amb32954698 [0,1,1,0,0,0|0,0,2]=4 1063 B14R1.152 CC(N)CC(=O)c1cccc(Br)c1F Amb27478828 [0,1,1,0,0,0|2,0,0]=4 1064 B14R1.152 Cc1cccc(C(=O)CC(C)C)c1N Amb27749421 [0,1,1,0,0,0|2,0,0]=4 1065 B14R1.243 Cc1ccccc1C(=O)C(C)C(C)N Amb28422974 [0,1,1,0,0,0|2,0,0]=4 1066 B14R1.587 C[C@@H](CN)NC(=O)c1ccccc1N Amb27774617 [0,1,1,0,0,0|2,0,0]=4 1067 B14R1.587 C[C@H](CN)NC(=O)c1ccccc1N Amb27842849 [0,1,1,0,0,0|2,0,0]=4 1068 B14R1.5958 CC(N)CC(=O)c1c(Cl)cccc1Cl Amb27236270 [0,1,1,0,0,0|2,0,0]=4 1069 B14R1.6048 C=C(CN(C)N)c1ccc(F)cc1C Amb8391747 [0,1,1,0,0,0|2,0,0]=4 1070 B14R1.6048 CC(C)CC(=O)c1ccc(F)cc1N Amb28048152 [0,1,1,0,0,0|2,0,0]=4 1071 B14R1.6048 CC(N)CC(=O)c1ccc(Br)cc1Cl Amb27971451 [0,1,1,0,0,0|2,0,0]=4 1072 B14R1.6048 Cc1ccc(C(=O)CC(C)C)c(N)c1 Amb28410013 [0,1,1,0,0,0|2,0,0]=4 1073 B14R1.6048 Cc1ccc(C(=O)CC(C)N)c(C)c1 Amb27418121 [0,1,1,0,0,0|2,0,0]=4 1074 B14R1.6052 CC(C)CC(=O)c1cc(Cl)ccc1N Amb35584209 [0,1,1,0,0,0|2,0,0]=4 1075 B14R1.6052 CC(N)CC(=O)c1cc(Br)ccc1F Amb27812595 [0,1,1,0,0,0|2,0,0]=4 1076 B14R1.6052 CC(N)CC(=O)c1cc(F)ccc1Cl Amb27464235 [0,1,1,0,0,0|2,0,0]=4 1077 B14R1.6052 CC(N)CC(=O)c1cc(F)ccc1F Amb27418123 [0,1,1,0,0,0|2,0,0]=4 1078 B14R1.6052 Cc1ccc(N)c(C(=O)CC(C)C)c1 Amb27760049 [0,1,1,0,0,0|2,0,0]=4 1079 B14R1.6052 Cc1cnc(N)c(C(=O)CC(C)N)c1 Amb28342105 [0,1,1,0,0,0|2,0,0]=4 1080 B14R1.423 CC(C)CNC(=S)Nc1ccccc1 Amb1841661 [0,1,1,0,0,0|2,0,0]=4 1081 B14R1.423 CC(C)COC(=S)Nc1ccccc1 Amb1039629 [0,1,1,0,0,0|2,0,0]=4 1082 B14R1.423 CC(N)COC(=O)Nc1ccccc1 Amb35723823 [0,1,1,0,0,0|1,0,0]=3 1083 B14R1.423 CC(O)CCC(=O)Nc1ccccc1 Amb17336624 [0,1,1,0,0,0|1,0,1]=4 1084 B14R1.423 CC(O)CNC(=O)Nc1ccccc1 Amb9246709 [0,1,1,0,0,0|2,0,0]=4 1085 B14R1.423 CC(O)CNC(=S)Nc1ccccc1 Amb2688787 [0,1,1,0,0,0|2,0,0]=4 1086 B14R1.423 CC(O)COC(=O)Nc1ccccc1 Amb27230575 [0,1,1,0,0,0|2,0,0]=4 1087 B14R1.423 CC(\C=C\C(C)N)=C/c1ccccc1 Amb33381249 [0,1,1,0,0,0|1,0,1]=4 1088 B14R1.423 C[C@@H](O)CNC(=O)Nc1ccccc1 Amb27461579 [0,1,1,0,0,0|2,0,0]=4 1089 B14R1.423 C[C@H](O)CNC(=S)Nc1ccccc1 Amb27391731 [0,1,1,0,0,0|2,0,0]=4 1090 B14R1.423 C\C(=C/c1ccccc1)CCC(C)N Amb33476718 [0,1,1,0,0,0|1,0,1]=4 1091 B14R1.423 C\C(=C/c1ccccc1)CC[C@@H](C)N Amb33476737 [0,1,1,0,0,0|1,0,1]=4 1092 B14R1.423 C\C(=C/c1ccccc1)CC[C@H](C)N Amb33476741 [0,1,1,0,0,0|1,0,1]=4 1093 B14R1.677 CC(N)CC\C=C\c1ccc(F)cc1 Amb33202737 [0,1,1,0,0,0|1,0,1]=4 1094 B14R1.677 CC(N)\C=C\C=C\c1ccc(F)cc1 Amb33201719 [0,1,1,0,0,0|1,0,1]=4 1095 B14R1.677 C[C@@H](N)CC\C=C\c1ccc(F)cc1 Amb33202733 [0,1,1,0,0,0|1,0,1]=4 1096 B14R1.677 C[C@H](N)CC\C=C\c1ccc(F)cc1 Amb33202438 [0,1,1,0,0,0|1,0,1]=4 1097 B14R1.818 CC(N)CC(=O)NNc1ccccc1 Amb27810166 [0,1,1,0,0,0|1,0,0]=3 1098 B14R1.818 CC(N)CC(=O)OCc1ccccc1 Amb19042037 [0,1,1,0,0,0|2,0,0]=4 1099 B14R1.818 CC(N)CC(=O)OCc1ccccc1 Amb32681166 [0,1,1,0,0,0|2,0,0]=4 1100 B14R1.818 C[C@H](N)CC(=O)OCc1ccccc1 Amb27249734 [0,1,1,0,0,0|2,0,0]=4 1101 B14R1.818 C\C(CC(C)O)=N/Nc1ccccc1 Amb28453454 [0,1,1,0,0,0|2,0,0]=4 1102 B14R1.3331 CC(C)(N)CC\C=C\c1ccccc1 Amb18863479 [0,1,1,0,0,0|1,0,1]=4 1103 B14R1.1019 Cc1ccc(\C(=C/O)CC(C)N)cc1 Amb28384600 [0,1,1,0,0,0|1,0,0]=3 1104 B14R1.1019 Cc1ccc(\C(=C\O)CC(C)N)cc1 Amb28289943 [0,1,1,0,0,0|1,0,0]=3 1105 B14R1.6455 CC(C)\C=C(\C(N)=O)c1ccccc1 Amb27781459 [0,1,1,0,0,0|1,0,1]=4 1106 B14R1.6455 CC(O)CC(=C(F)F)c1ccccc1 Amb27757395 [0,1,1,0,0,0|2,0,0]=4 1107 B14R2.3 BrCCCc1cnc2ccccn12 Amb24095409 [1,1,0,0,0,0|1,0,1]=4 1108 B14R2.3 BrCCCc1cnn2ccccc12 Amb33435063 [1,1,0,0,0,0|1,0,1]=4 1109 B14R2.3 BrCCCc1csc2ccccc12 Amb26353125 [1,1,0,0,0,0|1,0,0]=3 1110 B14R2.3 BrCCCn1ccc2ccccc21 Amb10608812 [1,1,0,0,0,0|2,0,0]=4 1111 B14R2.3 C#CCCc1csc2ccccc12 Amb33196985 [1,1,0,0,0,0|1,0,1]=4 1112 B14R2.3 C=CCCc1coc2ccccc12 Amb35704125 [1,1,0,0,0,0|1,0,1]=4 1113 B14R2.3 CCCCC1CNc2ccccc21 Amb27830325 [1,1,0,0,0,0|0,0,2]=4 1114 B14R2.3 CCCCn1cnc2ccccc21 Amb1744547 [1,1,0,0,0,0|1,0,1]=4 1115 B14R2.3 CCCNc1csc2ccccc12 Amb27186106 [1,1,0,0,0,0|1,0,0]=3 1116 B14R2.3 CCCNc1nsc2ccccc12 Amb26845355 [1,1,0,0,0,0|2,0,0]=4 1117 B14R2.3 CCCOn1cnc2ccccc21 Amb24725237 [1,1,0,0,0,0|1,0,1]=4 1118 B14R2.3 CCNCC1CNc2ccccc21 Amb27585478 [1,1,0,0,0,0|0,0,2]=4 1119 B14R2.3 CCNCc1cnc2ccccn12 Amb22713604 [1,1,0,0,0,0|1,0,1]=4 1120 B14R2.3 CCNCc1cnn2ccccc12 Amb25693835 [1,1,0,0,0,0|1,0,1]=4 1121 B14R2.3 CCNCc1coc2ccccc12 Amb19649832 [1,1,0,0,0,0|1,0,0]=3 1122 B14R2.3 CCNCc1csc2ccccc12 Amb18994544 [1,1,0,0,0,0|1,0,0]=3 1123 B14R2.3 CCOCc1coc2ccccc12 Amb27193439 [1,1,0,0,0,0|1,0,0]=3 1124 B14R2.3 CCOCn1ccc2ccccc21 Amb27978166 [1,1,0,0,0,0|2,0,0]=4 1125 B14R2.3 CCOCn1cnc2ccccc21 Amb25065187 [1,1,0,0,0,0|1,0,1]=4 1126 B14R2.3 CNCCC1C=Cc2ccccc21 Amb27215471 [1,1,0,0,0,0|1,0,1]=4 1127 B14R2.3 CNCCC1CNc2ccccc21 Amb18647991 [1,1,0,0,0,0|0,0,2]=4 1128 B14R2.3 CNCCc1cnc2ccccn12 Amb33225717 [1,1,0,0,0,0|1,0,1]=4 1129 B14R2.3 CNCCc1cnn2ccccc12 Amb33149375 [1,1,0,0,0,0|1,0,1]=4 1130 B14R2.3 CNCCc1csc2ccccc12 Amb18129924 [1,1,0,0,0,0|1,0,0]=3 1131 B14R2.3 CNCCn1ccc2ccccc21 Amb1792778 [1,1,0,0,0,0|2,0,0]=4 1132 B14R2.3 CNCCn1ccc2ccccc21 Amb6344835 [1,1,0,0,0,0|2,0,0]=4 1133 B14R2.3 CNCCn1cnc2ccccc21 Amb9339073 [1,1,0,0,0,0|1,0,1]=4 1134 B14R2.3 COCCn1ccc2ccccc21 Amb28427993 [1,1,0,0,0,0|2,0,0]=4 1135 B14R2.3 CONCc1csc2ccccc12 Amb28205550 [1,1,0,0,0,0|2,0,0]=4 1136 B14R2.3 CSCCn1ccc2ccccc21 Amb27414624 [1,1,0,0,0,0|2,0,0]=4 1137 B14R2.3 CSCCn1cnc2ccccc21 Amb27587043 [1,1,0,0,0,0|1,0,1]=4 1138 B14R2.3 ClCCCC1C=Cc2ccccc21 Amb28320765 [1,1,0,0,0,0|1,0,1]=4 1139 B14R2.3 ClCCCc1coc2ccccc12 Amb35704102 [1,1,0,0,0,0|1,0,0]=3 1140 B14R2.3 ClCCCc1csc2ccccc12 Amb28193411 [1,1,0,0,0,0|1,0,0]=3 1141 B14R2.3 ClCCCn1cnc2ccccc21 Amb1130021 [1,1,0,0,0,0|1,0,1]=4 1142 B14R2.3 ClCCOc1csc2ccccc12 Amb27463408 [1,1,0,0,0,0|2,0,0]=4 1143 B14R2.3 N#CCCc1coc2ccccc12 Amb27878503 [1,1,0,0,0,0|1,0,1]=4 1144 B14R2.3 N#CCCc1csc2ccccc12 Amb28255385 [1,1,0,0,0,0|1,0,1]=4 1145 B14R2.3 NCCCc1cnc2ccccn12 Amb18252272 [1,1,0,0,0,0|1,0,1]=4 1146 B14R2.3 NCCCc1cnn2ccccc12 Amb26603662 [1,1,0,0,0,0|1,0,1]=4 1147 B14R2.3 NCCCc1csc2ccccc12 Amb18910203 [1,1,0,0,0,0|1,0,0]=3 1148 B14R2.3 NCCCc1onc2ccccc12 Amb18196761 [1,1,0,0,0,0|1,0,1]=4 1149 B14R2.3 NCCCn1ccc2ccccc21 Amb2370979 [1,1,0,0,0,0|2,0,0]=4 1150 B14R2.3 NCCCn1ccc2ccccc21 Amb30308 [1,1,0,0,0,0|2,0,0]=4 1151 B14R2.3 NCCCn1ccc2ccccc21 Amb8503274 [1,1,0,0,0,0|2,0,0]=4 1152 B14R2.3 NCCCn1cnc2ccccc21 Amb6326448 [1,1,0,0,0,0|1,0,1]=4 1153 B14R2.3 NCCCn1cnc2ccccc21 Amb6861473 [1,1,0,0,0,0|1,0,1]=4 1154 B14R2.3 NCCCn1cnc2ccccc21 Amb7969601 [1,1,0,0,0,0|1,0,1]=4 1155 B14R2.3 NCCNc1noc2ccccc12 Amb28248500 [1,1,0,0,0,0|2,0,0]=4 1156 B14R2.3 NCCNc1nsc2ccccc12 Amb1108876 [1,1,0,0,0,0|2,0,0]=4 1157 B14R2.3 NCCNc1snc2ccccc12 Amb27643180 [1,1,0,0,0,0|1,0,1]=4 1158 B14R2.3 NCCOc1cnc2ccccn12 Amb33146259 [1,1,0,0,0,0|1,0,1]=4 1159 B14R2.3 NCCOc1cnn2ccccc12 Amb33146814 [1,1,0,0,0,0|1,0,1]=4 1160 B14R2.3 NCCOc1csc2ccccc12 Amb33196991 [1,1,0,0,0,0|1,0,0]=3 1161 B14R2.3 NCCSc1coc2ccccc12 Amb18130031 [1,1,0,0,0,0|1,0,0]=3 1162 B14R2.3 NC\C=C\c1coc2ccccc12 Amb24492217 [1,1,0,0,0,0|1,0,1]=4 1163 B14R2.3 NC\C=C\c1csc2ccccc12 Amb26989128 [1,1,0,0,0,0|1,0,1]=4 1164 B14R2.3 NOCCc1cnc2ccccn12 Amb33274062 [1,1,0,0,0,0|1,0,1]=4 1165 B14R2.3 NOCCc1cnn2ccccc12 Amb33147533 [1,1,0,0,0,0|1,0,1]=4 1166 B14R2.3 NOCCc1coc2ccccc12 Amb24450105 [1,1,0,0,0,0|1,0,0]=3 1167 B14R2.3 NOCCc1csc2ccccc12 Amb27610362 [1,1,0,0,0,0|1,0,0]=3 1168 B14R2.3 O=CCCc1coc2ccccc12 Amb28321950 [1,1,0,0,0,0|1,0,1]=4 1169 B14R2.3 O=CCCc1csc2ccccc12 Amb26851937 [1,1,0,0,0,0|1,0,1]=4 1170 B14R2.3 OCCCc1cnc2ccccn12 Amb24097767 [1,1,0,0,0,0|1,0,1]=4 1171 B14R2.3 OCCCc1cnn2ccccc12 Amb33147784 [1,1,0,0,0,0|1,0,1]=4 1172 B14R2.3 OCCCc1coc2ccccc12 Amb25898468 [1,1,0,0,0,0|1,0,0]=3 1173 B14R2.3 OCCCc1csc2ccccc12 Amb25138282 [1,1,0,0,0,0|1,0,0]=3 1174 B14R2.3 OCCCn1cnc2ccccc21 Amb8041913 [1,1,0,0,0,0|1,0,1]=4 1175 B14R2.3 OCCSc1coc2ccccc12 Amb27399514 [1,1,0,0,0,0|2,0,0]=4 1176 B14R2.3 SCCCc1cnc2ccccn12 Amb33146248 [1,1,0,0,0,0|1,0,1]=4 1177 B14R2.3 SCCCc1cnn2ccccc12 Amb33146759 [1,1,0,0,0,0|1,0,1]=4 1178 B14R2.3 SCCCc1coc2ccccc12 Amb27196744 [1,1,0,0,0,0|1,0,0]=3 1179 B14R2.3 SCCCc1csc2ccccc12 Amb24405823 [1,1,0,0,0,0|1,0,0]=3 1180 B14R2.3 [C-]#[N+]CCc1csc2ccccc12 Amb33313007 [1,1,0,0,0,0|1,0,1]=4 1181 B14R2.7 CCCC1CNc2c(Br)cccc21 Amb26315297 [1,1,0,0,0,0|0,0,2]=4 1182 B14R2.7 CCCC1CNc2c(C)cccc21 Amb25836520 [1,1,0,0,0,0|0,0,2]=4 1183 B14R2.7 CCCC1CNc2c(Cl)cccc21 Amb26918346 [1,1,0,0,0,0|0,0,2]=4 1184 B14R2.7 CCCC1CNc2c(F)cccc21 Amb25062730 [1,1,0,0,0,0|0,0,2]=4 1185 B14R2.7 CCCC1CNc2c(N)cccc21 Amb32658301 [1,1,0,0,0,0|0,0,2]=4 1186 B14R2.7 CCCc1cnc2c(Br)cccn12 Amb32645131 [1,1,0,0,0,0|1,0,1]=4 1187 B14R2.7 CCCn1ccc2c(Cl)cccc21 Amb27760231 [1,1,0,0,0,0|2,0,0]=4 1188 B14R2.7 CCCn1ccc2c(N)cccc21 Amb25998588 [1,1,0,0,0,0|2,0,0]=4 1189 B14R2.7 CCCn1cnc2c(F)cccc21 Amb30021079 [1,1,0,0,0,0|1,0,1]=4 1190 B14R2.7 CNCc1coc2c(O)cccc12 Amb27220455 [1,1,0,0,0,0|2,0,0]=4 1191 B14R2.7 CNCc1csc2c(Br)cccc12 Amb27791361 [1,1,0,0,0,0|2,0,0]=4 1192 B14R2.7 CSCc1csc2c(C)cccc12 Amb27459699 [1,1,0,0,0,0|2,0,0]=4 1193 B14R2.7 Cc1cccc2c(CCN)coc12 Amb18252258 [1,1,0,0,0,0|1,0,0]=3 1194 B14R2.7 Cc1cccc2c(CCN)csc12 Amb24076700 [1,1,0,0,0,0|1,0,0]=3 1195 B14R2.7 Cc1cccc2c(CCO)coc12 Amb25180284 [1,1,0,0,0,0|2,0,0]=4 1196 B14R2.7 Cc1cccc2c1NCC2CCN Amb18063032 [1,1,0,0,0,0|0,0,2]=4 1197 B14R2.7 Cc1cccc2c1ccn2CCN Amb33756730 [1,1,0,0,0,0|2,0,0]=4 1198 B14R2.7 Cc1cccc2c1ccn2CCN Amb8853493 [1,1,0,0,0,0|2,0,0]=4 1199 B14R2.7 Cc1cccn2c(CCN)cnc12 Amb17115541 [1,1,0,0,0,0|1,0,1]=4 1200 B14R2.7 NCCC1=CCc2c(F)cccc21 Amb27959034 [1,1,0,0,0,0|1,0,0]=3 1201 B14R2.7 NCCC1CNc2c(Br)cccc21 Amb18560692 [1,1,0,0,0,0|0,0,2]=4 1202 B14R2.7 NCCC1CNc2c(Cl)cccc21 Amb18063017 [1,1,0,0,0,0|0,0,2]=4 1203 B14R2.7 NCCC1CNc2c(F)cccc21 Amb18063036 [1,1,0,0,0,0|0,0,2]=4 1204 B14R2.7 NCCc1cnc2c(Br)cccn12 Amb17225200 [1,1,0,0,0,0|1,0,1]=4 1205 B14R2.7 NCCc1cnc2c(F)cccn12 Amb18264267 [1,1,0,0,0,0|1,0,1]=4 1206 B14R2.7 NCCc1coc2c(Cl)cccc12 Amb18253195 [1,1,0,0,0,0|1,0,0]=3 1207 B14R2.7 NCCc1csc2c(Br)cccc12 Amb27809805 [1,1,0,0,0,0|1,0,0]=3 1208 B14R2.7 NCCc1csc2c(Cl)cccc12 Amb28194375 [1,1,0,0,0,0|1,0,0]=3 1209 B14R2.7 NCCc1noc2c(F)cccc12 Amb27777601 [1,1,0,0,0,0|2,0,0]=4 1210 B14R2.7 NCCn1ccc2c(Br)cccc21 Amb25256179 [1,1,0,0,0,0|2,0,0]=4 1211 B14R2.7 NCCn1ccc2c(Cl)cccc21 Amb18910758 [1,1,0,0,0,0|2,0,0]=4 1212 B14R2.7 NCCn1ccc2c(F)cccc21 Amb27402290 [1,1,0,0,0,0|2,0,0]=4 1213 B14R2.7 OCCc1coc2c(Br)cccc12 Amb25761941 [1,1,0,0,0,0|2,0,0]=4 1214 B14R2.7 OCCc1coc2c(Cl)cccc12 Amb27610208 [1,1,0,0,0,0|2,0,0]=4 1215 B14R2.7 OCCc1coc2c(F)cccc12 Amb27762913 [1,1,0,0,0,0|2,0,0]=4 1216 B14R2.95 C=C(CN)c1csc2ccccc12 Amb33312682 [1,1,0,0,0,0|1,0,1]=4 1217 B14R2.95 CC(CBr)c1csc2ccccc12 Amb33386530 [1,1,0,0,0,0|2,0,0]=4 1218 B14R2.95 CC(CN)c1cnc2ccccn12 Amb17115548 [1,1,0,0,0,0|1,0,1]=4 1219 B14R2.95 CC(CN)c1cnn2ccccc12 Amb33149376 [1,1,0,0,0,0|1,0,1]=4 1220 B14R2.95 CC(CN)c1coc2ccccc12 Amb35583423 [1,1,0,0,0,0|1,0,0]=3 1221 B14R2.95 CC(CN)c1csc2ccccc12 Amb33313049 [1,1,0,0,0,0|1,0,0]=3 1222 B14R2.95 CC(CN)n1ccc2ccccc21 Amb17480899 [1,1,0,0,0,0|2,0,0]=4 1223 B14R2.95 CC(NN)c1coc2ccccc12 Amb28346251 [1,1,0,0,0,0|2,0,0]=4 1224 B14R2.95 CC(ON)c1csc2ccccc12 Amb33312734 [1,1,0,0,0,0|2,0,0]=4 1225 B14R2.95 CCC(=O)c1coc2ccccc12 Amb25086526 [1,1,0,0,0,0|1,0,1]=4 1226 B14R2.95 CCC(=O)c1csc2ccccc12 Amb9212755 [1,1,0,0,0,0|1,0,1]=4 1227 B14R2.95 CCC(Br)c1csc2ccccc12 Amb27833133 [1,1,0,0,0,0|1,0,0]=3 1228 B14R2.95 CCC(C)n1cnc2ccccc21 Amb2502174 [1,1,0,0,0,0|1,0,1]=4 1229 B14R2.95 CCC(Cl)c1coc2ccccc12 Amb35704190 [1,1,0,0,0,0|1,0,0]=3 1230 B14R2.95 CCC(N)c1cnc2ccccn12 Amb17112794 [1,1,0,0,0,0|1,0,1]=4 1231 B14R2.95 CCC(N)c1cnn2ccccc12 Amb27756828 [1,1,0,0,0,0|1,0,1]=4 1232 B14R2.95 CCC(O)C1CNc2ccccc21 Amb35622375 [1,1,0,0,0,0|0,0,2]=4 1233 B14R2.95 CCC(O)c1cnc2ccccn12 Amb17115483 [1,1,0,0,0,0|1,0,1]=4 1234 B14R2.95 CC[C@@H](O)c1coc2ccccc12 Amb27634735 [1,1,0,0,0,0|1,0,0]=3 1235 B14R2.95 CC[C@H](O)c1coc2ccccc12 Amb27590084 [1,1,0,0,0,0|1,0,0]=3 1236 B14R2.95 CNC(C)c1csc2ccccc12 Amb9345784 [1,1,0,0,0,0|2,0,0]=4 1237 B14R2.95 C[C@H](CO)C1=CCc2ccccc21 Amb28350278 [1,1,0,0,0,0|2,0,0]=4 1238 B14R2.95 C[C@H](CO)c1csc2ccccc12 Amb27255203 [1,1,0,0,0,0|2,0,0]=4 1239 B14R2.95 NC(CO)c1coc2ccccc12 Amb28316514 [1,1,0,0,0,0|2,0,0]=4 1240 B14R2.95 NC(CO)c1csc2ccccc12 Amb18963399 [1,1,0,0,0,0|2,0,0]=4 1241 B14R2.95 NCC(=O)c1coc2ccccc12 Amb18197463 [1,1,0,0,0,0|1,0,1]=4 1242 B14R2.95 NCC(=O)c1csc2ccccc12 Amb18910163 [1,1,0,0,0,0|1,0,1]=4 1243 B14R2.95 NCC(F)c1cnc2ccccn12 Amb26961962 [1,1,0,0,0,0|1,0,1]=4 1244 B14R2.95 NCC(F)c1cnn2ccccc12 Amb33148707 [1,1,0,0,0,0|1,0,1]=4 1245 B14R2.95 NCC(F)c1coc2ccccc12 Amb30013820 [1,1,0,0,0,0|1,0,0]=3 1246 B14R2.95 NCC(F)c1csc2ccccc12 Amb32953977 [1,1,0,0,0,0|1,0,0]=3 1247 B14R2.95 NCC(N)c1csc2ccccc12 Amb18286967 [1,1,0,0,0,0|1,0,0]=3 1248 B14R2.95 NCC(O)c1cnc2ccccn12 Amb18196101 [1,1,0,0,0,0|1,0,1]=4 1249 B14R2.95 NCC(O)c1cnn2ccccc12 Amb24414140 [1,1,0,0,0,0|1,0,1]=4 1250 B14R2.95 NCC(O)c1coc2ccccc12 Amb25204806 [1,1,0,0,0,0|1,0,0]=3 1251 B14R2.95 NCC(O)c1csc2ccccc12 Amb18286956 [1,1,0,0,0,0|1,0,0]=3 1252 B14R2.95 NCC(O)c1csc2ccccc12 Amb33743684 [1,1,0,0,0,0|1,0,0]=3 1253 B14R2.95 NCC(O)c1occ2ccccc12 Amb27946748 [1,1,0,0,0,0|2,0,0]=4 1254 B14R2.95 NC[C@@H](N)c1coc2ccccc12 Amb27259126 [1,1,0,0,0,0|1,0,0]=3 1255 B14R2.95 NC[C@@H](O)c1cnc2ccccn12 Amb33274378 [1,1,0,0,0,0|1,0,1]=4 1256 B14R2.95 NC[C@@H](O)c1cnn2ccccc12 Amb33147888 [1,1,0,0,0,0|1,0,1]=4 1257 B14R2.95 NC[C@@H](O)c1csc2ccccc12 Amb33313002 [1,1,0,0,0,0|1,0,0]=3 1258 B14R2.95 NC[C@H](O)c1cnc2ccccn12 Amb33274379 [1,1,0,0,0,0|1,0,1]=4 1259 B14R2.95 NC[C@H](O)c1cnn2ccccc12 Amb33147889 [1,1,0,0,0,0|1,0,1]=4 1260 B14R2.95 NC[C@H](O)c1csc2ccccc12 Amb33313003 [1,1,0,0,0,0|1,0,0]=3 1261 B14R2.95 N[C@@H](CO)c1csc2ccccc12 Amb27873960 [1,1,0,0,0,0|2,0,0]=4 1262 B14R2.95 N[C@H](CO)c1csc2ccccc12 Amb28043058 [1,1,0,0,0,0|2,0,0]=4 1263 B14R2.95 OC(CBr)c1csc2ccccc12 Amb33450566 [1,1,0,0,0,0|2,0,0]=4 1264 B14R2.95 OC(CCl)c1csc2ccccc12 Amb33259626 [1,1,0,0,0,0|2,0,0]=4 1265 B14R2.95 OC(CF)c1csc2ccccc12 Amb33312697 [1,1,0,0,0,0|2,0,0]=4 1266 B14R2.95 OCC(O)c1csc2ccccc12 Amb27786846 [1,1,0,0,0,0|2,0,0]=4 1267 B14R2.95 OC[C@H](O)c1csc2ccccc12 Amb28321272 [1,1,0,0,0,0|2,0,0]=4 1268 B14R2.467 CCCc1coc2cc(O)ccc12 Amb28199838 [1,1,0,0,0,0|1,0,0]=3 1269 B14R2.467 CCCc1noc2cc(O)ccc12 Amb18127884 [1,1,0,0,0,0|2,0,0]=4 1270 B14R2.467 CCCn1ccc2cc(N)ccc21 Amb13951334 [1,1,0,0,0,0|2,0,0]=4 1271 B14R2.467 CCCn1ccc2cc(N)ccc21 Amb8855660 [1,1,0,0,0,0|2,0,0]=4 1272 B14R2.467 CCCn1cnc2cc(Br)ccc21 Amb20075761 [1,1,0,0,0,0|1,0,1]=4 1273 B14R2.467 CCCn1cnc2cc(Br)ccc21 Amb27644735 [1,1,0,0,0,0|1,0,1]=4 1274 B14R2.467 CCCn1cnc2cc(C)ccc21 Amb30021073 [1,1,0,0,0,0|1,0,1]=4 1275 B14R2.467 CCCn1cnc2cc(Cl)ccc21 Amb30021086 [1,1,0,0,0,0|1,0,1]=4 1276 B14R2.467 CCCn1cnc2cc(F)ccc21 Amb30021081 [1,1,0,0,0,0|1,0,1]=4 1277 B14R2.467 CCCn1cnc2cc(N)ccc21 Amb17622110 [1,1,0,0,0,0|1,0,1]=4 1278 B14R2.467 CCCn1cnc2cc(N)ccc21 Amb7089083 [1,1,0,0,0,0|1,0,1]=4 1279 B14R2.467 CNCc1coc2cc(Cl)ccc12 Amb27426557 [1,1,0,0,0,0|2,0,0]=4 1280 B14R2.467 Cc1ccc2c(CCN)coc2c1 Amb9768238 [1,1,0,0,0,0|1,0,0]=3 1281 B14R2.467 Cc1ccc2c(CCO)coc2c1 Amb28141903 [1,1,0,0,0,0|2,0,0]=4 1282 B14R2.467 Cc1ccc2c(c1)ncn2CCN Amb28123517 [1,1,0,0,0,0|1,0,1]=4 1283 B14R2.467 Cc1ccc2c(ccn2CCN)c1 Amb18243602 [1,1,0,0,0,0|2,0,0]=4 1284 B14R2.467 Cc1ccc2c(ccn2CCN)c1 Amb22742748 [1,1,0,0,0,0|2,0,0]=4 1285 B14R2.467 Cc1ccn2c(CCN)cnc2c1 Amb8009661 [1,1,0,0,0,0|1,0,1]=4 1286 B14R2.467 Fc1ccc2c(c1)CC=C2CCCl Amb27170718 [1,1,0,0,0,0|2,0,0]=4 1287 B14R2.467 NCCC1CNc2cc(Br)ccc21 Amb18063027 [1,1,0,0,0,0|0,0,2]=4 1288 B14R2.467 NCCC1CNc2cc(Cl)ccc21 Amb18063026 [1,1,0,0,0,0|0,0,2]=4 1289 B14R2.467 NCCC1CNc2cc(F)ccc21 Amb18561073 [1,1,0,0,0,0|0,0,2]=4 1290 B14R2.467 NCCc1cnc2cc(Cl)ccn12 Amb18624902 [1,1,0,0,0,0|1,0,1]=4 1291 B14R2.467 NCCc1coc2cc(Cl)ccc12 Amb28047342 [1,1,0,0,0,0|1,0,0]=3 1292 B14R2.467 NCCc1coc2cc(F)ccc12 Amb18194742 [1,1,0,0,0,0|1,0,0]=3 1293 B14R2.467 NCCc1coc2cc(I)ccc12 Amb27467466 [1,1,0,0,0,0|1,0,0]=3 1294 B14R2.467 NCCc1coc2cc(I)ccc12 Amb27867238 [1,1,0,0,0,0|1,0,0]=3 1295 B14R2.467 NCCc1csc2cc(O)ccc12 Amb27782242 [1,1,0,0,0,0|1,0,0]=3 1296 B14R2.467 NCCc1noc2cc(F)ccc12 Amb25178487 [1,1,0,0,0,0|2,0,0]=4 1297 B14R2.467 NCCc1noc2cc(F)ccc12 Amb35750225 [1,1,0,0,0,0|2,0,0]=4 1298 B14R2.467 NCCn1ccc2cc(Br)ccc21 Amb18962463 [1,1,0,0,0,0|2,0,0]=4 1299 B14R2.467 NCCn1ccc2cc(Cl)ccc21 Amb18894469 [1,1,0,0,0,0|2,0,0]=4 1300 B14R2.467 NCCn1ccc2cc(F)ccc21 Amb18243722 [1,1,0,0,0,0|2,0,0]=4 1301 B14R2.467 NCCn1cnc2cc(Cl)ccc21 Amb21895540 [1,1,0,0,0,0|1,0,1]=4 1302 B14R2.467 NCCn1cnc2cc(Cl)ccc21 Amb2792654 [1,1,0,0,0,0|1,0,1]=4 1303 B14R2.467 Oc1ccc2c(CCBr)coc2c1 Amb25844950 [1,1,0,0,0,0|2,0,0]=4 1304 B14R2.510 C#CCc1cn(C)c2ccccc12 Amb33319514 [1,1,0,0,0,0|0,0,2]=4 1305 B14R2.510 C=CCc1cn(C)c2ccccc12 Amb27795216 [1,1,0,0,0,0|0,0,2]=4 1306 B14R2.510 CCNc1cn(C)c2ccccc12 Amb27946726 [1,1,0,0,0,0|1,0,0]=3 1307 B14R2.510 CCOc1nn(C)c2ccccc12 Amb23560579 [1,1,0,0,0,0|2,0,0]=4 1308 B14R2.510 CCSc1cn(C)c2ccccc12 Amb27777517 [1,1,0,0,0,0|1,0,0]=3 1309 B14R2.510 CN1CC(CCN)c2ccccc21 Amb13881745 [1,1,0,0,0,0|0,0,2]=4 1310 B14R2.510 CNCc1cn(C)c2ccccc12 Amb18564020 [1,1,0,0,0,0|1,0,0]=3 1311 B14R2.510 CNCc1cn(C)c2ccccc12 Amb21969139 [1,1,0,0,0,0|1,0,0]=3 1312 B14R2.510 CNCc1cn(C)c2ncccc12 Amb26844487 [1,1,0,0,0,0|2,0,0]=4 1313 B14R2.510 CNCc1cn(C)c2ncccc12 Amb33755416 [1,1,0,0,0,0|2,0,0]=4 1314 B14R2.510 CNCc1nn(C)c2ccccc12 Amb2723104 [1,1,0,0,0,0|2,0,0]=4 1315 B14R2.510 COCc1cn(C)c2ccccc12 Amb28286815 [1,1,0,0,0,0|1,0,0]=3 1316 B14R2.510 Cc1cn(CCN)c2ccccc12 Amb8949877 [1,1,0,0,0,0|2,0,0]=4 1317 B14R2.510 Cn1cc(CC#N)c2ccccc21 Amb8629506 [1,1,0,0,0,0|0,0,2]=4 1318 B14R2.510 Cn1cc(CCBr)c2ccccc21 Amb18869001 [1,1,0,0,0,0|1,0,0]=3 1319 B14R2.510 Cn1cc(CCBr)c2cccnc21 Amb33432202 [1,1,0,0,0,0|2,0,0]=4 1320 B14R2.510 Cn1cc(CCCl)c2ccccc21 Amb18863875 [1,1,0,0,0,0|1,0,0]=3 1321 B14R2.510 Cn1cc(CCI)c2ccccc21 Amb27621601 [1,1,0,0,0,0|1,0,0]=3 1322 B14R2.510 Cn1cc(CCN)c2ccccc21 Amb23399594 [1,1,0,0,0,0|0,0,0]=2 1323 B14R2.510 Cn1cc(CCN)c2ccccc21 Amb2610709 [1,1,0,0,0,0|0,0,0]=2 1324 B14R2.510 Cn1cc(CCN)c2ccccc21 Amb8631325 [1,1,0,0,0,0|0,0,0]=2 1325 B14R2.510 Cn1cc(CCN)c2cccnc21 Amb13885054 [1,1,0,0,0,0|1,0,0]=3 1326 B14R2.510 Cn1cc(CCN)c2cccnc21 Amb32671200 [1,1,0,0,0,0|1,0,0]=3 1327 B14R2.510 Cn1cc(CCO)c2ccccc21 Amb7088957 [1,1,0,0,0,0|1,0,0]=3 1328 B14R2.510 Cn1cc(CCO)c2cccnc21 Amb32880445 [1,1,0,0,0,0|2,0,0]=4 1329 B14R2.510 Cn1cc(CCS)c2ccccc21 Amb18066266 [1,1,0,0,0,0|1,0,0]=3 1330 B14R2.510 Cn1cc(CCS)c2cccnc21 Amb32878648 [1,1,0,0,0,0|2,0,0]=4 1331 B14R2.510 Cn1cc(CNN)c2ccccc21 Amb24553076 [1,1,0,0,0,0|1,0,0]=3 1332 B14R2.510 Cn1cc(CNN)c2cccnc21 Amb19664702 [1,1,0,0,0,0|2,0,0]=4 1333 B14R2.510 Cn1cc(CNO)c2ccccc21 Amb26846848 [1,1,0,0,0,0|2,0,0]=4 1334 B14R2.510 Cn1cc(CON)c2ccccc21 Amb25198311 [1,1,0,0,0,0|1,0,0]=3 1335 B14R2.510 Cn1cc(CON)c2cccnc21 Amb32880070 [1,1,0,0,0,0|2,0,0]=4 1336 B14R2.510 Cn1nc(CCBr)c2ccccc21 Amb24549428 [1,1,0,0,0,0|2,0,0]=4 1337 B14R2.510 Cn1nc(CCN)c2ccccc21 Amb33549434 [1,1,0,0,0,0|1,0,0]=3 1338 B14R2.510 Cn1nc(CCO)c2ccccc21 Amb28383727 [1,1,0,0,0,0|2,0,0]=4 1339 B14R2.510 Cn1nc(CCS)c2ccccc21 Amb33196024 [1,1,0,0,0,0|2,0,0]=4 1340 B14R2.510 Cn1nc(CNN)c2ccccc21 Amb24676936 [1,1,0,0,0,0|2,0,0]=4 1341 B14R2.510 Cn1nc(CON)c2ccccc21 Amb26483184 [1,1,0,0,0,0|2,0,0]=4 1342 B14R2.510 NCCn1cc(Br)c2ccccc21 Amb18287524 [1,1,0,0,0,0|2,0,0]=4 1343 B14R2.510 NCCn1cc(Cl)c2ccccc21 Amb18287525 [1,1,0,0,0,0|2,0,0]=4 1344 B14R2.510 [C-]#[N+]Cc1cn(C)c2ccccc12 Amb33319831 [1,1,0,0,0,0|1,0,1]=4 1345 B14R2.517 CCCC1C(=O)Nc2ccccc21 Amb17233120 [1,1,0,0,0,0|0,0,1]=3 1346 B14R2.517 CCCN1C(=O)Nc2ccccc21 Amb18034258 [1,1,0,0,0,0|1,0,0]=3 1347 B14R2.517 CCCN1C(=S)Nc2ccccc21 Amb19815963 [1,1,0,0,0,0|1,0,0]=3 1348 B14R2.517 CCC[n+]1c(C)sc2ccccc21 Amb4020176 [1,1,0,0,0,0|2,0,0]=4 1349 B14R2.517 CCCc1c(C)cc2ccccn12 Amb27264631 [1,1,0,0,0,0|2,0,0]=4 1350 B14R2.517 CCCc1c(C)nc2ccccn12 Amb27634972 [1,1,0,0,0,0|1,0,1]=4 1351 B14R2.517 CCCn1c(=O)oc2ccccc21 Amb2834242 [1,1,0,0,0,0|2,0,0]=4 1352 B14R2.517 CCCn1c(=O)sc2ccccc21 Amb2916332 [1,1,0,0,0,0|2,0,0]=4 1353 B14R2.517 CCCn1c(=S)oc2ccccc21 Amb2612905 [1,1,0,0,0,0|2,0,0]=4 1354 B14R2.517 CCCn1c(N)nc2ccccc21 Amb6335932 [1,1,0,0,0,0|1,0,1]=4 1355 B14R2.517 CCCn1c(S)nc2ccccc21 Amb2370410 [1,1,0,0,0,0|1,0,1]=4 1356 B14R2.517 CCNN1C(=O)Nc2ccccc21 Amb27964493 [1,1,0,0,0,0|2,0,0]=4 1357 B14R2.517 CCOc1c(Br)oc2ccccc12 Amb27633626 [1,1,0,0,0,0|2,0,0]=4 1358 B14R2.517 CC\C=C1\C(=O)Nc2ccccc21 Amb27970958 [1,1,0,0,0,0|0,0,1]=3 1359 B14R2.517 CC\N=C1\C(=O)Nc2ccccc21 Amb25995413 [1,1,0,0,0,0|1,0,0]=3 1360 B14R2.517 CNCC1C(=O)Nc2ccccc21 Amb28044155 [1,1,0,0,0,0|1,0,1]=4 1361 B14R2.517 CNCc1c(C)oc2ccccc12 Amb25689631 [1,1,0,0,0,0|2,0,0]=4 1362 B14R2.517 CNCc1c(C)oc2ccccc12 Amb33156927 [1,1,0,0,0,0|2,0,0]=4 1363 B14R2.517 CNCc1c(Cl)oc2ccccc12 Amb24492009 [1,1,0,0,0,0|2,0,0]=4 1364 B14R2.517 CN\C=C1/C(=O)Nc2ccccc21 Amb28255618 [1,1,0,0,0,0|1,0,1]=4 1365 B14R2.517 CN\C=C1\C(=O)Nc2ccccc21 Amb27880892 [1,1,0,0,0,0|1,0,1]=4 1366 B14R2.517 CO\C=C1\C(=O)Nc2ccccc21 Amb4007687 [1,1,0,0,0,0|1,0,1]=4 1367 B14R2.517 CO\N=C1\C(=O)Nc2ccccc21 Amb25235523 [1,1,0,0,0,0|2,0,0]=4 1368 B14R2.517 CSCc1c(C)sc2ccccc12 Amb27200108 [1,1,0,0,0,0|2,0,0]=4 1369 B14R2.517 CS\C=C1\C(=O)Nc2ccccc21 Amb26388687 [1,1,0,0,0,0|1,0,1]=4 1370 B14R2.517 Cc1cc2ccccc2n1CCN Amb11012592 [1,1,0,0,0,0|2,0,0]=4 1371 B14R2.517 Cc1cc2ccccc2n1CCN Amb1291614 [1,1,0,0,0,0|2,0,0]=4 1372 B14R2.517 Cc1cc2ccccc2n1CCN Amb33756724 [1,1,0,0,0,0|2,0,0]=4 1373 B14R2.517 Cc1cc2ccccn2c1CCN Amb18560935 [1,1,0,0,0,0|2,0,0]=4 1374 B14R2.517 Cc1nc2ccccc2n1CCN Amb10609499 [1,1,0,0,0,0|1,0,1]=4 1375 B14R2.517 Cc1nc2ccccc2n1CCN Amb2371194 [1,1,0,0,0,0|1,0,1]=4 1376 B14R2.517 Cc1nc2ccccc2n1CCN Amb45070 [1,1,0,0,0,0|1,0,1]=4 1377 B14R2.517 Cc1nc2ccccn2c1CCN Amb5734983 [1,1,0,0,0,0|1,0,1]=4 1378 B14R2.517 Cc1nn2ccccc2c1CCN Amb18224492 [1,1,0,0,0,0|1,0,1]=4 1379 B14R2.517 Cc1oc2ccccc2c1CCN Amb25187809 [1,1,0,0,0,0|1,0,0]=3 1380 B14R2.517 Cc1oc2ccccc2c1CCN Amb33307172 [1,1,0,0,0,0|1,0,0]=3 1381 B14R2.517 Cc1sc2ccccc2c1CCN Amb27209653 [1,1,0,0,0,0|1,0,0]=3 1382 B14R2.517 Clc1oc2ccccc2c1CCBr Amb33433619 [1,1,0,0,0,0|2,0,0]=4 1383 B14R2.517 Cn1nc2ccccc2c1CCN Amb33312483 [1,1,0,0,0,0|1,0,1]=4 1384 B14R2.517 NCCC1C(=O)Nc2ccccc21 Amb9703504 [1,1,0,0,0,0|0,0,1]=3 1385 B14R2.517 NCCN1C(=O)Cc2ccccc21 Amb6243979 [1,1,0,0,0,0|2,0,0]=4 1386 B14R2.517 NCCN1C(=O)Nc2ccccc21 Amb18010617 [1,1,0,0,0,0|1,0,0]=3 1387 B14R2.517 NCCN1C(=O)Nc2ccccc21 Amb20622563 [1,1,0,0,0,0|1,0,0]=3 1388 B14R2.517 NCCN1C(=O)Nc2cccnc21 Amb18254720 [1,1,0,0,0,0|2,0,0]=4 1389 B14R2.517 NCCN1C(=O)Nc2ncccc21 Amb32418910 [1,1,0,0,0,0|2,0,0]=4 1390 B14R2.517 NCCN1C(=O)Oc2ccccc21 Amb18532136 [1,1,0,0,0,0|2,0,0]=4 1391 B14R2.517 NCCN1C(=O)Oc2ccccc21 Amb19373315 [1,1,0,0,0,0|2,0,0]=4 1392 B14R2.517 NCCc1c(Cl)nc2ccccn12 Amb27755471 [1,1,0,0,0,0|1,0,1]=4 1393 B14R2.517 NCCn1c(Br)nc2ccccc21 Amb27463561 [1,1,0,0,0,0|1,0,1]=4 1394 B14R2.517 NCCn1c(N)nc2ccccc21 Amb22011792 [1,1,0,0,0,0|1,0,1]=4 1395 B14R2.517 O=C1Nc2ccccc2C1CCO Amb6316168 [1,1,0,0,0,0|1,0,1]=4 1396 B14R2.517 O=C1Nc2ccccc2N1CCBr Amb26486893 [1,1,0,0,0,0|2,0,0]=4 1397 B14R2.517 O=C1Nc2ccccc2N1CCO Amb19132609 [1,1,0,0,0,0|2,0,0]=4 1398 B14R2.517 [NH3+]CCC1C(=O)Nc2ccccc21 Amb4282925 [1,1,0,0,0,0|0,0,2]=4 1399 B14R2.6368 CCCn1ccc2cccc(N)c21 Amb27597273 [1,1,0,0,0,0|2,0,0]=4 1400 B14R2.6368 CCCn1cnc2cccc(Br)c21 Amb32708829 [1,1,0,0,0,0|1,0,1]=4 1401 B14R2.6368 CCCn1cnc2cccc(Cl)c21 Amb30021087 [1,1,0,0,0,0|1,0,1]=4 1402 B14R2.6368 Cc1cccc2ccc(CCN)n12 Amb18197545 [1,1,0,0,0,0|2,0,0]=4 1403 B14R2.6368 Cc1cccc2ccn(CCN)c12 Amb18243603 [1,1,0,0,0,0|2,0,0]=4 1404 B14R2.6368 NCCc1cnc2cccc(Br)n12 Amb17225208 [1,1,0,0,0,0|1,0,1]=4 1405 B14R2.6368 NCCc1cnc2cccc(F)n12 Amb28249770 [1,1,0,0,0,0|1,0,1]=4 1406 B14R2.6368 NCCc1coc2cccc(F)c12 Amb27950959 [1,1,0,0,0,0|1,0,0]=3 1407 B14R2.6368 NCCn1ccc2cccc(Br)c21 Amb18246591 [1,1,0,0,0,0|2,0,0]=4 1408 B14R2.6368 NCCn1ccc2cccc(Cl)c21 Amb18894470 [1,1,0,0,0,0|2,0,0]=4 1409 B14R2.6368 NCCn1ccc2cccc(F)c21 Amb18243723 [1,1,0,0,0,0|2,0,0]=4 1410 B14R2.6419 CCCC1CNc2ccc(Br)cc21 Amb26350506 [1,1,0,0,0,0|0,0,2]=4 1411 B14R2.6419 CCCC1CNc2ccc(C)cc21 Amb26859593 [1,1,0,0,0,0|0,0,2]=4 1412 B14R2.6419 CCCC1CNc2ccc(Cl)cc21 Amb25131406 [1,1,0,0,0,0|0,0,2]=4 1413 B14R2.6419 CCCC1CNc2ccc(F)cc21 Amb24556295 [1,1,0,0,0,0|0,0,2]=4 1414 B14R2.6419 CCCC1CNc2ccc(N)cc21 Amb32658293 [1,1,0,0,0,0|0,0,2]=4 1415 B14R2.6419 CCCC1CNc2ccc(O)cc21 Amb32658311 [1,1,0,0,0,0|0,0,2]=4 1416 B14R2.6419 CCCc1ccc2ccc(C)cn12 Amb27670060 [1,1,0,0,0,0|2,0,0]=4 1417 B14R2.6419 CCCn1ccc2ccc(N)cc21 Amb8941149 [1,1,0,0,0,0|2,0,0]=4 1418 B14R2.6419 CCCn1cnc2ccc(Br)cc21 Amb32708780 [1,1,0,0,0,0|1,0,1]=4 1419 B14R2.6419 CCCn1cnc2ccc(Cl)cc21 Amb30021090 [1,1,0,0,0,0|1,0,1]=4 1420 B14R2.6419 CCCn1cnc2ccc(F)cc21 Amb30021077 [1,1,0,0,0,0|1,0,1]=4 1421 B14R2.6419 CCCn1cnc2ccc(N)cc21 Amb23114105 [1,1,0,0,0,0|1,0,1]=4 1422 B14R2.6419 CNCc1coc2ccc(Br)cc12 Amb27480629 [1,1,0,0,0,0|2,0,0]=4 1423 B14R2.6419 Cc1ccc2c(c1)C(CCN)CN2 Amb18560683 [1,1,0,0,0,0|0,0,2]=4 1424 B14R2.6419 Cc1ccc2ccn(CCN)c2c1 Amb8853498 [1,1,0,0,0,0|2,0,0]=4 1425 B14R2.6419 Cc1ccc2ncc(CCN)n2c1 Amb17115540 [1,1,0,0,0,0|1,0,1]=4 1426 B14R2.6419 Cc1ccc2occ(CCN)c2c1 Amb18197164 [1,1,0,0,0,0|1,0,0]=3 1427 B14R2.6419 Cc1ccc2occ(CCO)c2c1 Amb28429707 [1,1,0,0,0,0|2,0,0]=4 1428 B14R2.6419 Cc1ccc2onc(CCN)c2c1 Amb18909015 [1,1,0,0,0,0|2,0,0]=4 1429 B14R2.6419 Cc1ccc2scc(CCN)c2c1 Amb18650973 [1,1,0,0,0,0|1,0,0]=3 1430 B14R2.6419 Clc1ccc2scc(CCI)c2c1 Amb27971103 [1,1,0,0,0,0|2,0,0]=4 1431 B14R2.6419 NCCC1C=Nc2ccc(O)cc21 Amb27647622 [1,1,0,0,0,0|0,0,2]=4 1432 B14R2.6419 NCCC1CNc2ccc(Br)cc21 Amb18560689 [1,1,0,0,0,0|0,0,2]=4 1433 B14R2.6419 NCCC1CNc2ccc(Cl)cc21 Amb18560688 [1,1,0,0,0,0|0,0,2]=4 1434 B14R2.6419 NCCC1CNc2ccc(F)cc21 Amb18560687 [1,1,0,0,0,0|0,0,2]=4 1435 B14R2.6419 NCCC1CNc2ccc(O)cc21 Amb27400672 [1,1,0,0,0,0|0,0,2]=4 1436 B14R2.6419 NCCc1cnc2ccc(Br)cn12 Amb17115543 [1,1,0,0,0,0|1,0,1]=4 1437 B14R2.6419 NCCc1cnc2ccc(Cl)cn12 Amb17115542 [1,1,0,0,0,0|1,0,1]=4 1438 B14R2.6419 NCCc1cnc2ccc(F)cn12 Amb17225211 [1,1,0,0,0,0|1,0,1]=4 1439 B14R2.6419 NCCc1coc2ccc(Cl)cc12 Amb18910888 [1,1,0,0,0,0|1,0,0]=3 1440 B14R2.6419 NCCc1coc2ccc(Cl)cc12 Amb30594007 [1,1,0,0,0,0|1,0,0]=3 1441 B14R2.6419 NCCc1coc2ccc(F)cc12 Amb18909090 [1,1,0,0,0,0|1,0,0]=3 1442 B14R2.6419 NCCc1coc2ccc(I)cc12 Amb27757822 [1,1,0,0,0,0|1,0,0]=3 1443 B14R2.6419 NCCc1coc2ccc(O)cc12 Amb25674734 [1,1,0,0,0,0|1,0,0]=3 1444 B14R2.6419 NCCc1csc2ccc(Br)cc12 Amb19958512 [1,1,0,0,0,0|1,0,0]=3 1445 B14R2.6419 NCCc1csc2ccc(Br)cc12 Amb22490913 [1,1,0,0,0,0|1,0,0]=3 1446 B14R2.6419 NCCc1csc2ccc(Cl)cc12 Amb20622925 [1,1,0,0,0,0|1,0,0]=3 1447 B14R2.6419 NCCc1csc2ccc(Cl)cc12 Amb2657933 [1,1,0,0,0,0|1,0,0]=3 1448 B14R2.6419 NCCc1csc2ccc(F)cc12 Amb24076694 [1,1,0,0,0,0|1,0,0]=3 1449 B14R2.6419 NCCc1noc2ccc(Br)cc12 Amb25929928 [1,1,0,0,0,0|2,0,0]=4 1450 B14R2.6419 NCCc1noc2ccc(F)cc12 Amb28343113 [1,1,0,0,0,0|2,0,0]=4 1451 B14R2.6419 NCCn1ccc2ccc(Br)cc21 Amb18962520 [1,1,0,0,0,0|2,0,0]=4 1452 B14R2.6419 NCCn1ccc2ccc(Cl)cc21 Amb18962515 [1,1,0,0,0,0|2,0,0]=4 1453 B14R2.6419 NCCn1ccc2ccc(F)cc21 Amb9214683 [1,1,0,0,0,0|2,0,0]=4 1454 B14R2.6419 NCCn1cnc2ccc(Cl)cc21 Amb27668992 [1,1,0,0,0,0|1,0,1]=4 1455 B14R2.6419 NCCn1cnc2ccc(F)cc21 Amb28400728 [1,1,0,0,0,0|1,0,1]=4 1456 B14R2.6419 NCCn1cnc2ccc(O)cc21 Amb17128370 [1,1,0,0,0,0|1,0,1]=4 1457 B14R2.6419 OCCc1coc2ccc(Br)cc12 Amb27778526 [1,1,0,0,0,0|2,0,0]=4 1458 B14R2.6419 OCCc1coc2ccc(Cl)cc12 Amb26590880 [1,1,0,0,0,0|2,0,0]=4 1459 B14R2.6419 OCCc1coc2ccc(F)cc12 Amb25700888 [1,1,0,0,0,0|2,0,0]=4 1460 B14R2.9718 CCCC1(C)CNc2ccccc21 Amb27393524 [1,1,0,0,0,0|0,0,2]=4 1461 B14R2.286 CC(C)(C)C1=CCc2ccccc21 Amb24117283 [0,1,0,0,1,0|2,0,0]=4 1462 B14R2.286 CC(C)(N)c1cnc2ccccn12 Amb25222244 [0,1,0,0,1,0|1,0,1]=4 1463 B14R2.286 CC(C)(N)c1cnn2ccccc12 Amb25753392 [0,1,0,0,1,0|1,0,1]=4 1464 B14R2.286 CC(C)(N)c1csc2ccccc12 Amb25325205 [0,1,0,0,1,0|1,0,0]=3 1465 B14R2.286 CC(C)(O)c1csc2ccccc12 Amb26658475 [0,1,0,0,1,0|2,0,0]=4 1466 B14R2.300 CC(F)c1coc2cc(N)ccc12 Amb27200385 [0,1,0,0,1,0|2,0,0]=4 1467 B14R2.300 CC(F)c1csc2cc(N)ccc12 Amb27879123 [0,1,0,0,1,0|2,0,0]=4 1468 B14R2.300 CC(N)c1cnc2cc(Cl)ccn12 Amb18106726 [0,1,0,0,1,0|1,0,1]=4 1469 B14R2.300 CC(O)c1coc2cc(Cl)ccc12 Amb27478553 [0,1,0,0,1,0|2,0,0]=4 1470 B14R2.300 Cc1ccn2c(C(C)N)cnc2c1 Amb17112847 [0,1,0,0,1,0|1,0,1]=4 1471 B14R2.642 CC(C)=C1C(=O)Nc2ccccc21 Amb18114948 [0,1,0,0,1,0|1,0,1]=4 1472 B14R2.642 CC(C)C1C(=O)Nc2ccccc21 Amb8447077 [0,1,0,0,1,0|1,0,1]=4 1473 B14R2.642 CC(C)N1C(=O)Nc2ccccc21 Amb18035941 [0,1,0,0,1,0|2,0,0]=4 1474 B14R2.642 CC(Cl)N1C(=O)Nc2ccccc21 Amb24457956 [0,1,0,0,1,0|2,0,0]=4 1475 B14R2.642 CC(N)c1c2ccccc2nn1C Amb27852750 [0,1,0,0,1,0|1,0,1]=4 1476 B14R2.642 C[C@@H](N)c1c2ccccc2nn1C Amb33312090 [0,1,0,0,1,0|1,0,1]=4 1477 B14R2.642 C[C@H](N)c1c2ccccc2nn1C Amb33312089 [0,1,0,0,1,0|1,0,1]=4 1478 B14R2.642 C\C(O)=C1\C(=O)Nc2ccccc21 Amb25200001 [0,1,0,0,1,0|1,0,1]=4 1479 B14R2.642 Cc1nc2ccccn2c1C(C)N Amb17112944 [0,1,0,0,1,0|1,0,1]=4 1480 B14R2.642 Cc1oc2ccccc2c1C(C)O Amb27803497 [0,1,0,0,1,0|2,0,0]=4 1481 B14R2.642 Cc1oc2ccccc2c1[C@@H](C)N Amb27175360 [0,1,0,0,1,0|1,0,0]=3 1482 B14R2.5816 CC(C)c1csc2ccc(Cl)cc12 Amb28386056 [0,1,0,0,1,0|2,0,0]=4 1483 B14R2.5816 CC(F)c1csc2ccc(N)cc12 Amb27201792 [0,1,0,0,1,0|2,0,0]=4 1484 B14R2.5816 CC(N)c1cnc2ccc(Br)cn12 Amb17112901 [0,1,0,0,1,0|1,0,1]=4 1485 B14R2.5816 CC(N)c1cnc2ccc(Cl)cn12 Amb17112883 [0,1,0,0,1,0|1,0,1]=4 1486 B14R2.5816 Cc1ccc2ncc(C(C)N)n2c1 Amb17112829 [0,1,0,0,1,0|1,0,1]=4 1487 B14R2.8032 C[C@@H](N)c1coc2c(F)cccc12 Amb24683894 [0,1,0,0,1,0|1,0,0]=3 1488 B14R2.8032 C[C@@H](N)c1coc2c(F)cccc12 Amb33482914 [0,1,0,0,1,0|1,0,0]=3 1489 B14R2.8032 C[C@@H](O)c1csc2c(Br)cccc12 Amb27858039 [0,1,0,0,1,0|2,0,0]=4 1490 B14R2.8032 C[C@H](N)c1coc2c(F)cccc12 Amb33483213 [0,1,0,0,1,0|1,0,0]=3 1491 B14R2.8032 C[C@H](N)c1coc2c(F)cccc12 Amb33483214 [0,1,0,0,1,0|1,0,0]=3 1492 B14R2.8032 C[C@H](O)c1csc2c(Br)cccc12 Amb28078338 [0,1,0,0,1,0|2,0,0]=4 1493 B14R2.8032 Cc1cccn2c(C(C)N)cnc12 Amb17112865 [0,1,0,0,1,0|1,0,1]=4 1494 B14R2.8053 CC(F)c1coc2cccc(O)c12 Amb27876856 [0,1,0,0,1,0|2,0,0]=4 1495 B14R2.8053 CC(F)c1csc2cccc(N)c12 Amb27842329 [0,1,0,0,1,0|2,0,0]=4 1496 B14R2.8053 CC(F)c1csc2cccc(O)c12 Amb27958771 [0,1,0,0,1,0|2,0,0]=4 1497 B14R2.8053 Cc1cccc2ncc(C(C)N)n12 Amb17112811 [0,1,0,0,1,0|1,0,1]=4 1498 B14R2.25733 CC(=O)c1cn(C)c2ccccc12 Amb33528534 [0,1,0,0,1,0|1,0,1]=4 1499 B14R2.25733 CC(C)c1cn(C)c2ccccc12 Amb27767966 [0,1,0,0,1,0|1,0,0]=3 1500 B14R2.25733 CC(N)c1cn(C)c2ccccc12 Amb21959786 [0,1,0,0,1,0|0,0,0]=2 1501 B14R2.25733 CC(N)c1cn(C)c2ccccc12 Amb7173603 [0,1,0,0,1,0|0,0,0]=2 1502 B14R2.25733 CC(N)c1cn(C)c2ncccc12 Amb32880045 [0,1,0,0,1,0|1,0,0]=3 1503 B14R2.25733 CC(N)c1nn(C)c2ccccc12 Amb24442735 [0,1,0,0,1,0|1,0,0]=3 1504 B14R2.25733 CC(O)c1cn(C)c2ccccc12 Amb27396080 [0,1,0,0,1,0|1,0,0]=3 1505 B14R2.25733 CC(O)c1nn(C)c2ccccc12 Amb28349391 [0,1,0,0,1,0|2,0,0]=4 1506 B14R2.25733 C[C@@H](N)c1cn(C)c2ccccc12 Amb26321568 [0,1,0,0,1,0|0,0,0]=2 1507 B14R2.25733 C[C@@H](N)c1cn(C)c2ncccc12 Amb32880862 [0,1,0,0,1,0|1,0,0]=3 1508 B14R2.25733 C[C@@H](N)c1nn(C)c2ccccc12 Amb33198514 [0,1,0,0,1,0|1,0,0]=3 1509 B14R2.25733 C[C@@H](O)c1cn(C)c2ccccc12 Amb25927482 [0,1,0,0,1,0|1,0,0]=3 1510 B14R2.25733 C[C@@H](O)c1cn(C)c2ncccc12 Amb33224770 [0,1,0,0,1,0|2,0,0]=4 1511 B14R2.25733 C[C@@H](O)c1nn(C)c2ccccc12 Amb33197022 [0,1,0,0,1,0|2,0,0]=4 1512 B14R2.25733 C[C@H](N)c1cn(C)c2ccccc12 Amb26553296 [0,1,0,0,1,0|0,0,0]=2 1513 B14R2.25733 C[C@H](N)c1cn(C)c2ncccc12 Amb32880861 [0,1,0,0,1,0|1,0,0]=3 1514 B14R2.25733 C[C@H](N)c1nn(C)c2ccccc12 Amb33198513 [0,1,0,0,1,0|1,0,0]=3 1515 B14R2.25733 C[C@H](O)c1cn(C)c2ccccc12 Amb25125560 [0,1,0,0,1,0|1,0,0]=3 1516 B14R2.25733 C[C@H](O)c1cn(C)c2ncccc12 Amb32880860 [0,1,0,0,1,0|2,0,0]=4 1517 B14R2.25733 C[C@H](O)c1nn(C)c2ccccc12 Amb33197021 [0,1,0,0,1,0|2,0,0]=4 1518 B14R2.25733 Cn1cc(C(=N)N)c2ccccc21 Amb2697187 [0,1,0,0,1,0|1,0,1]=4 1519 B14R2.25733 Cn1cc(C(N)=O)c2ccccc21 Amb615381 [0,1,0,0,1,0|1,0,1]=4 1520 B14R2.25733 Cn1cc(C(N)=S)c2ccccc21 Amb17087571 [0,1,0,0,1,0|1,0,1]=4 1521 B14R2.45895 CC(C)(N)CC1Cc2ccccc21 Amb27768904 [0,1,0,0,1,0|0,0,2]=4 1522 B16R2.12 CC(Cl)C(C)Cc1csc2ccccc12 Amb28125109 [0,1,0,0,0,1|2,0,0]=4 1523 B16R2.12 C[C@@H](N)C(=O)Cc1csc2ccccc12 Amb30024488 [0,1,0,0,0,1|1,0,0]=3 1524 B16R2.12 C[C@H](N)C(=O)Cc1csc2ccccc12 Amb30024715 [0,1,0,0,0,1|1,0,0]=3 1525 B16R2.14 CC(CO)NCc1csc2ccccc12 Amb18313694 [0,1,0,0,0,1|2,0,0]=4 1526 B16R2.14 CCC(C)NCc1csc2ccccc12 Amb33442306 [0,1,0,0,0,1|2,0,0]=4 1527 B16R2.520 CC(Br)CC(C)c1coc2ccccc12 Amb35704110 [0,1,0,0,0,1|2,0,0]=4 1528 B16R2.520 CC(C)CC(=O)c1coc2ccccc12 Amb26877298 [0,1,0,0,0,1|2,0,0]=4 1529 B16R2.520 CC(C)CC(Cl)c1coc2ccccc12 Amb35704194 [0,1,0,0,0,1|2,0,0]=4 1530 B16R2.520 CC(C)CC(Cl)c1csc2ccccc12 Amb27753357 [0,1,0,0,0,1|2,0,0]=4 1531 B16R2.520 CC(C)CC(N)c1coc2ccccc12 Amb31112567 [0,1,0,0,0,1|2,0,0]=4 1532 B16R2.520 CC(C)CC(N)c1csc2ccccc12 Amb9212771 [0,1,0,0,0,1|2,0,0]=4 1533 B16R2.520 CC(C)NC(C)c1csc2ccccc12 Amb19649487 [0,1,0,0,0,1|2,0,0]=4 1534 B16R2.520 CC(Cl)CC(C)c1coc2ccccc12 Amb35704108 [0,1,0,0,0,1|2,0,0]=4 1535 B16R2.520 CC(N)CC(=O)c1coc2ccccc12 Amb35704140 [0,1,0,0,0,1|1,0,0]=3 1536 B16R2.2947 CC(C)(N)CCc1cnc2ccccn12 Amb33274053 [0,1,0,0,0,1|1,0,1]=4 1537 B16R2.2947 CC(C)(N)CCc1cnn2ccccc12 Amb33147525 [0,1,0,0,0,1|1,0,1]=4 1538 B16R2.2947 CC(C)(N)CCc1csc2ccccc12 Amb33313107 [0,1,0,0,0,1|1,0,0]=3 1539 B16R2.4003 CC(C)CCN1C(=O)Nc2ccccc21 Amb18034261 [0,1,0,0,0,1|2,0,0]=4 1540 B16R2.4003 CC(N)CCc1c2ccccc2nn1C Amb33313063 [0,1,0,0,0,1|1,0,1]=4 1541 B16R2.4003 C[C@@H](N)CCc1c2ccccc2nn1C Amb33312143 [0,1,0,0,0,1|1,0,1]=4 1542 B16R2.4003 C[C@H](N)CCc1c2ccccc2nn1C Amb33312142 [0,1,0,0,0,1|1,0,1]=4 1543 B16R2.104522 CC(=O)CCc1cn(C)c2ccccc12 Amb17595348 [0,1,0,0,0,1|1,0,1]=4 1544 B16R2.104522 CC(Br)\C=C\c1cn(C)c2ccccc12 Amb28191610 [0,1,0,0,0,1|1,0,1]=4 1545 B16R2.104522 CC(C)NCc1cn(C)c2ccccc12 Amb18566604 [0,1,0,0,0,1|1,0,0]=3 1546 B16R2.104522 CC(C)NCc1cn(C)c2ccccc12 Amb21969162 [0,1,0,0,0,1|1,0,0]=3 1547 B16R2.104522 CC(N)CCc1cn(C)c2ccccc12 Amb17760422 [0,1,0,0,0,1|0,0,0]=2 1548 B16R2.104522 CC(N)CCc1cn(C)c2ncccc12 Amb32880056 [0,1,0,0,0,1|1,0,0]=3 1549 B16R2.104522 CC(N)CCc1nn(C)c2ccccc12 Amb33358690 [0,1,0,0,0,1|1,0,0]=3 1550 B16R2.104522 CC(N)COc1nn(C)c2ccccc12 Amb23560678 [0,1,0,0,0,1|1,0,0]=3 1551 B16R2.104522 CC(N)\C=C\c1cn(C)c2ccccc12 Amb33428786 [0,1,0,0,0,1|0,0,1]=3 1552 B16R2.104522 CC(N)\C=C\c1cn(C)c2ncccc12 Amb32878641 [0,1,0,0,0,1|1,0,1]=4 1553 B16R2.104522 CC(N)\C=C\c1nn(C)c2ccccc12 Amb33196337 [0,1,0,0,0,1|1,0,1]=4 1554 B16R2.104522 CC(O)CCc1cn(C)c2ccccc12 Amb33172540 [0,1,0,0,0,1|1,0,0]=3 1555 B16R2.104522 CC(O)CCc1cn(C)c2ncccc12 Amb32880055 [0,1,0,0,0,1|2,0,0]=4 1556 B16R2.104522 CC(O)CCc1nn(C)c2ccccc12 Amb33359581 [0,1,0,0,0,1|2,0,0]=4 1557 B16R2.104522 C[C@@H](N)CCc1cn(C)c2ccccc12 Amb33320665 [0,1,0,0,0,1|0,0,0]=2 1558 B16R2.104522 C[C@@H](N)CCc1cn(C)c2ncccc12 Amb32880052 [0,1,0,0,0,1|1,0,0]=3 1559 B16R2.104522 C[C@@H](N)CCc1nn(C)c2ccccc12 Amb33197219 [0,1,0,0,0,1|1,0,0]=3 1560 B16R2.104522 C[C@@H](O)CCc1cn(C)c2ccccc12 Amb33320666 [0,1,0,0,0,1|1,0,0]=3 1561 B16R2.104522 C[C@@H](O)CCc1cn(C)c2ncccc12 Amb32880053 [0,1,0,0,0,1|2,0,0]=4 1562 B16R2.104522 C[C@@H](O)CCc1nn(C)c2ccccc12 Amb33197214 [0,1,0,0,0,1|2,0,0]=4 1563 B16R2.104522 C[C@H](N)CCc1cn(C)c2ccccc12 Amb33320664 [0,1,0,0,0,1|0,0,0]=2 1564 B16R2.104522 C[C@H](N)CCc1cn(C)c2ncccc12 Amb32880051 [0,1,0,0,0,1|1,0,0]=3 1565 B16R2.104522 C[C@H](N)CCc1nn(C)c2ccccc12 Amb33197218 [0,1,0,0,0,1|1,0,0]=3 1566 B16R2.104522 C[C@H](O)CCc1cn(C)c2ccccc12 Amb33320667 [0,1,0,0,0,1|1,0,0]=3 1567 B16R2.104522 C[C@H](O)CCc1cn(C)c2ncccc12 Amb32880054 [0,1,0,0,0,1|2,0,0]=4 1568 B16R2.104522 C[C@H](O)CCc1nn(C)c2ccccc12 Amb33197189 [0,1,0,0,0,1|2,0,0]=4 1569 B16R2.104522 Cn1cc(CNC(=N)N)c2ccccc21 Amb31112442 [0,1,0,0,0,1|1,0,1]=4 1570 B16R2.104522 Cn1cc(CNC(N)=O)c2ccccc21 Amb31129069 [0,1,0,0,0,1|1,0,1]=4 1571 B16R2.104522 Cn1cc(SCC(N)=O)c2ccccc21 Amb1349739 [0,1,0,0,0,1|1,0,1]=4 1572 B16R2.3989 CC(=O)CC1=Nc2ccccc2NC1=O Amb20414414 [0,1,0,0,0,1|1,0,1]=4 1573 B16R2.3989 CC(Br)Cc1cc2ccccc2nc1Cl Amb33436062 [0,1,0,0,0,1|1,0,1]=4 1574 B16R2.3989 CC(C)Cc1nc2ccccc2nc1Cl Amb35736078 [0,1,0,0,0,1|1,0,1]=4 1575 B16R2.3989 CC(O)Cc1cc2ccccc2nc1Cl Amb33058687 [0,1,0,0,0,1|1,0,1]=4 1576 B16R2.3989 C[C@@H](N)Cc1cc2ccccc2nc1Cl Amb33058973 [0,1,0,0,0,1|0,0,1]=3 1577 B16R2.3989 C[C@@H](O)Cc1cc2ccccc2nc1Cl Amb33485135 [0,1,0,0,0,1|1,0,1]=4 1578 B16R2.3989 C[C@H](N)Cc1cc2ccccc2nc1Cl Amb33058873 [0,1,0,0,0,1|0,0,1]=3 1579 B16R2.3989 C[C@H](O)Cc1cc2ccccc2nc1Cl Amb33057297 [0,1,0,0,0,1|1,0,1]=4 1580 B16R2.5347 CC(CBr)Cc1ccc2ccccc2c1 Amb28456230 [0,1,0,0,0,1|2,0,0]=4 1581 B16R2.5347 CC(CN)Cc1ccc2ccccc2c1 Amb33748491 [0,1,0,0,0,1|1,0,0]=3 1582 B16R2.5347 CC(CN)Cc1ccc2ccccc2n1 Amb17578901 [0,1,0,0,0,1|1,0,0]=3 1583 B16R2.5347 CC(CN)Cc1ccc2cccnc2c1 Amb18353624 [0,1,0,0,0,1|2,0,0]=4 1584 B16R2.5347 CC(CN)Cc1ccc2ccncc2c1 Amb19105232 [0,1,0,0,0,1|2,0,0]=4 1585 B16R2.5347 CC(CN)Cc1ccc2cnccc2c1 Amb19105234 [0,1,0,0,0,1|2,0,0]=4 1586 B16R2.5347 CC(CN)Cc1ccc2ncccc2c1 Amb18353670 [0,1,0,0,0,1|2,0,0]=4 1587 B16R2.5347 CC(CN)Cc1cnc2ccccc2c1 Amb33737171 [0,1,0,0,0,1|0,0,1]=3 1588 B16R2.5347 CC(CO)Cc1ccc2ccccc2c1 Amb33748495 [0,1,0,0,0,1|2,0,0]=4 1589 B16R2.5347 CC(CO)Cc1ccc2ccccc2n1 Amb33748302 [0,1,0,0,0,1|2,0,0]=4 1590 B16R2.5347 CC(CO)Cc1cnc2ccccc2c1 Amb33737537 [0,1,0,0,0,1|1,0,1]=4 1591 B16R2.5347 CCC(Br)Cc1ccc2ccccc2c1 Amb18548932 [0,1,0,0,0,1|2,0,0]=4 1592 B16R2.5347 CCC(Cl)Cc1ccc2ccccc2n1 Amb27834391 [0,1,0,0,0,1|2,0,0]=4 1593 B16R2.5347 C[C@@H](CN)Cc1ccc2ccccc2c1 Amb33743133 [0,1,0,0,0,1|1,0,0]=3 1594 B16R2.5347 C[C@@H](CN)Cc1ccc2ccccc2n1 Amb33731719 [0,1,0,0,0,1|1,0,0]=3 1595 B16R2.5347 C[C@@H](CN)Cc1ccc2cccnc2c1 Amb33727235 [0,1,0,0,0,1|2,0,0]=4 1596 B16R2.5347 C[C@@H](CN)Cc1cnc2ccccc2c1 Amb33743244 [0,1,0,0,0,1|0,0,1]=3 1597 B16R2.5347 C[C@@H](CO)Cc1ccc2ccccc2c1 Amb33746681 [0,1,0,0,0,1|2,0,0]=4 1598 B16R2.5347 C[C@@H](CO)Cc1ccc2ccccc2n1 Amb33740796 [0,1,0,0,0,1|2,0,0]=4 1599 B16R2.5347 C[C@@H](CO)Cc1cnc2ccccc2c1 Amb33739843 [0,1,0,0,0,1|1,0,1]=4 1600 B16R2.5347 C[C@H](CN)Cc1ccc2ccccc2c1 Amb33740279 [0,1,0,0,0,1|1,0,0]=3 1601 B16R2.5347 C[C@H](CN)Cc1ccc2ccccc2n1 Amb33737688 [0,1,0,0,0,1|1,0,0]=3 1602 B16R2.5347 C[C@H](CN)Cc1ccc2cccnc2c1 Amb33728694 [0,1,0,0,0,1|2,0,0]=4 1603 B16R2.5347 C[C@H](CN)Cc1cnc2ccccc2c1 Amb33737874 [0,1,0,0,0,1|0,0,1]=3 1604 B16R2.5347 C[C@H](CO)Cc1ccc2ccccc2c1 Amb33738168 [0,1,0,0,0,1|2,0,0]=4 1605 B16R2.5347 C[C@H](CO)Cc1ccc2ccccc2n1 Amb33749845 [0,1,0,0,0,1|2,0,0]=4 1606 B16R2.5347 C[C@H](CO)Cc1cnc2ccccc2c1 Amb33744420 [0,1,0,0,0,1|1,0,1]=4 1607 B16R2.5347 NC(CO)Cc1ccc2ccccc2c1 Amb24056375 [0,1,0,0,0,1|1,0,0]=3 1608 B16R2.5347 NC(CO)Cc1ccc2ccccc2n1 Amb33358975 [0,1,0,0,0,1|1,0,0]=3 1609 B16R2.5347 NC(CO)Cc1ccc2cccnc2c1 Amb32879656 [0,1,0,0,0,1|2,0,0]=4 1610 B16R2.5347 NC(CO)Cc1ccc2ncccc2c1 Amb33475230 [0,1,0,0,0,1|2,0,0]=4 1611 B16R2.5347 NC(CO)Cc1cnc2ccccc2c1 Amb33171436 [0,1,0,0,0,1|0,0,1]=3 1612 B16R2.5347 NC(CO)Cc1cnc2ccccc2n1 Amb33358194 [0,1,0,0,0,1|0,0,1]=3 1613 B16R2.5347 NCC(O)Cc1ccc2ccccc2c1 Amb33362157 [0,1,0,0,0,1|2,0,0]=4 1614 B16R2.5347 NCC(O)Cc1ccc2ccccc2n1 Amb33172229 [0,1,0,0,0,1|2,0,0]=4 1615 B16R2.5347 NCC(O)Cc1cnc2ccccc2c1 Amb33359287 [0,1,0,0,0,1|1,0,1]=4 1616 B16R2.5347 NCC(O)Cc1cnc2ccccc2n1 Amb33376895 [0,1,0,0,0,1|1,0,1]=4 1617 B16R2.6284 CC(Br)C(C)c1cnc2ccccc2c1 Amb27483858 [0,1,0,0,0,1|1,0,1]=4 1618 B16R2.6284 CC(N)C(=O)c1ccc2ccccc2c1 Amb18623693 [0,1,0,0,0,1|1,0,1]=4 1619 B16R2.6284 CC(N)C(=O)c1ccc2ccccc2n1 Amb33201932 [0,1,0,0,0,1|1,0,1]=4 1620 B16R2.6284 CC(N)C(=O)c1cnc2ccccc2c1 Amb25836998 [0,1,0,0,0,1|0,0,2]=4 1621 B16R2.6284 CC(N)C(=O)c1cnc2ccccc2n1 Amb32953437 [0,1,0,0,0,1|0,0,2]=4 1622 B16R2.6284 CC(O)C(C)c1ccc2ccccc2n1 Amb20623546 [0,1,0,0,0,1|2,0,0]=4 1623 B16R2.6284 C[C@@H](N)C(=O)c1ccc2ccccc2c1 Amb35588722 [0,1,0,0,0,1|1,0,1]=4 1624 B16R2.6284 C[C@@H](N)C(=O)c1cnc2ccccc2c1 Amb35588731 [0,1,0,0,0,1|0,0,2]=4 1625 B16R2.6284 C[C@H](N)C(=O)c1ccc2ccccc2c1 Amb35738084 [0,1,0,0,0,1|1,0,1]=4 1626 B16R2.6284 C[C@H](N)C(=O)c1cnc2ccccc2c1 Amb35738093 [0,1,0,0,0,1|0,0,2]=4 1627 B16R2.11975 CC(C)Cc1ccc2ccc(O)cc2c1 Amb32751471 [0,1,0,0,0,1|2,0,0]=4 1628 B16R2.11975 Cc1ccc2ccc(CC(C)N)cc2n1 Amb18353828 [0,1,0,0,0,1|2,0,0]=4 1629 B16R2.11988 CC(N)Cc1ccc2cc(Cl)ccc2n1 Amb17580190 [0,1,0,0,0,1|1,0,0]=3 1630 B16R2.11988 CC(N)Cc1ccc2cc(F)ccc2n1 Amb17579030 [0,1,0,0,0,1|1,0,0]=3 1631 B16R2.11988 Cc1ccc2cc(CC(C)N)ccc2n1 Amb18353827 [0,1,0,0,0,1|2,0,0]=4 1632 B16R2.11988 Cc1ccc2cc(C[C@@H](C)N)ccc2n1 Amb33200741 [0,1,0,0,0,1|2,0,0]=4 1633 B16R2.11988 Cc1ccc2cc(C[C@@H](C)N)ccc2n1 Amb35751959 [0,1,0,0,0,1|2,0,0]=4 1634 B16R2.11988 Cc1ccc2cc(C[C@H](C)N)ccc2n1 Amb33226209 [0,1,0,0,0,1|2,0,0]=4 1635 B16R2.22859 Cc1ccnc2cc(CC(C)N)ccc12 Amb18353839 [0,1,0,0,0,1|2,0,0]=4 1636 B16R2.24933 CC(N)Cc1cc(F)c2ncccc2c1 Amb19105931 [0,1,0,0,0,1|2,0,0]=4 1637 B16R2.24933 Cc1cc(CC(C)N)nc2ccccc12 Amb18353846 [0,1,0,0,0,1|1,0,0]=3 1638 B16R2.82802 CC(C)(Br)Cc1ccc2ccccc2c1 Amb18049611 [0,1,0,0,0,1|2,0,0]=4 1639 B16R2.82802 CC(C)(N)Cc1ccc2ccccc2c1 Amb10601985 [0,1,0,0,0,1|1,0,0]=3 1640 B16R2.82802 CC(C)(N)Cc1ccc2ccccc2c1 Amb19516161 [0,1,0,0,0,1|1,0,0]=3 1641 B16R2.82802 CC(C)(N)Cc1ccc2ccccc2n1 Amb33474754 [0,1,0,0,0,1|1,0,0]=3 1642 B16R2.82802 CC(C)(N)Cc1ccc2cccnc2c1 Amb19105603 [0,1,0,0,0,1|2,0,0]=4 1643 B16R2.82802 CC(C)(N)Cc1ccc2ccncc2c1 Amb18353756 [0,1,0,0,0,1|2,0,0]=4 1644 B16R2.82802 CC(C)(N)Cc1ccc2cnccc2c1 Amb18353758 [0,1,0,0,0,1|2,0,0]=4 1645 B16R2.82802 CC(C)(N)Cc1ccc2ncccc2c1 Amb18353661 [0,1,0,0,0,1|2,0,0]=4 1646 B16R2.82802 CC(C)(N)Cc1cnc2ccccc2c1 Amb33079705 [0,1,0,0,0,1|0,0,1]=3 1647 B16R2.82802 CC(C)(N)Cc1cnc2ccccc2n1 Amb33378817 [0,1,0,0,0,1|0,0,1]=3 1648 B16R2.82802 CC(C)(O)Cc1ccc2ccccc2c1 Amb30593635 [0,1,0,0,0,1|2,0,0]=4 1649 B16R2.82802 CC(C)(O)Cc1ccc2ccccc2n1 Amb32953476 [0,1,0,0,0,1|2,0,0]=4 1650 B16R2.82802 CC(C)(O)Cc1cnc2ccccc2c1 Amb33324710 [0,1,0,0,0,1|1,0,1]=4 1651 B16R2.82802 CC(C)(O)Cc1cnc2ccccc2n1 Amb33377774 [0,1,0,0,0,1|1,0,1]=4 1652 B16R2.126902 CC(N)Cc1ccc2cccc(Br)c2n1 Amb17585760 [0,1,0,0,0,1|1,0,0]=3 1653 B16R2.126902 CC(N)Cc1ccc2cccc(Cl)c2n1 Amb17580188 [0,1,0,0,0,1|1,0,0]=3 1654 B16R2.126902 Cc1ccnc2ccc(CC(C)N)cc12 Amb18353831 [0,1,0,0,0,1|2,0,0]=4 1655 B16R2.333 CC(Br)Cc1c(O)ccc2ccccc12 Amb33336337 [0,1,0,0,0,1|2,0,0]=4 1656 B16R2.333 CC(C)CN1C(=O)CNc2ccccc21 Amb17238159 [0,1,0,0,0,1|2,0,0]=4 1657 B16R2.333 CC(O)Cc1c(O)ccc2ccccc12 Amb32954366 [0,1,0,0,0,1|2,0,0]=4 1658 B16R2.333 C[C@@H](N)Cc1c(Cl)ccc2cccnc12 Amb33221275 [0,1,0,0,0,1|2,0,0]=4 1659 B16R2.333 C[C@@H](N)Cc1c(O)ccc2ccccc12 Amb33421059 [0,1,0,0,0,1|1,0,0]=3 1660 B16R2.333 C[C@@H](O)Cc1c(O)ccc2ccccc12 Amb33421057 [0,1,0,0,0,1|2,0,0]=4 1661 B16R2.333 C[C@H](N)Cc1c(Cl)ccc2cccnc12 Amb33221277 [0,1,0,0,0,1|2,0,0]=4 1662 B16R2.333 C[C@H](N)Cc1c(O)ccc2ccccc12 Amb33421058 [0,1,0,0,0,1|1,0,0]=3 1663 B16R2.333 C[C@H](O)Cc1c(O)ccc2ccccc12 Amb32953611 [0,1,0,0,0,1|2,0,0]=4 1664 B16R2.2986 CC(N)Cc1nccc2cc(Cl)ccc12 Amb18353819 [0,1,0,0,0,1|1,0,0]=3 1665 B16R2.3995 CC(N)Cc1cc(Cl)cc2cnccc12 Amb18353786 [0,1,0,0,0,1|2,0,0]=4 1666 B16R2.3995 CC(N)Cc1cc(F)cc2cccnc12 Amb19105933 [0,1,0,0,0,1|2,0,0]=4 1667 B16R2.3995 CC(N)Cc1cc(F)cc2cnccc12 Amb18353812 [0,1,0,0,0,1|2,0,0]=4 1668 B16R2.3995 Cc1cc(CC(C)Br)c2ccccc2n1 Amb33227879 [0,1,0,0,0,1|1,0,1]=4 1669 B16R2.3995 Cc1cc(CC(C)N)c2ccncc2c1 Amb18353780 [0,1,0,0,0,1|2,0,0]=4 1670 B16R2.3995 Cc1cc(CC(C)O)c2ccccc2n1 Amb33473961 [0,1,0,0,0,1|1,0,1]=4 1671 B16R2.3995 Cc1cc(C[C@@H](C)N)c2ccccc2n1 Amb33429924 [0,1,0,0,0,1|0,0,1]=3 1672 B16R2.3995 Cc1cc(C[C@@H](C)O)c2ccccc2n1 Amb33373619 [0,1,0,0,0,1|1,0,1]=4 1673 B16R2.3995 Cc1cc(C[C@H](C)N)c2ccccc2n1 Amb33079723 [0,1,0,0,0,1|0,0,1]=3 1674 B16R2.3995 Cc1cc(C[C@H](C)O)c2ccccc2n1 Amb33373620 [0,1,0,0,0,1|1,0,1]=4 1675 B16R2.3995 Cc1cc2ccccc2c(CC(C)N)n1 Amb19105802 [0,1,0,0,0,1|1,0,0]=3 1676 B16R2.12129 CC(N)Cc1nccc2ccc(Cl)cc12 Amb18353818 [0,1,0,0,0,1|1,0,0]=3 1677 B16R2.12129 Cc1cc2c(CC(C)N)cccc2cn1 Amb19105774 [0,1,0,0,0,1|2,0,0]=4 1678 B16R2.22885 CC(N)Cc1nccc2c(F)cccc12 Amb19105779 [0,1,0,0,0,1|1,0,0]=3 1679 B16R2.22885 Cc1cccc2c(CC(C)N)nccc12 Amb19105777 [0,1,0,0,0,1|1,0,0]=3 1680 B16R2.24414 CC(N)Cc1ccc(F)c2ccncc12 Amb19105768 [0,1,0,0,0,1|2,0,0]=4 1681 B16R2.24414 CC(N)Cc1ccc(F)c2cnccc12 Amb18353774 [0,1,0,0,0,1|2,0,0]=4 1682 B16R2.24414 Cc1ccc(CC(C)Br)c2ccccc12 Amb33335969 [0,1,0,0,0,1|2,0,0]=4 1683 B16R2.24414 Cc1ccc(CC(C)O)c2ccccc12 Amb33198812 [0,1,0,0,0,1|2,0,0]=4 1684 B16R2.24414 Cc1ccc(C[C@@H](C)N)c2ccccc12 Amb33198337 [0,1,0,0,0,1|1,0,0]=3 1685 B16R2.24414 Cc1ccc(C[C@@H](C)O)c2ccccc12 Amb33198563 [0,1,0,0,0,1|2,0,0]=4 1686 B16R2.24414 Cc1ccc(C[C@H](C)N)c2ccccc12 Amb33198565 [0,1,0,0,0,1|1,0,0]=3 1687 B16R2.24414 Cc1ccc(C[C@H](C)O)c2ccccc12 Amb33198564 [0,1,0,0,0,1|2,0,0]=4 1688 B16R2.126882 CC(N)Cc1nccc2cccc(F)c12 Amb19105795 [0,1,0,0,0,1|1,0,0]=3 1689 B16R2.170412 CC(CN)Cc1cccc2ccccc12 Amb10608233 [0,1,0,0,0,1|1,0,0]=3 1690 B16R2.170412 CC(CN)Cc1ccnc2ccccc12 Amb33744901 [0,1,0,0,0,1|0,0,1]=3 1691 B16R2.170412 CC(CN)Cc1cncc2ccccc12 Amb18353658 [0,1,0,0,0,1|0,0,1]=3 1692 B16R2.170412 CC(CN)Cc1nccc2ccccc12 Amb18353634 [0,1,0,0,0,1|1,0,0]=3 1693 B16R2.170412 CC(CO)Cc1cccc2ccccc12 Amb33745571 [0,1,0,0,0,1|2,0,0]=4 1694 B16R2.170412 CC(CO)Cc1ccnc2ccccc12 Amb33749210 [0,1,0,0,0,1|1,0,1]=4 1695 B16R2.170412 CC(CO)Cc1cncc2ccccc12 Amb33737502 [0,1,0,0,0,1|1,0,1]=4 1696 B16R2.170412 CCC(Cl)Cc1cccc2ccccc12 Amb17476916 [0,1,0,0,0,1|2,0,0]=4 1697 B16R2.170412 CCC(Cl)Cc1ccnc2ccccc12 Amb27989134 [0,1,0,0,0,1|1,0,1]=4 1698 B16R2.170412 C[C@@H](CN)Cc1cccc2ccccc12 Amb33748153 [0,1,0,0,0,1|1,0,0]=3 1699 B16R2.170412 C[C@@H](CN)Cc1ccnc2ccccc12 Amb33728857 [0,1,0,0,0,1|0,0,1]=3 1700 B16R2.170412 C[C@@H](CN)Cc1cncc2ccccc12 Amb33730068 [0,1,0,0,0,1|0,0,1]=3 1701 B16R2.170412 C[C@@H](CO)Cc1cccc2ccccc12 Amb33746676 [0,1,0,0,0,1|2,0,0]=4 1702 B16R2.170412 C[C@@H](CO)Cc1ccnc2ccccc12 Amb33738944 [0,1,0,0,0,1|1,0,1]=4 1703 B16R2.170412 C[C@@H](CO)Cc1cncc2ccccc12 Amb33739844 [0,1,0,0,0,1|1,0,1]=4 1704 B16R2.170412 C[C@H](CN)Cc1cccc2ccccc12 Amb33740274 [0,1,0,0,0,1|1,0,0]=3 1705 B16R2.170412 C[C@H](CN)Cc1ccnc2ccccc12 Amb33733098 [0,1,0,0,0,1|0,0,1]=3 1706 B16R2.170412 C[C@H](CN)Cc1cncc2ccccc12 Amb33727727 [0,1,0,0,0,1|0,0,1]=3 1707 B16R2.170412 C[C@H](CO)Cc1cccc2ccccc12 Amb33738151 [0,1,0,0,0,1|2,0,0]=4 1708 B16R2.170412 C[C@H](CO)Cc1ccnc2ccccc12 Amb33748058 [0,1,0,0,0,1|1,0,1]=4 1709 B16R2.170412 C[C@H](CO)Cc1cncc2ccccc12 Amb33748597 [0,1,0,0,0,1|1,0,1]=4 1710 B16R2.170412 NC(CO)Cc1cccc2ccccc12 Amb32953908 [0,1,0,0,0,1|1,0,0]=3 1711 B16R2.170412 NC(CO)Cc1cccc2cnccc12 Amb32724585 [0,1,0,0,0,1|2,0,0]=4 1712 B16R2.170412 NC(CO)Cc1ccnc2ccccc12 Amb33080386 [0,1,0,0,0,1|0,0,1]=3 1713 B16R2.170412 NCC(O)Cc1cccc2ccccc12 Amb33449267 [0,1,0,0,0,1|2,0,0]=4 1714 B16R2.170412 NCC(O)Cc1ccnc2ccccc12 Amb33359774 [0,1,0,0,0,1|1,0,1]=4 1715 B16R2.244415 CC(C)C(Cl)c1cccc2ccccc12 Amb27805469 [0,1,0,0,0,1|2,0,0]=4 1716 B16R2.244415 CC(C)C(N)c1cccc2ccccc12 Amb19085226 [0,1,0,0,0,1|2,0,0]=4 1717 B16R2.244415 CC(C)C(N)c1cccc2ccccc12 Amb35745639 [0,1,0,0,0,1|2,0,0]=4 1718 B16R2.244415 CC(Cl)C(C)c1cccc2ccccc12 Amb27171164 [0,1,0,0,0,1|2,0,0]=4 1719 B16R2.244415 CC(N)C(=O)c1cccc2ccccc12 Amb25698024 [0,1,0,0,0,1|1,0,1]=4 1720 B16R2.244415 CC(N)C(=O)c1ccnc2ccccc12 Amb33146320 [0,1,0,0,0,1|0,0,2]=4 1721 B16R2.244415 C[C@@H](N)C(=O)c1cccc2ccccc12 Amb35588723 [0,1,0,0,0,1|1,0,1]=4 1722 B16R2.244415 C[C@@H](N)C(=O)c1cncc2ccccc12 Amb35588724 [0,1,0,0,0,1|0,0,2]=4 1723 B16R2.244415 C[C@H](N)C(=O)c1cccc2ccccc12 Amb35738085 [0,1,0,0,0,1|1,0,1]=4 1724 B16R2.244415 C[C@H](N)C(=O)c1cncc2ccccc12 Amb35738086 [0,1,0,0,0,1|0,0,2]=4 1725 B16R2.248309 CC(C)(N)Cc1cccc2ccccc12 Amb18962669 [0,1,0,0,0,1|1,0,0]=3 1726 B16R2.248309 CC(C)(N)Cc1cccc2cnccc12 Amb18353757 [0,1,0,0,0,1|2,0,0]=4 1727 B16R2.248309 CC(C)(N)Cc1ccnc2ccccc12 Amb33171918 [0,1,0,0,0,1|0,0,1]=3 1728 B16R2.248309 CC(C)(N)Cc1nccc2ccccc12 Amb19105596 [0,1,0,0,0,1|1,0,0]=3 1729 B16R2.248309 CC(C)(O)Cc1cccc2ccccc12 Amb30589254 [0,1,0,0,0,1|2,0,0]=4 1730 B16R2.248309 CC(C)(O)Cc1ccnc2ccccc12 Amb33079008 [0,1,0,0,0,1|1,0,1]=4 1731 B16R2.3 CC(C)(CBr)Cc1csc2ccccc12 Amb24720077 [0,2,0,0,0,0|2,0,0]=4 1732 B16R2.3 CC(C)(CN)Cc1cnc2ccccn12 Amb33274002 [0,2,0,0,0,0|1,0,1]=4 1733 B16R2.3 CC(C)(CN)Cc1cnn2ccccc12 Amb33147446 [0,2,0,0,0,0|1,0,1]=4 1734 B16R2.3 CC(C)(CN)Cc1csc2ccccc12 Amb33449388 [0,2,0,0,0,0|1,0,0]=3 1735 B16R2.3 CC(C)(CO)Cc1csc2ccccc12 Amb32953711 [0,2,0,0,0,0|2,0,0]=4 1736 B16R2.3 CC(N)(CO)Cc1cnc2ccccn12 Amb33225699 [0,2,0,0,0,0|1,0,1]=4 1737 B16R2.3 CC(N)(CO)Cc1cnn2ccccc12 Amb33147115 [0,2,0,0,0,0|1,0,1]=4 1738 B16R2.3 CC(N)(CO)Cc1csc2ccccc12 Amb33312691 [0,2,0,0,0,0|1,0,0]=3 1739 B16R2.3 CC(N)(CO)Cn1cnc2ccccc21 Amb33038173 [0,2,0,0,0,0|1,0,1]=4 1740 B16R2.3 CC(N)(CO)Cn1cnc2ccccc21 Amb33038174 [0,2,0,0,0,0|1,0,1]=4 1741 B16R2.3 CNC(C)(C)Cc1cnc2ccccn12 Amb33146734 [0,2,0,0,0,0|1,0,1]=4 1742 B16R2.3 CNC(C)(C)Cc1cnn2ccccc12 Amb33146831 [0,2,0,0,0,0|1,0,1]=4 1743 B16R2.3 CNC(C)(C)Cc1csc2ccccc12 Amb33197004 [0,2,0,0,0,0|1,0,0]=3 1744 B16R2.3 NCC(F)(F)Cc1csc2ccccc12 Amb33400951 [0,2,0,0,0,0|2,0,0]=4 1745 B16R2.4 N#CC(CBr)Cc1csc2ccccc12 Amb27603754 [0,2,0,0,0,0|1,0,1]=4 1746 B16R2.2224 CC(CN)C(=O)c1coc2ccccc12 Amb35704133 [0,2,0,0,0,0|1,0,1]=4 1747 B16R2.2224 CCC(C)C(Cl)c1coc2ccccc12 Amb35704193 [0,2,0,0,0,0|2,0,0]=4 1748 B16R2.2224 CCC(N)C(=O)c1coc2ccccc12 Amb35704139 [0,2,0,0,0,0|1,0,1]=4 1749 B16R2.2224 CC[C@@H](N)C(=O)c1coc2ccccc12 Amb35596822 [0,2,0,0,0,0|1,0,1]=4 1750 B16R2.2224 CC[C@H](N)C(=O)c1coc2ccccc12 Amb35601320 [0,2,0,0,0,0|1,0,1]=4 1751 B16R2.2224 CNC(C)C(=O)c1coc2ccccc12 Amb35704138 [0,2,0,0,0,0|1,0,1]=4 1752 B16R2.2224 CN[C@@H](C)C(=O)c1coc2ccccc12 Amb35662591 [0,2,0,0,0,0|1,0,1]=4 1753 B16R2.33556 CC(CBr)Cc1nn(C)c2ccccc12 Amb27249152 [0,2,0,0,0,0|2,0,0]=4 1754 B16R2.33556 CCC(Cl)Cc1nn(C)c2ccccc12 Amb27761835 [0,2,0,0,0,0|2,0,0]=4 1755 B16R2.33556 CCC(N)Cc1cn(C)c2ccccc12 Amb32660515 [0,2,0,0,0,0|0,0,0]=2 1756 B16R2.33556 CCC(N)Cc1cn(C)c2ccccc12 Amb32660517 [0,2,0,0,0,0|0,0,0]=2 1757 B16R2.33556 COC(=O)Cc1cn(C)c2ccccc12 Amb22371364 [0,2,0,0,0,0|1,0,1]=4 1758 B16R2.33556 Cn1cc(CC(N)CO)c2ccccc21 Amb18784125 [0,2,0,0,0,0|0,0,0]=2 1759 B16R2.33556 Cn1cc(CC(N)CO)c2cccnc21 Amb32880426 [0,2,0,0,0,0|1,0,0]=3 1760 B16R2.33556 Cn1cc(CC(O)CN)c2ccccc21 Amb33319489 [0,2,0,0,0,0|1,0,0]=3 1761 B16R2.33556 Cn1cc(CC(O)CN)c2cccnc21 Amb32879258 [0,2,0,0,0,0|2,0,0]=4 1762 B16R2.33556 Cn1nc(CC(N)CO)c2ccccc21 Amb33358902 [0,2,0,0,0,0|1,0,0]=3 1763 B16R2.33556 Cn1nc(CC(O)CN)c2ccccc21 Amb33448960 [0,2,0,0,0,0|2,0,0]=4 1764 B16R2.33562 CCC(N)CN1C(=O)Oc2ccccc21 Amb18984889 [0,2,0,0,0,0|2,0,0]=4 1765 B16R2.33562 CCC(N)CN1C(=O)Oc2ccccc21 Amb32662300 [0,2,0,0,0,0|2,0,0]=4 1766 B16R2.33562 CCC(N)Cn1c(C)nc2ccccc21 Amb17450428 [0,2,0,0,0,0|1,0,1]=4 1767 B16R2.33562 Cn1nc2ccccc2c1CC(N)CO Amb33311665 [0,2,0,0,0,0|1,0,1]=4 1768 B16R2.2804 CC(C)(C)C(N)c1csc2ccccc12 Amb9212780 [0,2,0,0,0,0|2,0,0]=4 1769 B16R2.2804 CC(C)(N)C(=O)c1coc2ccccc12 Amb35704137 [0,2,0,0,0,0|1,0,1]=4 1770 B16R2.2804 CC(F)(F)C(Br)c1csc2ccccc12 Amb27855447 [0,2,0,0,0,0|2,0,0]=4 1771 B16R2.2804 CC(F)(F)C(Cl)c1csc2ccccc12 Amb27436712 [0,2,0,0,0,0|2,0,0]=4 1772 B16R2.3988 CC(C)(N)CC1C(=O)Nc2ccccc21 Amb31142661 [0,2,0,0,0,0|0,0,1]=3 1773 B16R2.3988 Cc1nc2ccccc2n1CC(C)(C)N Amb17450429 [0,2,0,0,0,0|1,0,1]=4 1774 B16R2.3988 Cn1nc2ccccc2c1CC(C)(C)N Amb33312478 [0,2,0,0,0,0|1,0,1]=4 1775 B16R2.45200 Cn1cc(CC(C)(C)N)c2ccccc21 Amb18566606 [0,2,0,0,0,0|0,0,0]=2 1776 B16R2.45200 Cn1cc(CC(C)(C)N)c2cccnc21 Amb32880032 [0,2,0,0,0,0|1,0,0]=3 1777 B16R2.45200 Cn1cc(CC(C)(C)O)c2ccccc21 Amb33319806 [0,2,0,0,0,0|1,0,0]=3 1778 B16R2.45200 Cn1cc(CC(C)(C)O)c2cccnc21 Amb32880442 [0,2,0,0,0,0|2,0,0]=4 1779 B16R2.45200 Cn1cc(CS(N)(=O)=O)c2ccccc21 Amb33056548 [0,2,0,0,0,0|2,0,0]=4 1780 B16R2.45200 Cn1nc(CC(C)(C)N)c2ccccc21 Amb33449483 [0,2,0,0,0,0|1,0,0]=3 1781 B16R2.45200 Cn1nc(CC(C)(C)O)c2ccccc21 Amb33429685 [0,2,0,0,0,0|2,0,0]=4 1782 B16R2.13690 Cc1cc2ncn(CC(C)N)c2cc1C Amb20667673 [0,2,0,0,0,0|1,0,1]=4 1783 B16R2.13690 Cc1cc2ncn(CC(C)N)c2cc1C Amb6661289 [0,2,0,0,0,0|1,0,1]=4 1784 B16R2.24600 CC(=O)Cc1cn(C)c2cc(C)ccc12 Amb18894735 [0,2,0,0,0,0|1,0,1]=4 1785 B16R2.24600 CC(=O)Cc1cn(C)c2cc(Cl)ccc12 Amb18244800 [0,2,0,0,0,0|1,0,1]=4 1786 B16R2.24600 CC(=O)Cc1cn(C)c2cc(F)ccc12 Amb18895344 [0,2,0,0,0,0|1,0,1]=4 1787 B16R2.24600 CC(Br)Cc1cn(C)c2cc(Cl)ccc12 Amb33435672 [0,2,0,0,0,0|1,0,0]=3 1788 B16R2.24600 CC(N)Cc1cn(C)c2cc(Br)ccc12 Amb18064362 [0,2,0,0,0,0|0,0,0]=2 1789 B16R2.24600 CC(N)Cc1cn(C)c2cc(Cl)ccc12 Amb18064361 [0,2,0,0,0,0|0,0,0]=2 1790 B16R2.24600 CC(N)Cc1cn(C)c2cc(F)ccc12 Amb18064370 [0,2,0,0,0,0|0,0,0]=2 1791 B16R2.24600 CC(O)Cc1cn(C)c2cc(Cl)ccc12 Amb33223982 [0,2,0,0,0,0|1,0,0]=3 1792 B16R2.24600 CN(O)Cc1cn(C)c2cc(Cl)ccc12 Amb33223997 [0,2,0,0,0,0|2,0,0]=4 1793 B16R2.24600 C[C@@H](N)Cc1cn(C)c2cc(Cl)ccc12 Amb33059239 [0,2,0,0,0,0|0,0,0]=2 1794 B16R2.24600 C[C@@H](O)Cc1cn(C)c2cc(Cl)ccc12 Amb33221635 [0,2,0,0,0,0|1,0,0]=3 1795 B16R2.24600 C[C@H](N)Cc1cn(C)c2cc(Cl)ccc12 Amb33059300 [0,2,0,0,0,0|0,0,0]=2 1796 B16R2.24600 C[C@H](O)Cc1cn(C)c2cc(Cl)ccc12 Amb33221634 [0,2,0,0,0,0|1,0,0]=3 1797 B16R2.24600 Cc1ccc2c(CC(C)N)cn(C)c2c1 Amb18894898 [0,2,0,0,0,0|0,0,0]=2 1798 B16R2.24600 Cc1ccc2c(CC(N)=O)cn(C)c2c1 Amb18894837 [0,2,0,0,0,0|1,0,1]=4 1799 B16R2.24600 Cn1cc(CC(=N)N)c2ccc(Cl)cc21 Amb33223991 [0,2,0,0,0,0|1,0,1]=4 1800 B16R2.24600 Cn1cc(CC(N)=O)c2ccc(Br)cc21 Amb17074411 [0,2,0,0,0,0|1,0,1]=4 1801 B16R2.24600 Cn1cc(CC(N)=O)c2ccc(Cl)cc21 Amb18244939 [0,2,0,0,0,0|1,0,1]=4 1802 B16R2.24600 Cn1cc(CC(N)=O)c2ccc(F)cc21 Amb18895483 [0,2,0,0,0,0|1,0,1]=4 1803 B16R2.24600 Cn1cc(CC(N)=S)c2ccc(Cl)cc21 Amb33059373 [0,2,0,0,0,0|1,0,1]=4 1804 B16R2.4001 CC(O)CC1(O)C(=O)Nc2ccccc21 Amb5538884 [0,2,0,0,0,0|1,0,1]=4 1805 B16R2.12021 CC(C)CC1C(=O)Nc2ccc(Br)cc21 Amb17474103 [0,2,0,0,0,0|1,0,1]=4 1806 B16R2.44951 CC(=O)Cc1c(C)n(C)c2ccccc12 Amb18894713 [0,2,0,0,0,0|1,0,1]=4 1807 B16R2.44951 Cc1c(CC(=N)N)c2ccccc2n1C Amb32732855 [0,2,0,0,0,0|1,0,1]=4 1808 B16R2.44951 Cc1c(CC(C)Br)c2ccccc2n1C Amb33434921 [0,2,0,0,0,0|1,0,0]=3 1809 B16R2.44951 Cc1c(CC(C)N)c2ccccc2n1C Amb830860 [0,2,0,0,0,0|0,0,0]=2 1810 B16R2.44951 Cc1c(CC(C)O)c2ccccc2n1C Amb33473758 [0,2,0,0,0,0|1,0,0]=3 1811 B16R2.44951 Cc1c(CC(N)=O)c2ccccc2n1C Amb18894802 [0,2,0,0,0,0|1,0,1]=4 1812 B16R2.44951 Cc1c(CC(N)=S)c2ccccc2n1C Amb32731995 [0,2,0,0,0,0|1,0,1]=4 1813 B16R2.44951 Cc1c(CN(C)O)c2ccccc2n1C Amb33225202 [0,2,0,0,0,0|2,0,0]=4 1814 B16R2.44951 Cc1c(C[C@@H](C)N)c2ccccc2n1C Amb32732248 [0,2,0,0,0,0|0,0,0]=2 1815 B16R2.44951 Cc1c(C[C@@H](C)O)c2ccccc2n1C Amb32732245 [0,2,0,0,0,0|1,0,0]=3 1816 B16R2.44951 Cc1c(C[C@H](C)N)c2ccccc2n1C Amb32732247 [0,2,0,0,0,0|0,0,0]=2 1817 B16R2.44951 Cc1c(C[C@H](C)O)c2ccccc2n1C Amb32732246 [0,2,0,0,0,0|1,0,0]=3 1818 B16R2.44951 Cc1c(NC(C)C)c2ccccc2n1C Amb31173001 [0,2,0,0,0,0|2,0,0]=4 1819 B16R2.495 CC(N)C(C)(C)c1coc2ccccc12 Amb31116518 [0,2,0,0,0,0|1,0,0]=3 1820 B16R2.495 CC(N)C(C)(C)c1csc2ccccc12 Amb31162089 [0,2,0,0,0,0|1,0,0]=3 1821 B16R2.104521 CC(Br)C(=O)c1cn(C)c2ccccc12 Amb8838050 [0,2,0,0,0,0|1,0,1]=4 1822 B16R2.104521 CC(C)C(=O)c1cn(C)c2ccccc12 Amb9214481 [0,2,0,0,0,0|1,0,1]=4 1823 B16R2.104521 CC(C)C(N)c1cn(C)c2ccccc12 Amb18064522 [0,2,0,0,0,0|1,0,0]=3 1824 B16R2.104521 CC(N)C(=O)c1cn(C)c2ccccc12 Amb18566524 [0,2,0,0,0,0|0,0,1]=3 1825 B16R2.104521 CC(N)C(=O)c1cn(C)c2ncccc12 Amb32881130 [0,2,0,0,0,0|1,0,1]=4 1826 B16R2.104521 CC(N)C(=O)c1nn(C)c2ccccc12 Amb33474165 [0,2,0,0,0,0|1,0,1]=4 1827 B16R2.104521 CC(O)C(=O)c1cn(C)c2ccccc12 Amb31116459 [0,2,0,0,0,0|1,0,1]=4 1828 B16R2.104521 Cn1cc(C(N)C(F)F)c2ccccc21 Amb33008935 [0,2,0,0,0,0|2,0,0]=4 1829 B16R2.104521 Cn1cc(C(O)C(F)F)c2ccccc21 Amb32748972 [0,2,0,0,0,0|2,0,0]=4 1830 B16R2.104521 Cn1cc(C(O)C(N)=O)c2ccccc21 Amb31129169 [0,2,0,0,0,0|1,0,1]=4 1831 B16R2.97889 CC(=O)Cc1cn(C)c2ccc(Br)cc12 Amb18247401 [0,2,0,0,0,0|1,0,1]=4 1832 B16R2.97889 CC(=O)Cc1cn(C)c2ccc(C)cc12 Amb18894714 [0,2,0,0,0,0|1,0,1]=4 1833 B16R2.97889 CC(=O)Cc1cn(C)c2ccc(Cl)cc12 Amb18244776 [0,2,0,0,0,0|1,0,1]=4 1834 B16R2.97889 CC(=O)Cc1cn(C)c2ccc(F)cc12 Amb18895338 [0,2,0,0,0,0|1,0,1]=4 1835 B16R2.97889 CC(N)Cc1cn(C)c2ccc(Br)cc12 Amb18064359 [0,2,0,0,0,0|0,0,0]=2 1836 B16R2.97889 CC(N)Cc1cn(C)c2ccc(Cl)cc12 Amb18064358 [0,2,0,0,0,0|0,0,0]=2 1837 B16R2.97889 CC(N)Cc1cn(C)c2ccc(F)cc12 Amb21955609 [0,2,0,0,0,0|0,0,0]=2 1838 B16R2.97889 CC(N)Cc1cn(C)c2ccc(F)cc12 Amb830802 [0,2,0,0,0,0|0,0,0]=2 1839 B16R2.97889 Cc1ccc2c(c1)c(CC(C)N)cn2C Amb824528 [0,2,0,0,0,0|0,0,0]=2 1840 B16R2.97889 Cc1ccc2c(c1)c(CC(N)=O)cn2C Amb18894828 [0,2,0,0,0,0|1,0,1]=4 1841 B16R2.97889 Cn1cc(CC(N)=O)c2cc(Br)ccc21 Amb18906161 [0,2,0,0,0,0|1,0,1]=4 1842 B16R2.97889 Cn1cc(CC(N)=O)c2cc(Cl)ccc21 Amb18896920 [0,2,0,0,0,0|1,0,1]=4 1843 B16R2.97889 Cn1cc(CC(N)=O)c2cc(F)ccc21 Amb18895478 [0,2,0,0,0,0|1,0,1]=4 1844 B16R2.22914 CC(=O)Cc1cn(C)c2c(Br)cccc12 Amb18247405 [0,2,0,0,0,0|1,0,1]=4 1845 B16R2.22914 CC(=O)Cc1cn(C)c2c(C)cccc12 Amb18894721 [0,2,0,0,0,0|1,0,1]=4 1846 B16R2.22914 CC(=O)Cc1cn(C)c2c(Cl)cccc12 Amb18244788 [0,2,0,0,0,0|1,0,1]=4 1847 B16R2.22914 CC(=O)Cc1cn(C)c2c(F)cccc12 Amb18895341 [0,2,0,0,0,0|1,0,1]=4 1848 B16R2.22914 CC(N)Cc1cn(C)c2c(Br)cccc12 Amb18906177 [0,2,0,0,0,0|0,0,0]=2 1849 B16R2.22914 CC(N)Cc1cn(C)c2c(Cl)cccc12 Amb18064368 [0,2,0,0,0,0|0,0,0]=2 1850 B16R2.22914 CC(N)Cc1cn(C)c2c(F)cccc12 Amb18064367 [0,2,0,0,0,0|0,0,0]=2 1851 B16R2.22914 Cc1cccc2c(CC(C)N)cn(C)c12 Amb820137 [0,2,0,0,0,0|0,0,0]=2 1852 B16R2.22914 Cc1cccc2c(CC(N)=O)cn(C)c12 Amb18894831 [0,2,0,0,0,0|1,0,1]=4 1853 B16R2.22914 Cn1cc(CC(N)=O)c2cccc(Br)c21 Amb18247408 [0,2,0,0,0,0|1,0,1]=4 1854 B16R2.22914 Cn1cc(CC(N)=O)c2cccc(Cl)c21 Amb18244900 [0,2,0,0,0,0|1,0,1]=4 1855 B16R2.22914 Cn1cc(CC(N)=O)c2cccc(F)c21 Amb18895480 [0,2,0,0,0,0|1,0,1]=4 1856 B16R2.75436 CCn1cc(CC(C)N)c2ccccc21 Amb823792 [0,2,0,0,0,0|0,0,0]=2 1857 B14R2.52 CN1CC(N)CCc2ccccc21 Amb27865408 [0,0,1,1,0,0|0,0,2]=4 1858 B14R2.450 CC(N)c1cc2ccccc2n1C Amb27442888 [0,0,1,1,0,0|0,0,2]=4 1859 B14R2.450 C[C@@H](N)c1cc2ccccc2n1C Amb24533858 [0,0,1,1,0,0|0,0,2]=4 1860 B14R2.450 C[C@H](N)c1cc2ccccc2n1C Amb27858330 [0,0,1,1,0,0|0,0,2]=4 1861 B14R2.781 CC(N)c1ccc2ccccc2c1 Amb1211899 [0,0,1,1,0,0|1,0,1]=4 1862 B14R2.781 CC(N)c1ccc2ccccc2c1 Amb6239355 [0,0,1,1,0,0|1,0,1]=4 1863 B14R2.781 CC(N)c1cnc2ccccc2c1 Amb18944280 [0,0,1,1,0,0|0,0,2]=4 1864 B14R2.781 C[C@@H](N)c1ccc2ccccc2c1 Amb13951472 [0,0,1,1,0,0|1,0,1]=4 1865 B14R2.781 C[C@@H](N)c1ccc2ccccc2c1 Amb3941411 [0,0,1,1,0,0|1,0,1]=4 1866 B14R2.781 C[C@@H](N)c1cnc2ccccc2c1 Amb25250663 [0,0,1,1,0,0|0,0,2]=4 1867 B14R2.781 C[C@H](N)c1ccc2ccccc2c1 Amb2611666 [0,0,1,1,0,0|1,0,1]=4 1868 B14R2.781 C[C@H](N)c1cnc2ccccc2c1 Amb25791638 [0,0,1,1,0,0|0,0,2]=4 1869 B14R2.1073 C=Cc1cccc2c1CCC(C)N2 Amb27427074 [0,0,1,1,0,0|1,0,1]=4 1870 B14R2.1073 C=Cc1cccc2c1CC[C@@H](C)N2 Amb28200033 [0,0,1,1,0,0|1,0,1]=4 1871 B14R2.1073 C=Cc1cccc2c1CC[C@@H](N)C2 Amb28250839 [0,0,1,1,0,0|1,0,1]=4 1872 B14R2.1073 C=Cc1cccc2c1CC[C@H](C)N2 Amb27162421 [0,0,1,1,0,0|1,0,1]=4 1873 B14R2.1073 C=Cc1cccc2c1NCC(N)C2 Amb27248443 [0,0,1,1,0,0|2,0,0]=4 1874 B14R2.1073 C=Cc1cccc2c1NC[C@@H](N)C2 Amb27273106 [0,0,1,1,0,0|2,0,0]=4 1875 B14R2.256 Nc1ccccc1[C@@H]2CC[C@H](N)C2 Amb28348473 [0,0,1,1,0,0|0,0,2]=4 1876 B14R2.4618 NC1CC1C(=O)c2ccccc2Cl Amb27466207 [0,0,1,1,0,0|2,0,0]=4 1877 B14R2.29496 C=C1CC(C)(C)Oc2ccccc21 Amb27245784 [0,0,1,1,0,0|2,0,0]=4 1878 B14R2.29496 CC1(C)CC(=O)c2ccccc2N1 Amb22754743 [0,0,1,1,0,0|2,0,0]=4 1879 B14R2.19 CC1CN=C(Nc2ccccc2)S1 Amb6572669 [0,0,1,1,0,0|2,0,0]=4 1880 B14R2.19 CC1COC(Nc2ccccc2)=N1 Amb27798313 [0,0,1,1,0,0|1,0,1]=4 1881 B14R2.19 C[C@H]1CN\C(=N\c2ccccc2)N1 Amb27204640 [0,0,1,1,0,0|1,0,1]=4 1882 B14R2.19 NC1CC\C(=C\c2ccccc2)C1 Amb27830475 [0,0,1,1,0,0|1,0,1]=4 1883 B14R2.21 CC1CCCN(c2ccccc2)N1 Amb13949053 [0,0,1,1,0,0|0,0,2]=4 1884 B14R2.21 C[C@@H]1CC=C[C@@H](c2ccccc2)N1 Amb27647684 [0,0,1,1,0,0|1,0,0]=3 1885 B14R2.21 NC1CCCN(c2ccccc2)C1 Amb19303052 [0,0,1,1,0,0|0,0,2]=4 1886 B14R2.21 N[C@H]1CCCN(c2ccccc2)C1 Amb17134823 [0,0,1,1,0,0|0,0,2]=4 1887 B14R2.436 NC1CC(CNc2ccccc2)C1 Amb35644417 [0,0,1,1,0,0|0,0,2]=4 1888 B14R2.436 N[C@H]1C[C@@H](CNc2ccccc2)C1 Amb30040082 [0,0,1,1,0,0|0,0,2]=4 1889 B14R2.436 N[C@H]1C[C@H](CNc2ccccc2)C1 Amb29880060 [0,0,1,1,0,0|0,0,2]=4 1890 B14R2.31359 CC(N)c1cccc2ccccc12 Amb1995283 [0,0,1,1,0,0|1,0,1]=4 1891 B14R2.31359 CC(N)c1cccc2ccccc12 Amb22001977 [0,0,1,1,0,0|1,0,1]=4 1892 B14R2.31359 CC(N)c1ccnc2ccccc12 Amb18825339 [0,0,1,1,0,0|0,0,2]=4 1893 B14R2.31359 C[C@@H](N)c1cccc2ccccc12 Amb19944601 [0,0,1,1,0,0|1,0,1]=4 1894 B14R2.31359 C[C@@H](N)c1cccc2ccccc12 Amb2720577 [0,0,1,1,0,0|1,0,1]=4 1895 B14R2.31359 C[C@@H](N)c1cccc2ccccc12 Amb32405684 [0,0,1,1,0,0|1,0,1]=4 1896 B14R2.31359 C[C@@H](N)c1ccnc2ccccc12 Amb27786914 [0,0,1,1,0,0|0,0,2]=4 1897 B14R2.31359 C[C@H](N)c1cccc2ccccc12 Amb19944602 [0,0,1,1,0,0|1,0,1]=4 1898 B14R2.31359 C[C@H](N)c1cccc2ccccc12 Amb3940164 [0,0,1,1,0,0|1,0,1]=4 1899 B14R2.31359 C[C@H](N)c1ccnc2ccccc12 Amb24493993 [0,0,1,1,0,0|0,0,2]=4 1900 B14R2.768 CC(Br)Cc1cn2ccccc2n1 Amb33432461 [0,0,1,1,0,0|2,0,0]=4 1901 B14R2.768 CC(N)Cc1cc2ccccc2s1 Amb19649530 [0,0,1,1,0,0|2,0,0]=4 1902 B14R2.768 CC(N)Cc1cc2ccccn2c1 Amb5736009 [0,0,1,1,0,0|0,0,0]=2 1903 B14R2.768 CC(N)Cc1cn2ccccc2n1 Amb17212751 [0,0,1,1,0,0|1,0,0]=3 1904 B14R2.768 CC(O)Cc1cn2ccccc2n1 Amb33447811 [0,0,1,1,0,0|2,0,0]=4 1905 B14R2.768 C[C@@H](N)Cc1cc2ccccc2s1 Amb33449035 [0,0,1,1,0,0|2,0,0]=4 1906 B14R2.768 C[C@@H](N)Cc1cc2ncccn2n1 Amb33144088 [0,0,1,1,0,0|2,0,0]=4 1907 B14R2.768 C[C@@H](N)Cc1cn2ccccc2n1 Amb33447335 [0,0,1,1,0,0|1,0,0]=3 1908 B14R2.768 C[C@@H](O)Cc1cn2ccccc2n1 Amb33447332 [0,0,1,1,0,0|2,0,0]=4 1909 B14R2.768 C[C@H](N)Cc1cc2ccccc2s1 Amb33312831 [0,0,1,1,0,0|2,0,0]=4 1910 B14R2.768 C[C@H](N)Cc1cc2ncccn2n1 Amb33144087 [0,0,1,1,0,0|2,0,0]=4 1911 B14R2.768 C[C@H](N)Cc1cn2ccccc2n1 Amb33447334 [0,0,1,1,0,0|1,0,0]=3 1912 B14R2.768 C[C@H](O)Cc1cn2ccccc2n1 Amb33447333 [0,0,1,1,0,0|2,0,0]=4 1913 B14R2.598 CC1CC(c2ccccc2)C(=O)N1 Amb28342413 [0,0,1,1,0,0|1,0,1]=4 1914 B14R2.598 CC1CN(c2ccccc2)C(=N)N1 Amb27630410 [0,0,1,1,0,0|1,0,1]=4 1915 B14R2.598 CC1CN(c2ccccc2)C(=O)N1 Amb27851502 [0,0,1,1,0,0|2,0,0]=4 1916 B14R2.598 NC1CC(=O)N(c2ccccc2)C1 Amb17845256 [0,0,1,1,0,0|2,0,0]=4 1917 B14R2.598 NC1CC(=O)N(c2ccccc2)C1 Amb7173110 [0,0,1,1,0,0|2,0,0]=4 1918 B14R2.45179 CC1(C)C\C(=N\N)c2ccccc21 Amb27206366 [0,0,1,1,0,0|2,0,0]=4 1919 B14R2.1008 CC(N)Cc1ccc2ccoc2c1 Amb27799281 [0,0,1,1,0,0|2,0,0]=4 1920 B14R2.1008 CC(N)Cc1ccc2occc2c1 Amb18676616 [0,0,1,1,0,0|2,0,0]=4 1921 B14R2.1008 CC(N)Cc1ccc2occc2c1 Amb22410847 [0,0,1,1,0,0|2,0,0]=4 1922 B14R2.1008 CC(N)Cc1ccc2sccc2c1 Amb18675376 [0,0,1,1,0,0|2,0,0]=4 1923 B14R2.1008 C[C@@H](N)Cc1cnc2ccnn2c1 Amb33341019 [0,0,1,1,0,0|2,0,0]=4 1924 B14R2.1008 C[C@H](N)Cc1ccc2occc2c1 Amb28313286 [0,0,1,1,0,0|2,0,0]=4 1925 B14R2.1008 C[C@H](N)Cc1cnc2ccnn2c1 Amb33341018 [0,0,1,1,0,0|2,0,0]=4 1926 B14R2.9440 CC(N)Cc1cccc2ccnn12 Amb24667952 [0,0,1,1,0,0|1,0,1]=4 1927 B14R2.9440 CC(N)Cc1cccc2ccsc12 Amb27771374 [0,0,1,1,0,0|1,0,0]=3 1928 B14R2.9440 CC(N)Cc1cccc2cnsc12 Amb35583419 [0,0,1,1,0,0|2,0,0]=4 1929 B14R2.9440 CN(N)Cc1cccc2ccsc12 Amb27240260 [0,0,1,1,0,0|2,0,0]=4 1930 B14R3.7 NC1CC12CNc3ccccc32 Amb32701108 [1,0,0,1,0,0|0,0,2]=4 1931 B14R3.49 C1=C2C(=Nc3ccccc32)CC1 Amb27423983 [1,0,0,1,0,0|0,0,2]=4 1932 B14R3.49 c1ccc2c(c1)NC3=NCCC32 Amb28243983 [1,0,0,1,0,0|0,0,2]=4 1933 B14R3.49 c1ccc2c(c1)NC3=NCCN32 Amb17873449 [1,0,0,1,0,0|1,0,1]=4 1934 B14R3.49 c1ccc2c(c1)NC3=NCCN32 Amb22493775 [1,0,0,1,0,0|1,0,1]=4 1935 B14R3.49 c1ccc2c(c1)NC3CCCC23 Amb22802457 [1,0,0,1,0,0|0,0,2]=4 1936 B14R3.49 c1ccc2c(c1)N[C@@H]3CCC[C@H]23 Amb27647586 [1,0,0,1,0,0|0,0,2]=4 1937 B14R3.49 c1ccc2c(c1)N[C@H]3CCC[C@@H]23 Amb27227996 [1,0,0,1,0,0|0,0,2]=4 1938 B14R3.49 c1ccc2c(c1)cc3n2CCN3 Amb18830470 [1,0,0,1,0,0|2,0,0]=4 1939 B14R3.49 c1ccc2c(c1)nc3n2CCC3 Amb2137051 [1,0,0,1,0,0|1,0,1]=4 1940 B14R3.49 c1ccc2c(c1)nc3n2CCN3 Amb1639394 [1,0,0,1,0,0|1,0,1]=4 1941 B14R3.49 c1ccc2c(c1)sc3[n+]2CCC3 Amb3592064 [1,0,0,1,0,0|2,0,0]=4 1942 B14R3.49 c1ccc2c3c(oc2c1)CNC3 Amb18830377 [1,0,0,1,0,0|2,0,0]=4 1943 B14R3.49 c1ccc2c3c(sc2c1)CNC3 Amb18197009 [1,0,0,1,0,0|2,0,0]=4 1944 B14R3.49 c1ccc2c3c(sc2c1)NCC3 Amb18196943 [1,0,0,1,0,0|1,0,0]=3 1945 B14R3.49 c1ccn2c3c(nc2c1)CCC3 Amb27474098 [1,0,0,1,0,0|1,0,1]=4 1946 B14R3.51 c1ccc2c(C3CO3)csc2c1 Amb18804568 [1,0,0,1,0,0|2,0,0]=4 1947 B14R3.51 c1ccc2c([C@@H]3CO3)csc2c1 Amb33196682 [1,0,0,1,0,0|2,0,0]=4 1948 B14R3.51 c1ccc2c([C@H]3CO3)csc2c1 Amb33196684 [1,0,0,1,0,0|2,0,0]=4 1949 B14R3.51 c1ccc2c(c1)NCC2C3CC3 Amb27270822 [1,0,0,1,0,0|0,0,2]=4 1950 B14R3.51 c1ccc2c(c1)ccn2C3CC3 Amb20248281 [1,0,0,1,0,0|2,0,0]=4 1951 B14R3.51 c1cnc2scc(C3CC3)c2c1 Amb27967633 [1,0,0,1,0,0|2,0,0]=4 1952 B14R3.164 C1=CC2CCCc3cccc1c32 Amb26880106 [1,0,0,1,0,0|1,0,1]=4 1953 B14R3.164 c1cc2c3c(c1)NCC3CCC2 Amb18061640 [1,0,0,1,0,0|0,0,2]=4 1954 B14R3.164 c1cc2c3c(c1)NCN3CCC2 Amb5750777 [1,0,0,1,0,0|1,0,1]=4 1955 B14R3.164 c1cc2c3c(c1)ccn3CCC2 Amb15693411 [1,0,0,1,0,0|2,0,0]=4 1956 B14R3.164 c1cc2c3c(c1)ccn3CCN2 Amb18830472 [1,0,0,1,0,0|2,0,0]=4 1957 B14R3.164 c1cc2c3c(c1)ncn3CCC2 Amb17138472 [1,0,0,1,0,0|1,0,1]=4 1958 B14R3.164 c1cc2c3c(c1)ncn3CCN2 Amb18830342 [1,0,0,1,0,0|1,0,1]=4 1959 B14R3.164 c1cc2c3c(csc3c1)CNC2 Amb18196977 [1,0,0,1,0,0|2,0,0]=4 1960 B14R3.3059 c1ccc2c(c1)NCC23CCC3 Amb24077483 [1,0,0,1,0,0|0,0,2]=4 1961 B14R3.3059 c1ccc2c(c1)NCC23CCC3 Amb26511427 [1,0,0,1,0,0|0,0,2]=4 1962 B16R3.34 NC1CC1Nc2nsc3ccccc23 Amb35717997 [0,0,0,1,0,1|2,0,0]=4 1963 B16R3.67 NC1CN(c2nsc3ccccc23)C1 Amb35717998 [0,0,0,1,0,1|2,0,0]=4 1964 B16R3.1814 c1ccc2c(CNC3CC3)coc2c1 Amb19649834 [0,0,0,1,0,1|2,0,0]=4 1965 B16R3.1814 c1ccc2c(CNC3CC3)csc2c1 Amb19649476 [0,0,0,1,0,1|2,0,0]=4 1966 B16R3.2637 CC1CCn2c(nc3ccccc32)N1 Amb26949300 [0,0,0,1,0,1|1,0,1]=4 1967 B16R3.2273 CC1CN2Cc3ccccc3N=C2N1 Amb28066525 [0,0,0,1,0,1|1,0,1]=4 1968 B16R3.5186 BrC1CC1c2ccc3ccccc3c2 Amb27493617 [0,0,0,1,0,1|2,0,0]=4 1969 B16R3.5186 Br[C@@H]1C[C@H]1c2ccc3ccccc3c2 Amb28347583 [0,0,0,1,0,1|2,0,0]=4 1970 B16R3.5186 NC1CC1c2ccc3ccccc3c2 Amb19373436 [0,0,0,1,0,1|1,0,0]=3 1971 B16R3.5186 NC1CC1c2ccc3ccccc3c2 Amb9677185 [0,0,0,1,0,1|1,0,0]=3 1972 B16R3.5186 NC1CC1c2ccc3ccccc3n2 Amb27419440 [0,0,0,1,0,1|1,0,0]=3 1973 B16R3.5186 NC1CC1c2ccc3cccnc3c2 Amb32953247 [0,0,0,1,0,1|2,0,0]=4 1974 B16R3.5186 NC1CC1c2ccc3ncccc3c2 Amb26521983 [0,0,0,1,0,1|2,0,0]=4 1975 B16R3.5186 NC1CC1c2cnc3ccccc3c2 Amb33474740 [0,0,0,1,0,1|0,0,1]=3 1976 B16R3.5186 NC1CC1c2cnc3ccccc3n2 Amb33377780 [0,0,0,1,0,1|0,0,1]=3 1977 B16R3.5186 N[C@@H]1C[C@@H]1c2ccc3ccccc3c2 Amb34915318 [0,0,0,1,0,1|1,0,0]=3 1978 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3ccccc3c2 Amb26531031 [0,0,0,1,0,1|1,0,0]=3 1979 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3ccccc3c2 Amb33032244 [0,0,0,1,0,1|1,0,0]=3 1980 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3ccccc3n2 Amb33201639 [0,0,0,1,0,1|1,0,0]=3 1981 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3cccnc3c2 Amb32879505 [0,0,0,1,0,1|2,0,0]=4 1982 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3ncccc3c2 Amb33143669 [0,0,0,1,0,1|2,0,0]=4 1983 B16R3.5186 N[C@@H]1C[C@H]1c2cnc3ccccc3c2 Amb33325123 [0,0,0,1,0,1|0,0,1]=3 1984 B16R3.5186 N[C@@H]1C[C@H]1c2cnc3ccccc3n2 Amb33377781 [0,0,0,1,0,1|0,0,1]=3 1985 B16R3.63903 c1ccc2cc(CC3CO3)ccc2c1 Amb33550622 [0,0,0,1,0,1|2,0,0]=4 1986 B16R3.63903 c1ccc2nc(CC3CO3)ccc2c1 Amb33201367 [0,0,0,1,0,1|2,0,0]=4 1987 B16R3.63903 c1ccc2nc(CC3CO3)cnc2c1 Amb33377315 [0,0,0,1,0,1|1,0,1]=4 1988 B16R3.63903 c1ccc2ncc(CC3CO3)cc2c1 Amb27211730 [0,0,0,1,0,1|1,0,1]=4 1989 B16R3.31 Br[C@@H]1C[C@H]1c2cccc3ccccc23 Amb28119388 [0,0,0,1,0,1|2,0,0]=4 1990 B16R3.31 NC1CC1c2cccc3ccccc23 Amb19346487 [0,0,0,1,0,1|1,0,0]=3 1991 B16R3.31 NC1CC1c2cccc3ccccc23 Amb9677214 [0,0,0,1,0,1|1,0,0]=3 1992 B16R3.31 NC1CC1c2cccc3cnccc23 Amb33358679 [0,0,0,1,0,1|2,0,0]=4 1993 B16R3.31 NC1CC1c2ccnc3ccccc23 Amb25726504 [0,0,0,1,0,1|0,0,1]=3 1994 B16R3.31 N[C@@H]1C[C@H]1c2cccc3ccccc23 Amb26003650 [0,0,0,1,0,1|1,0,0]=3 1995 B16R3.31 N[C@@H]1C[C@H]1c2cccc3ccccc23 Amb33032252 [0,0,0,1,0,1|1,0,0]=3 1996 B16R3.31 N[C@@H]1C[C@H]1c2cccc3cnccc23 Amb32724672 [0,0,0,1,0,1|2,0,0]=4 1997 B16R3.31 N[C@@H]1C[C@H]1c2ccnc3ccccc23 Amb33146001 [0,0,0,1,0,1|0,0,1]=3 1998 B16R3.1817 c1ccc2c(CC3CO3)cccc2c1 Amb24744373 [0,0,0,1,0,1|2,0,0]=4 1999 B16R3.1817 c1ccc2c(CC3CO3)ccnc2c1 Amb33145349 [0,0,0,1,0,1|1,0,1]=4 2000 B16R3.27088 CC1Cc2ncnc3cccc(c23)N1 Amb10569053 [0,0,0,1,0,1|0,0,1]=3 2001 B16R3.27088 CC1Nc2cccc3cccc(c23)N1 Amb27749168 [0,0,0,1,0,1|2,0,0]=4 2002 B16R3.27088 NN1Cc2cccc3cccc(c23)C1 Amb18648936 [0,0,0,1,0,1|2,0,0]=4 2003 B16R3.50 NC1CCC1c2coc3ccccc23 Amb35583424 [0,1,0,1,0,0|1,0,0]=3 2004 B16R3.160 CC1CN2CNc3cccc(c32)CN1 Amb27831410 [0,1,0,1,0,0|1,0,1]=4 2005 B16R3.160 CC1Cn2cnc3cccc(c32)CN1 Amb27747011 [0,1,0,1,0,0|1,0,1]=4 2006 B16R3.1813 c1ccc2c(CC3CNC3)coc2c1 Amb27263490 [0,1,0,1,0,0|1,0,0]=3 2007 B16R3.1813 c1ccc2c(CC3CNC3)csc2c1 Amb28044588 [0,1,0,1,0,0|1,0,0]=3 2008 B16R3.1813 c1ccc2c(OC3CNC3)csc2c1 Amb33196990 [0,1,0,1,0,0|2,0,0]=4 2009 B16R3.1813 c1ccn2c(CC3CNC3)cnc2c1 Amb33274392 [0,1,0,1,0,0|1,0,1]=4 2010 B16R3.1813 c1ccn2ncc(CC3CNC3)c2c1 Amb33147905 [0,1,0,1,0,0|1,0,1]=4 2011 B16R3.1999 ClCC1CC1c2csc3ccccc23 Amb27590738 [0,1,0,1,0,0|2,0,0]=4 2012 B16R3.1999 NCC1CC1c2cnc3ccccn23 Amb33147455 [0,1,0,1,0,0|1,0,1]=4 2013 B16R3.1999 NCC1CC1c2cnn3ccccc23 Amb33147076 [0,1,0,1,0,0|1,0,1]=4 2014 B16R3.1999 NCC1CC1c2csc3ccccc23 Amb26983655 [0,1,0,1,0,0|1,0,0]=3 2015 B16R3.1999 NC[C@@H]1C[C@H]1c2cnc3ccccn23 Amb33146686 [0,1,0,1,0,0|1,0,1]=4 2016 B16R3.1999 NC[C@@H]1C[C@H]1c2cnn3ccccc23 Amb33147077 [0,1,0,1,0,0|1,0,1]=4 2017 B16R3.1999 NC[C@@H]1C[C@H]1c2csc3ccccc23 Amb33196987 [0,1,0,1,0,0|1,0,0]=3 2018 B16R3.2583 CC1CNc2nc3ccccc3n2C1 Amb25848978 [0,1,0,1,0,0|1,0,1]=4 2019 B16R3.2583 CC1Cn2c(nc3ccccc32)CN1 Amb26038757 [0,1,0,1,0,0|1,0,1]=4 2020 B16R3.2583 NC1CCC2Nc3ccccc3C2C1 Amb27246761 [0,1,0,1,0,0|0,0,2]=4 2021 B16R3.2583 NC1CCc2cc3ccccc3n2C1 Amb27858859 [0,1,0,1,0,0|2,0,0]=4 2022 B16R3.12359 NC1(Cc2cnc3ccccn23)CC1 Amb33274001 [0,1,0,1,0,0|1,0,1]=4 2023 B16R3.12359 NC1(Cc2cnn3ccccc23)CC1 Amb33147527 [0,1,0,1,0,0|1,0,1]=4 2024 B16R3.12359 NC1(Cc2csc3ccccc23)CC1 Amb24443213 [0,1,0,1,0,0|1,0,0]=3 2025 B16R3.12359 NC1(Cn2ccc3ccccc32)CC1 Amb27842183 [0,1,0,1,0,0|2,0,0]=4 2026 B16R3.12359 OC1(Cc2csc3ccccc23)CC1 Amb33197001 [0,1,0,1,0,0|2,0,0]=4 2027 B16R3.43152 CN[C@@H]1Cc2cccc3ncn(c23)C1 Amb26457679 [0,1,0,1,0,0|1,0,1]=4 2028 B16R3.43152 CN[C@H]1Cc2cccc3ncn(c23)C1 Amb27482624 [0,1,0,1,0,0|1,0,1]=4 2029 B16R3.16774 CC1(C)Cn2c(nc3ccccc32)N1 Amb20413962 [0,1,0,1,0,0|1,0,1]=4 2030 B16R3.3517 Cn1nc2ccccc2c1C3CC3N Amb33312015 [0,1,0,1,0,0|1,0,1]=4 2031 B16R3.3517 Cn1nc2ccccc2c1[C@@H]3C[C@H]3N Amb33312016 [0,1,0,1,0,0|1,0,1]=4 2032 B16R3.3518 O=C1Nc2ccccc2C13CC(O)C3 Amb27651847 [0,1,0,1,0,0|1,0,1]=4 2033 B16R3.3519 O=C1Nc2ccccc2N1CC3CC3 Amb22752577 [0,1,0,1,0,0|2,0,0]=4 2034 B16R3.3519 O=C1Nc2ccccc2\C1=C/C3CC3 Amb27875204 [0,1,0,1,0,0|1,0,1]=4 2035 B16R3.53461 NC1Cc2cccc3c2C(C1)C(=O)N3 Amb27388046 [0,1,0,1,0,0|0,0,1]=3 2036 B16R3.53461 NC1Cc2cccn3nc(Cl)c(c23)C1 Amb27874729 [0,1,0,1,0,0|1,0,1]=4 2037 B16R3.53461 N[C@@H]1Cc2cccc3c2N(C1)C(=O)N3 Amb27875158 [0,1,0,1,0,0|1,0,0]=3 2038 B16R3.2057 N[C@@H](c1csc2ccccc12)C3CC3 Amb27461985 [0,1,0,1,0,0|2,0,0]=4 2039 B16R3.2057 N[C@H](c1coc2ccccc12)C3CC3 Amb28423505 [0,1,0,1,0,0|2,0,0]=4 2040 B16R3.2057 OC(c1csc2ccccc12)C3CC3 Amb28350814 [0,1,0,1,0,0|2,0,0]=4 2041 B16R3.2347 CC1CC1(O)c2coc3ccccc23 Amb27244074 [0,1,0,1,0,0|2,0,0]=4 2042 B16R3.53716 CC1Nc2cccc3ncn(c23)C1C Amb28250662 [0,1,0,1,0,0|1,0,1]=4 2043 B16R3.53716 C[C@@H]1Nc2cccc3ncn(c23)[C@@H]1C Amb27767962 [0,1,0,1,0,0|1,0,1]=4 2044 B16R3.52767 Cn1cc(CC2CO2)c3ccccc31 Amb33319509 [0,1,0,1,0,0|1,0,0]=3 2045 B16R3.52767 Cn1cc(CC2CO2)c3cccnc31 Amb32879788 [0,1,0,1,0,0|2,0,0]=4 2046 B16R3.52767 Cn1cc(NC2CC2)c3ccccc31 Amb24359069 [0,1,0,1,0,0|2,0,0]=4 2047 B16R3.52767 Cn1nc(CC2CO2)c3ccccc31 Amb33196403 [0,1,0,1,0,0|2,0,0]=4 2048 B16R3.546696 Cn1cc(C2CC2N)c3ccccc31 Amb18863197 [0,1,0,1,0,0|0,0,0]=2 2049 B16R3.546696 Cn1cc(C2CC2N)c3cccnc31 Amb32880456 [0,1,0,1,0,0|1,0,0]=3 2050 B16R3.546696 Cn1cc([C@@H]2C[C@H]2N)c3ccccc31 Amb33319838 [0,1,0,1,0,0|0,0,0]=2 2051 B16R3.546696 Cn1cc([C@@H]2C[C@H]2N)c3cccnc31 Amb32880457 [0,1,0,1,0,0|1,0,0]=3 2052 B16R3.546696 Cn1nc(C2CC2N)c3ccccc31 Amb33196751 [0,1,0,1,0,0|1,0,0]=3 2053 B16R3.546696 Cn1nc([C@@H]2C[C@H]2N)c3ccccc31 Amb33196752 [0,1,0,1,0,0|1,0,0]=3 2054 B12R1.75 C#Cc1ccccc1CC(C)N Amb26027254 [0,0,1,0,1,0|1,0,1]=4 2055 B12R1.75 C#Cc1ccccc1C[C@@H](C)N Amb33203583 [0,0,1,0,1,0|1,0,1]=4 2056 B12R1.75 C#Cc1ccccc1C[C@H](C)N Amb33203582 [0,0,1,0,1,0|1,0,1]=4 2057 B12R1.75 C=Cc1ccccc1CC(C)N Amb28045731 [0,0,1,0,1,0|1,0,0]=3 2058 B12R1.75 C=Cc1cccnc1CC(C)N Amb25688953 [0,0,1,0,1,0|2,0,0]=4 2059 B12R1.75 C=Cc1ccncc1CC(C)N Amb28047400 [0,0,1,0,1,0|2,0,0]=4 2060 B12R1.75 C=Cc1cnccc1CC(C)N Amb26375635 [0,0,1,0,1,0|2,0,0]=4 2061 B12R1.75 CC(N)Cc1ccccc1C#N Amb27791969 [0,0,1,0,1,0|2,0,0]=4 2062 B12R1.75 CCc1ccccc1C[C@@H](C)N Amb24524719 [0,0,1,0,1,0|1,0,1]=4 2063 B12R1.75 CCc1ccccc1C[C@H](C)N Amb26498566 [0,0,1,0,1,0|1,0,1]=4 2064 B12R1.75 COc1ccccc1CC(C)N Amb2719601 [0,0,1,0,1,0|1,0,1]=4 2065 B12R1.75 COc1ccccc1C[C@@H](C)N Amb13952975 [0,0,1,0,1,0|1,0,1]=4 2066 B12R1.75 COc1ccccc1C[C@@H](C)N Amb30526839 [0,0,1,0,1,0|1,0,1]=4 2067 B12R1.75 CSc1ccccc1CC(C)N Amb28341490 [0,0,1,0,1,0|1,0,1]=4 2068 B12R1.75 CSc1ccccc1CC(C)N Amb31188238 [0,0,1,0,1,0|1,0,1]=4 2069 B12R1.75 CSc1ccccc1C[C@@H](C)N Amb25039285 [0,0,1,0,1,0|1,0,1]=4 2070 B12R1.75 CSc1ccccc1C[C@H](C)N Amb25835778 [0,0,1,0,1,0|1,0,1]=4 2071 B12R1.75 C[C@@H](N)Cc1ccccc1C#N Amb26498641 [0,0,1,0,1,0|2,0,0]=4 2072 B12R1.75 C[C@@H](N)Cc1ccccc1CO Amb27217636 [0,0,1,0,1,0|2,0,0]=4 2073 B12R1.75 C[C@H](N)Cc1ccccc1C#N Amb27830632 [0,0,1,0,1,0|2,0,0]=4 2074 B12R1.124 CC(Br)C(=O)c1ccccc1N Amb27240070 [0,0,1,0,1,0|2,0,0]=4 2075 B12R1.124 CC(C)C(=O)c1ccccc1N Amb18645870 [0,0,1,0,1,0|2,0,0]=4 2076 B12R1.124 CC(N)C(=O)c1ccccc1Br Amb18160374 [0,0,1,0,1,0|2,0,0]=4 2077 B12R1.124 CC(N)C(=O)c1ccccc1Cl Amb18823031 [0,0,1,0,1,0|2,0,0]=4 2078 B12R1.124 CC(N)C(=O)c1ccccc1F Amb18827241 [0,0,1,0,1,0|2,0,0]=4 2079 B12R1.124 CC(N)C(=O)c1ccccc1O Amb27598048 [0,0,1,0,1,0|2,0,0]=4 2080 B12R1.124 CN(N)C(=O)c1ccccc1N Amb6336642 [0,0,1,0,1,0|2,0,0]=4 2081 B12R1.124 C[C@@H](N)C(=O)c1ccccc1Cl Amb35738376 [0,0,1,0,1,0|2,0,0]=4 2082 B12R1.124 C[C@@H](N)C(=O)c1ccccc1F Amb35618029 [0,0,1,0,1,0|2,0,0]=4 2083 B12R1.124 C[C@@H](N)C(=O)c1cccnc1N Amb35618028 [0,0,1,0,1,0|2,0,0]=4 2084 B12R1.124 C[C@@H](N)C(=O)c1cnccc1N Amb35618027 [0,0,1,0,1,0|2,0,0]=4 2085 B12R1.124 C[C@H](N)C(=O)c1ccccc1Cl Amb35588871 [0,0,1,0,1,0|2,0,0]=4 2086 B12R1.124 C[C@H](N)C(=O)c1ccccc1F Amb30024515 [0,0,1,0,1,0|2,0,0]=4 2087 B12R1.124 C[C@H](N)C(=O)c1cccnc1N Amb30024514 [0,0,1,0,1,0|2,0,0]=4 2088 B12R1.124 C[C@H](N)C(=O)c1cnccc1N Amb30024513 [0,0,1,0,1,0|2,0,0]=4 2089 B12R1.124 C[C@H](N)[C@@H](O)c1ccccc1N Amb27468097 [0,0,1,0,1,0|1,0,1]=4 2090 B12R1.124 Cc1ccccc1C(=O)C(C)N Amb18829245 [0,0,1,0,1,0|2,0,0]=4 2091 B12R1.124 Cc1ccccc1C(=O)[C@@H](C)N Amb35618019 [0,0,1,0,1,0|2,0,0]=4 2092 B12R1.124 Cc1ccccc1C(=O)[C@H](C)N Amb30024486 [0,0,1,0,1,0|2,0,0]=4 2093 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [0,0,1,0,1,0|1,0,1]=4 2094 B12R1.252 CC(=O)\C=C/Nc1ccccc1 Amb28461253 [0,0,1,0,1,0|1,0,1]=4 2095 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [0,0,1,0,1,0|1,0,1]=4 2096 B12R1.252 CC(Br)C\C=C\c1ccccc1 Amb33080969 [0,0,1,0,1,0|1,0,0]=3 2097 B12R1.252 CC(C)CCNc1ccccc1 Amb4016589 [0,0,1,0,1,0|1,0,1]=4 2098 B12R1.252 CC(C)C\C=C\c1ccccn1 Amb27661989 [0,0,1,0,1,0|2,0,0]=4 2099 B12R1.252 CC(Cl)\C=C\Sc1ccccc1 Amb27401898 [0,0,1,0,1,0|2,0,0]=4 2100 B12R1.252 CC(N)CC#Cc1ccccc1 Amb25081198 [0,0,1,0,1,0|0,0,2]=4 2101 B12R1.252 CC(N)CCCc1ccccc1 Amb2721865 [0,0,1,0,1,0|0,0,2]=4 2102 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,0,1,0,1,0|0,0,1]=3 2103 B12R1.252 CC(N)CCNc1ccccn1 Amb27599643 [0,0,1,0,1,0|1,0,1]=4 2104 B12R1.252 CC(N)CCOc1ccccc1 Amb7772215 [0,0,1,0,1,0|1,0,1]=4 2105 B12R1.252 CC(N)CCSc1ccccc1 Amb13881552 [0,0,1,0,1,0|1,0,1]=4 2106 B12R1.252 CC(N)COCc1ccccc1 Amb1124568 [0,0,1,0,1,0|1,0,1]=4 2107 B12R1.252 CC(N)CSCc1ccccc1 Amb18648554 [0,0,1,0,1,0|1,0,1]=4 2108 B12R1.252 CC(N)C\C=C\c1ccccc1 Amb25970039 [0,0,1,0,1,0|0,0,0]=2 2109 B12R1.252 CC(N)C\C=C\c1ccncc1 Amb24540248 [0,0,1,0,1,0|1,0,0]=3 2110 B12R1.252 CC(N)\C=C\Cc1ccccc1 Amb32953143 [0,0,1,0,1,0|1,0,0]=3 2111 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb32954303 [0,0,1,0,1,0|1,0,0]=3 2112 B12R1.252 CC(O)C\C=N\c1ccccc1 Amb27948769 [0,0,1,0,1,0|1,0,1]=4 2113 B12R1.252 CC(O)\C=C\Sc1ccccc1 Amb28294251 [0,0,1,0,1,0|2,0,0]=4 2114 B12R1.252 CN(O)C\C=C\c1ccccc1 Amb33081135 [0,0,1,0,1,0|2,0,0]=4 2115 B12R1.252 C[C@@H](N)CCCc1ccccc1 Amb33081452 [0,0,1,0,1,0|0,0,2]=4 2116 B12R1.252 C[C@@H](N)CCOc1ccccc1 Amb33081226 [0,0,1,0,1,0|1,0,1]=4 2117 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [0,0,1,0,1,0|1,0,1]=4 2118 B12R1.252 C[C@@H](N)C\C=C\c1ccccc1 Amb33080763 [0,0,1,0,1,0|0,0,0]=2 2119 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb32954522 [0,0,1,0,1,0|1,0,0]=3 2120 B12R1.252 C[C@H](N)CCCc1ccccc1 Amb32954284 [0,0,1,0,1,0|0,0,2]=4 2121 B12R1.252 C[C@H](N)CCOc1ccccc1 Amb32954086 [0,0,1,0,1,0|1,0,1]=4 2122 B12R1.252 C[C@H](N)COCc1ccccc1 Amb17061656 [0,0,1,0,1,0|1,0,1]=4 2123 B12R1.252 C[C@H](N)C\C=C\c1ccccc1 Amb33080767 [0,0,1,0,1,0|0,0,0]=2 2124 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb32954836 [0,0,1,0,1,0|1,0,0]=3 2125 B12R1.252 C\C(N)=N\C=C\c1ccccc1 Amb28457490 [0,0,1,0,1,0|1,0,1]=4 2126 B12R1.252 N=C(N)C\C=C\c1ccccc1 Amb27652946 [0,0,1,0,1,0|1,0,1]=4 2127 B12R1.252 NC(=S)C\C=C\c1ccccc1 Amb25112081 [0,0,1,0,1,0|1,0,1]=4 2128 B12R1.478 CC(=O)\C(=C/N)c1ccccc1 Amb17777807 [0,0,1,0,1,0|1,0,1]=4 2129 B12R1.478 CC(=O)\C(=C\N)c1ccccc1 Amb25238332 [0,0,1,0,1,0|1,0,1]=4 2130 B12R1.478 CC(N)C(CN)c1ccccc1 Amb28458249 [0,0,1,0,1,0|0,0,2]=4 2131 B12R1.478 CC(N)\C(=C\Cl)c1ccccc1 Amb24670393 [0,0,1,0,1,0|1,0,0]=3 2132 B12R1.478 C\C=C(/c1ccccc1)C(C)O Amb27605428 [0,0,1,0,1,0|2,0,0]=4 2133 B12R1.1392 NC(=O)CC1=CC=CC=CC=C1 Amb24607336 [0,0,1,0,1,0|1,0,1]=4 2134 B12R2.931 N#CCC1=Cc2ccccc21 Amb26423043 [1,0,0,0,1,0|0,0,2]=4 2135 B12R2.931 NCCC1=Cc2ccccc21 Amb27866978 [1,0,0,0,1,0|0,0,0]=2 2136 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [1,0,0,0,1,0|1,0,0]=3 2137 B12R2.3190 CC(N)C1Cc2ccccc21 Amb33527560 [0,0,0,0,2,0|0,0,2]=4 2138 B14R1.160 CC(C)CNC(=O)c1ccccc1N Amb1105963 [0,0,1,0,0,1|2,0,0]=4 2139 B14R1.160 CC(C)COC(=O)c1ccccc1N Amb2688908 [0,0,1,0,0,1|2,0,0]=4 2140 B14R1.160 CC(N)CNC(=O)c1ccccc1Cl Amb18112224 [0,0,1,0,0,1|2,0,0]=4 2141 B14R1.160 CC(N)CNC(=O)c1ccccc1I Amb27417228 [0,0,1,0,0,1|2,0,0]=4 2142 B14R1.160 C[C@H](N)CNC(=O)c1ccccc1O Amb27858876 [0,0,1,0,0,1|2,0,0]=4 2143 B14R1.337 CC(C)CC(=O)Nc1ccccc1N Amb1117476 [0,0,1,0,0,1|2,0,0]=4 2144 B14R1.337 CC(Cl)CC(=O)Nc1ccccc1N Amb27849025 [0,0,1,0,0,1|2,0,0]=4 2145 B14R1.337 CC(N)CC(=O)Nc1ccccc1Br Amb26944570 [0,0,1,0,0,1|2,0,0]=4 2146 B14R1.337 CC(N)CC(=O)Nc1ccccc1Cl Amb18289189 [0,0,1,0,0,1|2,0,0]=4 2147 B14R1.337 CC(N)CC(=O)Nc1ccccc1N Amb27443497 [0,0,1,0,0,1|1,0,0]=3 2148 B14R1.540 CC(C)C\C=C(\C=O)c1ccccc1 Amb9826779 [0,0,1,0,0,1|2,0,0]=4 2149 B14R2.112 BrCCc1ccc2ccccc2c1 Amb8439759 [1,0,0,0,0,1|2,0,0]=4 2150 B14R2.112 BrCCc1ccc2ccccc2n1 Amb25113626 [1,0,0,0,0,1|2,0,0]=4 2151 B14R2.112 BrCCc1cnc2ccccc2c1 Amb25847391 [1,0,0,0,0,1|1,0,1]=4 2152 B14R2.112 BrCCc1cnc2ccccc2n1 Amb33227255 [1,0,0,0,0,1|1,0,1]=4 2153 B14R2.112 CCCC1CNc2ccccc2C1 Amb5746106 [1,0,0,0,0,1|0,0,2]=4 2154 B14R2.112 CCC[n+]1ccc2ccccc2c1 Amb9825983 [1,0,0,0,0,1|2,0,0]=4 2155 B14R2.112 CCCc1cc2ccccc2cn1 Amb27462348 [1,0,0,0,0,1|2,0,0]=4 2156 B14R2.112 CCCc1ccc2ccccc2n1 Amb27265534 [1,0,0,0,0,1|1,0,0]=3 2157 B14R2.112 CCCc1ccc2cccnc2n1 Amb27438611 [1,0,0,0,0,1|2,0,0]=4 2158 B14R2.112 CCCc1ccc2ncccc2c1 Amb28067645 [1,0,0,0,0,1|2,0,0]=4 2159 B14R2.112 CCNc1ccc2ccccc2c1 Amb7759811 [1,0,0,0,0,1|2,0,0]=4 2160 B14R2.112 CCNc1cnc2ccccc2n1 Amb18285469 [1,0,0,0,0,1|1,0,1]=4 2161 B14R2.112 CCOc1ccc2ccccc2c1 Amb4017891 [1,0,0,0,0,1|2,0,0]=4 2162 B14R2.112 CCSc1ccc2ccccc2c1 Amb24359866 [1,0,0,0,0,1|2,0,0]=4 2163 B14R2.112 CCSc1ccc2ccccc2n1 Amb27972844 [1,0,0,0,0,1|2,0,0]=4 2164 B14R2.112 CCSc1cnc2ccccc2n1 Amb27594469 [1,0,0,0,0,1|1,0,1]=4 2165 B14R2.112 CNCc1ccc2ccccc2c1 Amb1106022 [1,0,0,0,0,1|2,0,0]=4 2166 B14R2.112 CNCc1ccc2ccccc2n1 Amb6742539 [1,0,0,0,0,1|2,0,0]=4 2167 B14R2.112 CNCc1cnc2ccccc2c1 Amb1995108 [1,0,0,0,0,1|1,0,1]=4 2168 B14R2.112 CNCc1cnc2ccccc2c1 Amb8503260 [1,0,0,0,0,1|1,0,1]=4 2169 B14R2.112 CNCc1cnc2ccccc2n1 Amb3941205 [1,0,0,0,0,1|1,0,1]=4 2170 B14R2.112 CNCc1cnc2ccccc2n1 Amb8503466 [1,0,0,0,0,1|1,0,1]=4 2171 B14R2.112 COCc1cnc2ccccc2c1 Amb28422626 [1,0,0,0,0,1|1,0,1]=4 2172 B14R2.112 CSCc1ccc2ccccc2c1 Amb4006802 [1,0,0,0,0,1|2,0,0]=4 2173 B14R2.112 CSCc1ccc2ccccc2n1 Amb27836677 [1,0,0,0,0,1|2,0,0]=4 2174 B14R2.112 CSCc1cnc2ccccc2n1 Amb27971128 [1,0,0,0,0,1|1,0,1]=4 2175 B14R2.112 ClCCc1cnc2ccccc2c1 Amb19073738 [1,0,0,0,0,1|1,0,1]=4 2176 B14R2.112 NCCC1=COc2ccccc2O1 Amb28436814 [1,0,0,0,0,1|1,0,0]=3 2177 B14R2.112 NCCC1=Cc2ccccc2OC1 Amb27444441 [1,0,0,0,0,1|1,0,1]=4 2178 B14R2.112 NCCC1CNc2ccccc2C1 Amb18196493 [1,0,0,0,0,1|0,0,2]=4 2179 B14R2.112 NCCc1cc2ccccc2cn1 Amb23441235 [1,0,0,0,0,1|2,0,0]=4 2180 B14R2.112 NCCc1cc2ccccc2nn1 Amb27638819 [1,0,0,0,0,1|1,0,1]=4 2181 B14R2.112 NCCc1ccc2ccccc2c1 Amb6245305 [1,0,0,0,0,1|1,0,0]=3 2182 B14R2.112 NCCc1ccc2ccccc2c1 Amb7969583 [1,0,0,0,0,1|1,0,0]=3 2183 B14R2.112 NCCc1ccc2ccccc2n1 Amb6742401 [1,0,0,0,0,1|1,0,0]=3 2184 B14R2.112 NCCc1ccc2ccccc2n1 Amb9182400 [1,0,0,0,0,1|1,0,0]=3 2185 B14R2.112 NCCc1ccc2cccnc2c1 Amb18353295 [1,0,0,0,0,1|2,0,0]=4 2186 B14R2.112 NCCc1ccc2cnccc2c1 Amb18353186 [1,0,0,0,0,1|2,0,0]=4 2187 B14R2.112 NCCc1ccc2ncccc2c1 Amb32658737 [1,0,0,0,0,1|2,0,0]=4 2188 B14R2.112 NCCc1ccc2ncccc2c1 Amb33528373 [1,0,0,0,0,1|2,0,0]=4 2189 B14R2.112 NCCc1ccc2ncccc2n1 Amb28242399 [1,0,0,0,0,1|2,0,0]=4 2190 B14R2.112 NCCc1cnc2ccccc2c1 Amb18286590 [1,0,0,0,0,1|0,0,1]=3 2191 B14R2.112 NCCc1cnc2ccccc2c1 Amb32668157 [1,0,0,0,0,1|0,0,1]=3 2192 B14R2.112 NCCc1cnc2ccccc2n1 Amb18825284 [1,0,0,0,0,1|0,0,1]=3 2193 B14R2.112 NCCc1ncc2ccccc2n1 Amb18136765 [1,0,0,0,0,1|2,0,0]=4 2194 B14R2.112 NCCc1nnc2ccccc2n1 Amb18224468 [1,0,0,0,0,1|1,0,1]=4 2195 B14R2.112 NNCc1ccc2ccccc2c1 Amb21954060 [1,0,0,0,0,1|2,0,0]=4 2196 B14R2.112 NNCc1ccc2ccccc2c1 Amb6249128 [1,0,0,0,0,1|2,0,0]=4 2197 B14R2.112 NNCc1ccc2ccccc2c1 Amb8471152 [1,0,0,0,0,1|2,0,0]=4 2198 B14R2.112 NNCc1ccc2ccccc2n1 Amb32660461 [1,0,0,0,0,1|2,0,0]=4 2199 B14R2.112 NNCc1ccc2ccccc2n1 Amb6243381 [1,0,0,0,0,1|2,0,0]=4 2200 B14R2.112 NNCc1cnc2ccccc2c1 Amb10844879 [1,0,0,0,0,1|1,0,1]=4 2201 B14R2.112 NNCc1cnc2ccccc2c1 Amb20669581 [1,0,0,0,0,1|1,0,1]=4 2202 B14R2.112 NNCc1cnc2ccccc2n1 Amb27836119 [1,0,0,0,0,1|1,0,1]=4 2203 B14R2.112 NOCc1ccc2ccccc2c1 Amb33362172 [1,0,0,0,0,1|2,0,0]=4 2204 B14R2.112 NOCc1ccc2ccccc2n1 Amb24466527 [1,0,0,0,0,1|2,0,0]=4 2205 B14R2.112 NOCc1cnc2ccccc2c1 Amb26341250 [1,0,0,0,0,1|1,0,1]=4 2206 B14R2.112 NOCc1cnc2ccccc2n1 Amb26482890 [1,0,0,0,0,1|1,0,1]=4 2207 B14R2.112 OCCc1ccc2ccccc2c1 Amb3939094 [1,0,0,0,0,1|2,0,0]=4 2208 B14R2.112 OCCc1ccc2ccccc2n1 Amb4093502 [1,0,0,0,0,1|2,0,0]=4 2209 B14R2.112 OCCc1cnc2ccccc2c1 Amb18803362 [1,0,0,0,0,1|1,0,1]=4 2210 B14R2.112 OCCc1cnc2ccccc2n1 Amb24061361 [1,0,0,0,0,1|1,0,1]=4 2211 B14R2.112 SCCc1ccc2ccccc2c1 Amb28346891 [1,0,0,0,0,1|2,0,0]=4 2212 B14R2.112 SCCc1ccc2ccccc2n1 Amb26552663 [1,0,0,0,0,1|2,0,0]=4 2213 B14R2.112 SCCc1cnc2ccccc2c1 Amb33320654 [1,0,0,0,0,1|1,0,1]=4 2214 B14R2.112 SCCc1cnc2ccccc2n1 Amb33378880 [1,0,0,0,0,1|1,0,1]=4 2215 B14R2.6370 NCCc1ccc2cccccc12 Amb28137729 [1,0,0,0,0,1|1,0,0]=3 2216 B14R2.7150 BrCCc1cccc2ccccc12 Amb2721035 [1,0,0,0,0,1|2,0,0]=4 2217 B14R2.7150 BrCCc1ccnc2ccccc12 Amb33452102 [1,0,0,0,0,1|1,0,1]=4 2218 B14R2.7150 CCCC1CCNc2ccccc21 Amb27666797 [1,0,0,0,0,1|0,0,2]=4 2219 B14R2.7150 CCCC1CNCc2ccccc21 Amb17400523 [1,0,0,0,0,1|0,0,2]=4 2220 B14R2.7150 CCCN1CCNc2ccccc21 Amb17233228 [1,0,0,0,0,1|1,0,1]=4 2221 B14R2.7150 CCCc1cccc2cccnc12 Amb27630042 [1,0,0,0,0,1|2,0,0]=4 2222 B14R2.7150 CCCc1ncnc2ncccc12 Amb27239124 [1,0,0,0,0,1|1,0,1]=4 2223 B14R2.7150 CCNc1cccc2ccccc12 Amb4313294 [1,0,0,0,0,1|2,0,0]=4 2224 B14R2.7150 CCNc1cnnc2ccccc12 Amb28398291 [1,0,0,0,0,1|1,0,1]=4 2225 B14R2.7150 CCOc1cccc2ccccc12 Amb3100947 [1,0,0,0,0,1|2,0,0]=4 2226 B14R2.7150 CCOc1nccc2ccccc12 Amb24415360 [1,0,0,0,0,1|2,0,0]=4 2227 B14R2.7150 CCOc1ncnc2ccccc12 Amb1420005 [1,0,0,0,0,1|1,0,1]=4 2228 B14R2.7150 CCSc1cccc2ccccc12 Amb28316549 [1,0,0,0,0,1|2,0,0]=4 2229 B14R2.7150 CCSc1ccnc2ccccc12 Amb25924424 [1,0,0,0,0,1|1,0,1]=4 2230 B14R2.7150 CCSc1cnnc2ccccc12 Amb27652486 [1,0,0,0,0,1|1,0,1]=4 2231 B14R2.7150 CCSc1ncnc2ccccc12 Amb1349920 [1,0,0,0,0,1|1,0,1]=4 2232 B14R2.7150 CNCc1cccc2ccccc12 Amb1115895 [1,0,0,0,0,1|2,0,0]=4 2233 B14R2.7150 CNCc1cccc2ccccc12 Amb33531254 [1,0,0,0,0,1|2,0,0]=4 2234 B14R2.7150 CNCc1ccnc2ccccc12 Amb10124833 [1,0,0,0,0,1|1,0,1]=4 2235 B14R2.7150 CNCc1cncc2ccccc12 Amb6572008 [1,0,0,0,0,1|1,0,1]=4 2236 B14R2.7150 CNCc1cnnc2ccccc12 Amb28129862 [1,0,0,0,0,1|1,0,1]=4 2237 B14R2.7150 COCC1=CCNc2ccccc21 Amb27180116 [1,0,0,0,0,1|1,0,0]=3 2238 B14R2.7150 COCc1cccc2ccccc12 Amb28341769 [1,0,0,0,0,1|2,0,0]=4 2239 B14R2.7150 CSCc1cccc2ccccc12 Amb2613722 [1,0,0,0,0,1|2,0,0]=4 2240 B14R2.7150 CSCc1nccc2ccccc12 Amb27188708 [1,0,0,0,0,1|2,0,0]=4 2241 B14R2.7150 ClCCc1ccnc2ccccc12 Amb26487410 [1,0,0,0,0,1|1,0,1]=4 2242 B14R2.7150 ICCc1cccc2ccccc12 Amb27808573 [1,0,0,0,0,1|2,0,0]=4 2243 B14R2.7150 ICCc1ccnc2ccccc12 Amb27986276 [1,0,0,0,0,1|1,0,1]=4 2244 B14R2.7150 NCCC1=CCCc2ccccc21 Amb25067147 [1,0,0,0,0,1|1,0,0]=3 2245 B14R2.7150 NCCC1CCNc2ccccc21 Amb18196480 [1,0,0,0,0,1|0,0,2]=4 2246 B14R2.7150 NCCc1cccc2ccccc12 Amb19373183 [1,0,0,0,0,1|1,0,0]=3 2247 B14R2.7150 NCCc1cccc2ccccc12 Amb6245392 [1,0,0,0,0,1|1,0,0]=3 2248 B14R2.7150 NCCc1cccc2cccnc12 Amb19373703 [1,0,0,0,0,1|2,0,0]=4 2249 B14R2.7150 NCCc1cccc2cccnc12 Amb509764 [1,0,0,0,0,1|2,0,0]=4 2250 B14R2.7150 NCCc1cccc2cccnc12 Amb7969674 [1,0,0,0,0,1|2,0,0]=4 2251 B14R2.7150 NCCc1cccc2cnccc12 Amb18964971 [1,0,0,0,0,1|2,0,0]=4 2252 B14R2.7150 NCCc1cccc2cnccc12 Amb32671126 [1,0,0,0,0,1|2,0,0]=4 2253 B14R2.7150 NCCc1cccc2ncccc12 Amb24089143 [1,0,0,0,0,1|2,0,0]=4 2254 B14R2.7150 NCCc1cccc2ncccc12 Amb33465407 [1,0,0,0,0,1|2,0,0]=4 2255 B14R2.7150 NCCc1ccnc2ccccc12 Amb27980881 [1,0,0,0,0,1|0,0,1]=3 2256 B14R2.7150 NCCc1cncc2ccccc12 Amb19103480 [1,0,0,0,0,1|0,0,1]=3 2257 B14R2.7150 NCCc1nccc2ccccc12 Amb17232900 [1,0,0,0,0,1|1,0,0]=3 2258 B14R2.7150 NCCc1nccc2cccnc12 Amb18197964 [1,0,0,0,0,1|2,0,0]=4 2259 B14R2.7150 NCCc1nccc2ccncc12 Amb18197963 [1,0,0,0,0,1|2,0,0]=4 2260 B14R2.7150 NCCc1nccc2cnccc12 Amb18197965 [1,0,0,0,0,1|2,0,0]=4 2261 B14R2.7150 NCCc1nccc2ncccc12 Amb18197962 [1,0,0,0,0,1|2,0,0]=4 2262 B14R2.7150 NCCc1ncnc2ccccc12 Amb18136821 [1,0,0,0,0,1|0,0,1]=3 2263 B14R2.7150 NNCc1cccc2ccccc12 Amb1121466 [1,0,0,0,0,1|2,0,0]=4 2264 B14R2.7150 NNCc1cccc2ccccc12 Amb29083223 [1,0,0,0,0,1|2,0,0]=4 2265 B14R2.7150 NNCc1cccc2ccccc12 Amb7969830 [1,0,0,0,0,1|2,0,0]=4 2266 B14R2.7150 NNCc1ccnc2ccccc12 Amb24641338 [1,0,0,0,0,1|1,0,1]=4 2267 B14R2.7150 NNCc1cncc2ccccc12 Amb27249062 [1,0,0,0,0,1|1,0,1]=4 2268 B14R2.7150 NNCc1nccc2ccccc12 Amb18183759 [1,0,0,0,0,1|2,0,0]=4 2269 B14R2.7150 NOCc1cccc2ccccc12 Amb24723127 [1,0,0,0,0,1|2,0,0]=4 2270 B14R2.7150 NOCc1ccnc2ccccc12 Amb26571116 [1,0,0,0,0,1|1,0,1]=4 2271 B14R2.7150 NOCc1nccc2ccccc12 Amb27186212 [1,0,0,0,0,1|2,0,0]=4 2272 B14R2.7150 OCCC1=CCOc2ccccc21 Amb26347434 [1,0,0,0,0,1|2,0,0]=4 2273 B14R2.7150 OCCN1C=CNc2ccccc21 Amb17774687 [1,0,0,0,0,1|2,0,0]=4 2274 B14R2.7150 OCCc1cccc2ccccc12 Amb2613650 [1,0,0,0,0,1|2,0,0]=4 2275 B14R2.7150 OCCc1ccnc2ccccc12 Amb33544145 [1,0,0,0,0,1|1,0,1]=4 2276 B14R2.7150 OCCc1cncc2ccccc12 Amb27166929 [1,0,0,0,0,1|1,0,1]=4 2277 B14R2.7150 OCCc1ncnc2ccccc12 Amb27762912 [1,0,0,0,0,1|1,0,1]=4 2278 B14R2.7150 SCCc1cccc2ccccc12 Amb25757447 [1,0,0,0,0,1|2,0,0]=4 2279 B14R2.7150 SCCc1ccnc2ccccc12 Amb26448488 [1,0,0,0,0,1|1,0,1]=4 2280 B14R2.7150 [SiH3]CCc1ccnc2ccccc12 Amb27962604 [1,0,0,0,0,1|0,1,1]=4 2281 B16R2.36 CC(C)CNCc1csc2ccccc12 Amb28963525 [0,0,0,0,0,2|2,0,0]=4 2282 B16R2.36 CC(O)CNCc1csc2ccccc12 Amb19027872 [0,0,0,0,0,2|2,0,0]=4 2283 B16R2.477 CC(C)CNc1cnc2ccccc2c1 Amb9556785 [0,0,0,0,0,2|1,0,1]=4 2284 B16R2.477 CC(C)NCc1ccc2ccccc2c1 Amb6685361 [0,0,0,0,0,2|2,0,0]=4 2285 B16R2.477 CC(C)NCc1cnc2ccccc2c1 Amb7589147 [0,0,0,0,0,2|1,0,1]=4 2286 B16R2.477 CC(Cl)CCc1ccc2ccccc2c1 Amb27873054 [0,0,0,0,0,2|2,0,0]=4 2287 B16R2.477 CC(Cl)CNc1ccc2ccccc2n1 Amb27809548 [0,0,0,0,0,2|2,0,0]=4 2288 B16R2.477 CC(Cl)CNc1cnc2ccccc2n1 Amb27761169 [0,0,0,0,0,2|1,0,1]=4 2289 B16R2.477 CC(N)CCc1ccc2ccccc2c1 Amb33359116 [0,0,0,0,0,2|1,0,0]=3 2290 B16R2.477 CC(N)CCc1ccc2ccccc2n1 Amb32952925 [0,0,0,0,0,2|1,0,0]=3 2291 B16R2.477 CC(N)CCc1ccc2cccnc2c1 Amb33360711 [0,0,0,0,0,2|2,0,0]=4 2292 B16R2.477 CC(N)CCc1ccc2ncccc2c1 Amb33358922 [0,0,0,0,0,2|2,0,0]=4 2293 B16R2.477 CC(N)CCc1cnc2ccccc2c1 Amb19649866 [0,0,0,0,0,2|0,0,1]=3 2294 B16R2.477 CC(N)CCc1cnc2ccccc2n1 Amb33449192 [0,0,0,0,0,2|0,0,1]=3 2295 B16R2.477 CC(N)COc1ccc2ncccc2c1 Amb22642661 [0,0,0,0,0,2|2,0,0]=4 2296 B16R2.477 CC(N)COc1ccc2ncccc2c1 Amb32662159 [0,0,0,0,0,2|2,0,0]=4 2297 B16R2.477 CC(N)\C=C\c1ccc2ccccc2c1 Amb33171935 [0,0,0,0,0,2|1,0,1]=4 2298 B16R2.477 CC(N)\C=C\c1ccc2ccccc2n1 Amb33474364 [0,0,0,0,0,2|1,0,1]=4 2299 B16R2.477 CC(N)\C=C\c1cnc2ccccc2c1 Amb33319780 [0,0,0,0,0,2|0,0,2]=4 2300 B16R2.477 CC(N)\C=C\c1cnc2ccccc2n1 Amb33474464 [0,0,0,0,0,2|0,0,2]=4 2301 B16R2.477 CC(O)CCc1ccc2ccccc2c1 Amb33429892 [0,0,0,0,0,2|2,0,0]=4 2302 B16R2.477 CC(O)CCc1ccc2ccccc2n1 Amb33450015 [0,0,0,0,0,2|2,0,0]=4 2303 B16R2.477 CC(O)CCc1cnc2ccccc2c1 Amb33172084 [0,0,0,0,0,2|1,0,1]=4 2304 B16R2.477 CC(O)CCc1cnc2ccccc2n1 Amb33079923 [0,0,0,0,0,2|1,0,1]=4 2305 B16R2.477 CC(O)CNc1cnc2ccccc2c1 Amb18933524 [0,0,0,0,0,2|1,0,1]=4 2306 B16R2.477 CC(O)COc1ccc2ccccc2c1 Amb22339930 [0,0,0,0,0,2|2,0,0]=4 2307 B16R2.477 C[C@@H](N)CCc1ccc2ccccc2c1 Amb33474915 [0,0,0,0,0,2|1,0,0]=3 2308 B16R2.477 C[C@@H](N)CCc1ccc2ccccc2n1 Amb33201377 [0,0,0,0,0,2|1,0,0]=3 2309 B16R2.477 C[C@@H](N)CCc1ccc2cccnc2c1 Amb32878865 [0,0,0,0,0,2|2,0,0]=4 2310 B16R2.477 C[C@@H](N)CCc1ccc2ncccc2c1 Amb33148695 [0,0,0,0,0,2|2,0,0]=4 2311 B16R2.477 C[C@@H](N)CCc1cnc2ccccc2c1 Amb33323985 [0,0,0,0,0,2|0,0,1]=3 2312 B16R2.477 C[C@@H](N)CCc1cnc2ccccc2n1 Amb33377308 [0,0,0,0,0,2|0,0,1]=3 2313 B16R2.477 C[C@@H](N)COc1ccc2ccccc2c1 Amb18538578 [0,0,0,0,0,2|1,0,0]=3 2314 B16R2.477 C[C@@H](N)COc1ccc2ncccc2c1 Amb18538581 [0,0,0,0,0,2|2,0,0]=4 2315 B16R2.477 C[C@@H](O)CCc1ccc2ccccc2c1 Amb33362161 [0,0,0,0,0,2|2,0,0]=4 2316 B16R2.477 C[C@@H](O)CCc1ccc2ccccc2n1 Amb33201378 [0,0,0,0,0,2|2,0,0]=4 2317 B16R2.477 C[C@@H](O)CCc1cnc2ccccc2c1 Amb33323986 [0,0,0,0,0,2|1,0,1]=4 2318 B16R2.477 C[C@@H](O)CCc1cnc2ccccc2n1 Amb33377309 [0,0,0,0,0,2|1,0,1]=4 2319 B16R2.477 C[C@H](N)CCc1ccc2ccccc2c1 Amb33079342 [0,0,0,0,0,2|1,0,0]=3 2320 B16R2.477 C[C@H](N)CCc1ccc2ccccc2n1 Amb33201376 [0,0,0,0,0,2|1,0,0]=3 2321 B16R2.477 C[C@H](N)CCc1ccc2cccnc2c1 Amb32878860 [0,0,0,0,0,2|2,0,0]=4 2322 B16R2.477 C[C@H](N)CCc1ccc2ncccc2c1 Amb33148694 [0,0,0,0,0,2|2,0,0]=4 2323 B16R2.477 C[C@H](N)CCc1cnc2ccccc2c1 Amb33323984 [0,0,0,0,0,2|0,0,1]=3 2324 B16R2.477 C[C@H](N)CCc1cnc2ccccc2n1 Amb33377302 [0,0,0,0,0,2|0,0,1]=3 2325 B16R2.477 C[C@H](O)CCc1ccc2ccccc2c1 Amb33362162 [0,0,0,0,0,2|2,0,0]=4 2326 B16R2.477 C[C@H](O)CCc1ccc2ccccc2n1 Amb33201379 [0,0,0,0,0,2|2,0,0]=4 2327 B16R2.477 C[C@H](O)CCc1cnc2ccccc2c1 Amb33323987 [0,0,0,0,0,2|1,0,1]=4 2328 B16R2.477 C[C@H](O)CCc1cnc2ccccc2n1 Amb33377322 [0,0,0,0,0,2|1,0,1]=4 2329 B16R2.179941 CC(C)CNc1nccc2ccccc12 Amb18456059 [0,0,0,0,0,2|2,0,0]=4 2330 B16R2.179941 CC(C)NCc1cccc2ccccc12 Amb4303676 [0,0,0,0,0,2|2,0,0]=4 2331 B16R2.179941 CC(Cl)CNc1ccnc2ccccc12 Amb27652297 [0,0,0,0,0,2|1,0,1]=4 2332 B16R2.179941 CC(Cl)CNc1cnnc2ccccc12 Amb27757572 [0,0,0,0,0,2|1,0,1]=4 2333 B16R2.179941 CC(N)CCC1CNCc2ccccc21 Amb33330878 [0,0,0,0,0,2|0,0,2]=4 2334 B16R2.179941 CC(N)CCc1cccc2ccccc12 Amb9031775 [0,0,0,0,0,2|1,0,0]=3 2335 B16R2.179941 CC(N)CCc1cccc2cnccc12 Amb33358924 [0,0,0,0,0,2|2,0,0]=4 2336 B16R2.179941 CC(N)CCc1ccnc2ccccc12 Amb33448714 [0,0,0,0,0,2|0,0,1]=3 2337 B16R2.179941 CC(N)\C=C\c1cccc2ccccc12 Amb33449635 [0,0,0,0,0,2|1,0,1]=4 2338 B16R2.179941 CC(N)\C=C\c1ccnc2ccccc12 Amb32953660 [0,0,0,0,0,2|0,0,2]=4 2339 B16R2.179941 CC(O)CCc1cccc2ccccc12 Amb17507283 [0,0,0,0,0,2|2,0,0]=4 2340 B16R2.179941 CC(O)CCc1ccnc2ccccc12 Amb33449441 [0,0,0,0,0,2|1,0,1]=4 2341 B16R2.179941 C[C@@H](N)CCc1cccc2ccccc12 Amb33172463 [0,0,0,0,0,2|1,0,0]=3 2342 B16R2.179941 C[C@@H](N)CCc1cccc2cnccc12 Amb32724466 [0,0,0,0,0,2|2,0,0]=4 2343 B16R2.179941 C[C@@H](N)CCc1ccnc2ccccc12 Amb33145690 [0,0,0,0,0,2|0,0,1]=3 2344 B16R2.179941 C[C@@H](N)COc1cccc2ccccc12 Amb18538579 [0,0,0,0,0,2|1,0,0]=3 2345 B16R2.179941 C[C@@H](N)COc1cccc2cccnc12 Amb18538582 [0,0,0,0,0,2|2,0,0]=4 2346 B16R2.179941 C[C@@H](O)CCc1cccc2ccccc12 Amb33196045 [0,0,0,0,0,2|2,0,0]=4 2347 B16R2.179941 C[C@@H](O)CCc1ccnc2ccccc12 Amb33145691 [0,0,0,0,0,2|1,0,1]=4 2348 B16R2.179941 C[C@H](N)CCc1cccc2ccccc12 Amb33361625 [0,0,0,0,0,2|1,0,0]=3 2349 B16R2.179941 C[C@H](N)CCc1cccc2cnccc12 Amb32724465 [0,0,0,0,0,2|2,0,0]=4 2350 B16R2.179941 C[C@H](N)CCc1ccnc2ccccc12 Amb33145689 [0,0,0,0,0,2|0,0,1]=3 2351 B16R2.179941 C[C@H](O)CCc1cccc2ccccc12 Amb33196360 [0,0,0,0,0,2|2,0,0]=4 2352 B16R2.179941 C[C@H](O)CCc1ccnc2ccccc12 Amb33145692 [0,0,0,0,0,2|1,0,1]=4