0 B17R2.2382 C(=N\N=C\c1ccccc1)/c2ccccc2 Amb1419561 [0,0,0,0,0,0|2,0,2]=4 1 B17R2.2382 C(=N\OCc1ccccc1)/c2cccnc2 Amb24072697 [0,0,0,0,0,0|2,1,1]=4 2 B17R2.2382 C(C#Cc1ccccc1)#Cc2ccccc2 Amb17836434 [0,0,0,0,0,0|2,0,2]=4 3 B17R2.2382 C(\C=C\c1ccccc1)=C/c2ccccc2 Amb2458220 [0,0,0,0,0,0|2,0,2]=4 4 B17R2.2382 c1cc[n+](CCCC[n+]2ccccc2)cc1 Amb20668088 [0,0,0,0,0,0|4,0,0]=4 5 B17R2.2382 c1ccc(CCCNc2ccccc2)cc1 Amb4313446 [0,0,0,0,0,0|3,0,0]=3 6 B17R2.2382 c1ccc(CCCSc2ccccc2)cc1 Amb4010759 [0,0,0,0,0,0|3,0,0]=3 7 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 Amb1049050 [0,0,0,0,0,0|2,0,0]=2 8 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 Amb33439 [0,0,0,0,0,0|2,0,0]=2 9 B17R2.2382 c1ccc(CCNCc2ccccn2)cc1 Amb22279533 [0,0,0,0,0,0|3,0,0]=3 10 B17R2.2382 c1ccc(CCNCc2ccccn2)cc1 Amb838410 [0,0,0,0,0,0|3,0,0]=3 11 B17R2.2382 c1ccc(CCNCc2cccnc2)cc1 Amb15740914 [0,0,0,0,0,0|3,0,0]=3 12 B17R2.2382 c1ccc(CCNCc2cccnc2)cc1 Amb33527540 [0,0,0,0,0,0|3,0,0]=3 13 B17R2.2382 c1ccc(CCNCc2cccnc2)nc1 Amb6694375 [0,0,0,0,0,0|4,0,0]=4 14 B17R2.2382 c1ccc(CCNCc2ccncc2)cc1 Amb838157 [0,0,0,0,0,0|3,0,0]=3 15 B17R2.2382 c1ccc(CCNCc2ccncc2)nc1 Amb33473660 [0,0,0,0,0,0|4,0,0]=4 16 B17R2.2382 c1ccc(CCNCc2ccncc2)nc1 Amb6694381 [0,0,0,0,0,0|4,0,0]=4 17 B17R2.2382 c1ccc(CNCCc2ccccn2)cc1 Amb1397745 [0,0,0,0,0,0|3,0,0]=3 18 B17R2.2382 c1ccc(CNCCc2cccnc2)cc1 Amb27947338 [0,0,0,0,0,0|3,0,0]=3 19 B17R2.2382 c1ccc(CNCCc2ccncc2)cc1 Amb2592523 [0,0,0,0,0,0|3,0,0]=3 20 B17R2.2382 c1ccc(CNOCc2ccccc2)cc1 Amb27611604 [0,0,0,0,0,0|1,1,0]=2 21 B17R2.2382 c1ccc(CONCc2cccnc2)cc1 Amb28042688 [0,0,0,0,0,0|2,1,0]=3 22 B17R2.2382 c1ccc(CONCc2ccncc2)cc1 Amb28249603 [0,0,0,0,0,0|2,1,0]=3 23 B17R2.2382 c1ccc(CONCc2ccncn2)cc1 Amb27267750 [0,0,0,0,0,0|3,1,0]=4 24 B17R2.2382 c1ccc(CONCc2cnccn2)cc1 Amb28192646 [0,0,0,0,0,0|3,1,0]=4 25 B17R2.2382 c1ccc(CSSCc2ccccc2)cc1 Amb3978810 [0,0,0,0,0,0|0,0,0]=0 26 B17R2.2382 c1ccc(C[Se][Se]Cc2ccccc2)cc1 Amb8515143 [0,0,0,0,0,0|0,2,0]=2 27 B17R2.2382 c1ccc(NCCNc2ccccc2)cc1 Amb2720079 [0,0,0,0,0,0|4,0,0]=4 28 B17R2.2382 c1ccc(OCCOc2ccccc2)cc1 Amb6356501 [0,0,0,0,0,0|4,0,0]=4 29 B17R2.2382 c1ccc(SCCSc2ccccc2)cc1 Amb2684781 [0,0,0,0,0,0|4,0,0]=4 30 B17R2.2382 c1ccc(\N=N\NNc2ccccc2)cc1 Amb21953597 [0,0,0,0,0,0|4,0,0]=4 31 B18R2.270 Brc1ccc(CCOCc2ccccc2)cc1 Amb25322703 [0,1,0,0,0,0|1,1,0]=3 32 B18R2.270 Cc1ccc(CNCCc2ccccc2)cc1 Amb6695457 [0,1,0,0,0,0|2,0,0]=3 33 B18R2.270 Cc1ccc(CNOCc2ccccc2)cn1 Amb28041706 [0,1,0,0,0,0|2,1,0]=4 34 B18R2.270 Clc1ccc(CCNCc2cccnc2)cc1 Amb1846009 [0,1,0,0,0,0|3,0,0]=4 35 B18R2.270 Clc1ccc(CCNCc2ccncc2)cc1 Amb4132943 [0,1,0,0,0,0|3,0,0]=4 36 B18R2.270 Clc1ccc(CNCCc2ccccc2)cc1 Amb6574449 [0,1,0,0,0,0|2,0,0]=3 37 B18R2.270 Fc1ccc(CCNCc2ccccc2)cc1 Amb6689449 [0,1,0,0,0,0|2,0,0]=3 38 B18R2.270 Fc1ccc(CCNCc2cccnc2)cc1 Amb6689376 [0,1,0,0,0,0|3,0,0]=4 39 B18R2.270 Fc1ccc(CCNCc2ccncc2)cc1 Amb6689379 [0,1,0,0,0,0|3,0,0]=4 40 B18R2.270 Fc1ccc(CNCCc2ccccc2)cc1 Amb1058734 [0,1,0,0,0,0|2,0,0]=3 41 B18R2.270 Fc1ccc(CNCCc2ccccn2)cc1 Amb6694330 [0,1,0,0,0,0|3,0,0]=4 42 B18R2.270 Fc1ccc(CNOCc2ccccc2)cc1 Amb27593642 [0,1,0,0,0,0|1,1,0]=3 43 B18R2.270 Nc1ccc(CCNCc2ccccn2)cc1 Amb18050952 [0,1,0,0,0,0|3,0,0]=4 44 B18R2.270 Nc1ccc(CCNCc2cccnc2)cc1 Amb18050951 [0,1,0,0,0,0|3,0,0]=4 45 B18R2.270 Nc1ccc(CCNCc2ccncc2)cc1 Amb18050949 [0,1,0,0,0,0|3,0,0]=4 46 B18R2.270 Nc1ccc(CCOCc2ccccc2)cc1 Amb9380836 [0,1,0,0,0,0|1,1,0]=3 47 B18R2.270 Nc1ccc(OCCCc2ccccc2)cc1 Amb2089061 [0,1,0,0,0,0|3,0,0]=4 48 B18R2.270 Oc1ccc(CNOCc2ccccc2)cc1 Amb28460962 [0,1,0,0,0,0|1,1,0]=3 49 B18R2.270 Oc1ccc(CNOCc2ccccc2)nc1 Amb27244473 [0,1,0,0,0,0|2,1,0]=4 50 B18R2.2429 CC(Cc1ccccc1)NCc2ccccc2 Amb17618657 [0,1,0,0,0,0|2,0,0]=3 51 B18R2.2429 CC(Cc1ccccc1)NCc2ccccc2 Amb1813683 [0,1,0,0,0,0|2,0,0]=3 52 B18R2.2429 C\C(Cc1ccccc1)=N/Nc2ccccc2 Amb11012847 [0,1,0,0,0,0|3,0,0]=4 53 B18R2.2429 NC(CNc1ccccc1)Cc2ccccc2 Amb23927061 [0,1,0,0,0,0|3,0,0]=4 54 B18R2.2429 N\C(Cc1ccccc1)=N\Cc2ccccc2 Amb23569056 [0,1,0,0,0,0|2,0,0]=3 55 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccc2 Amb10572893 [0,1,0,0,0,0|2,0,0]=3 56 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 Amb6880289 [0,1,0,0,0,0|3,0,0]=4 57 B18R2.2429 O=C(Nc1ccccc1)OCc2ccccc2 Amb5290091 [0,1,0,0,0,0|2,1,0]=4 58 B18R2.2429 O=C(OCc1ccccc1)Oc2ccccc2 Amb21963907 [0,1,0,0,0,0|2,1,0]=4 59 B18R2.2429 S=C(Cc1ccccc1)NCc2ccccc2 Amb8459325 [0,1,0,0,0,0|2,0,0]=3 60 B18R2.2429 S\C(=N/Cc1ccccc1)Nc2ccccc2 Amb8470269 [0,1,0,0,0,0|3,0,0]=4 61 B18R2.2429 S\C(=N\c1ccccc1)NCc2ccccc2 Amb3467233 [0,1,0,0,0,0|3,0,0]=4 62 B18R2.3984 Brc1ccccc1CNOCc2ccccc2 Amb27260825 [0,1,0,0,0,0|1,1,0]=3 63 B18R2.3984 Brc1ccccc1OCOCc2ccccc2 Amb27251190 [0,1,0,0,0,0|2,1,0]=4 64 B18R2.3984 Cc1ccccc1CCNCc2ccccn2 Amb23912366 [0,1,0,0,0,0|3,0,0]=4 65 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 Amb6695456 [0,1,0,0,0,0|2,0,0]=3 66 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 Amb6695451 [0,1,0,0,0,0|2,0,0]=3 67 B18R2.3984 Clc1ccccc1CNOCc2ccccc2 Amb26487554 [0,1,0,0,0,0|1,1,0]=3 68 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 Amb6465186 [0,1,0,0,0,0|2,0,0]=3 69 B18R2.3984 Fc1ccccc1CCNCc2cccnc2 Amb6693026 [0,1,0,0,0,0|3,0,0]=4 70 B18R2.3984 Fc1ccccc1CCNCc2ccncc2 Amb6693030 [0,1,0,0,0,0|3,0,0]=4 71 B18R2.3984 Fc1ccccc1CNCCc2ccccc2 Amb6695551 [0,1,0,0,0,0|2,0,0]=3 72 B18R2.3984 Ic1ccccc1CNCCc2ccccc2 Amb32410785 [0,1,0,0,0,0|2,0,0]=3 73 B18R2.3984 Nc1ccccc1NCCCc2ccccc2 Amb19373177 [0,1,0,0,0,0|3,0,0]=4 74 B18R2.3984 Nc1ccccc1OCCCc2ccccc2 Amb2094487 [0,1,0,0,0,0|3,0,0]=4 75 B18R2.3984 Nc1ccccc1OCCCc2ccccc2 Amb6660254 [0,1,0,0,0,0|3,0,0]=4 76 B18R2.6483 Cc1cccc(CCNCc2ccccc2)c1 Amb28283128 [0,1,0,0,0,0|2,0,0]=3 77 B18R2.6483 Cc1cccc(CNCCc2ccccc2)c1 Amb4552917 [0,1,0,0,0,0|2,0,0]=3 78 B18R2.6483 Cc1cccc(CNCCc2ccccc2)n1 Amb2693164 [0,1,0,0,0,0|3,0,0]=4 79 B18R2.6483 Cc1cccc(CNOCc2ccccc2)c1 Amb25079434 [0,1,0,0,0,0|1,1,0]=3 80 B18R2.6483 Clc1cccc(CNCCc2ccccc2)c1 Amb4303622 [0,1,0,0,0,0|2,0,0]=3 81 B18R2.6483 Fc1cccc(CCNCc2ccccc2)c1 Amb9255562 [0,1,0,0,0,0|2,0,0]=3 82 B18R2.6483 Fc1cccc(CCNCc2ccccn2)c1 Amb2231717 [0,1,0,0,0,0|3,0,0]=4 83 B18R2.6483 Fc1cccc(CNCCc2ccccc2)c1 Amb6695455 [0,1,0,0,0,0|2,0,0]=3 84 B18R2.6483 Fc1cccc(OCOCc2ccccc2)c1 Amb27593731 [0,1,0,0,0,0|2,1,0]=4 85 B18R2.6483 Nc1cccc(CCNCc2ccccc2)c1 Amb18550386 [0,1,0,0,0,0|2,0,0]=3 86 B18R2.6483 Nc1cccc(CCNCc2ccccn2)c1 Amb18550403 [0,1,0,0,0,0|3,0,0]=4 87 B18R2.6483 Nc1cccc(CCNCc2cccnc2)c1 Amb18550402 [0,1,0,0,0,0|3,0,0]=4 88 B18R2.6483 Nc1cccc(CCNCc2ccncc2)c1 Amb18050990 [0,1,0,0,0,0|3,0,0]=4 89 B18R2.6483 Nc1cccc(COCCc2ccccc2)c1 Amb7790750 [0,1,0,0,0,0|1,1,0]=3 90 B18R2.6483 Nc1cccc(OCCCc2ccccc2)c1 Amb2094488 [0,1,0,0,0,0|3,0,0]=4 91 B18R2.6483 Nc1cccc(OCCCc2ccccc2)c1 Amb6251493 [0,1,0,0,0,0|3,0,0]=4 92 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 Amb6651189 [0,1,0,0,0,0|2,0,0]=3 93 B18R2.7189 CC(NCCc1ccccc1)c2ccccc2 Amb2612168 [0,1,0,0,0,0|2,0,0]=3 94 B18R2.7189 CC(NOCc1ccccc1)c2cccnc2 Amb27944261 [0,1,0,0,0,0|2,1,0]=4 95 B18R2.7189 NC(CCCc1ccccc1)c2ccccc2 Amb2371345 [0,1,0,0,0,0|2,0,0]=3 96 B18R2.7189 NC(CCCc1ccccc1)c2ccccc2 Amb270381 [0,1,0,0,0,0|2,0,0]=3 97 B18R2.7189 NC(CCSc1ccccc1)c2ccccc2 Amb29847198 [0,1,0,0,0,0|3,0,0]=4 98 B18R2.7189 NC(CNCc1ccccc1)c2ccccc2 Amb27451476 [0,1,0,0,0,0|2,0,0]=3 99 B18R2.7189 NC(COCc1ccccc1)c2ccccc2 Amb1126312 [0,1,0,0,0,0|1,1,0]=3 100 B18R2.7189 NC(COCc1ccccc1)c2ccccc2 Amb19374866 [0,1,0,0,0,0|1,1,0]=3 101 B18R2.7189 N\C(=N/OCc1ccccc1)c2ccccc2 Amb11212592 [0,1,0,0,0,0|1,1,1]=4 102 B18R2.7189 O=C(CCCc1ccccc1)c2ccccc2 Amb1548163 [0,1,0,0,0,0|2,0,1]=4 103 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 Amb6481313 [0,1,0,0,0,0|2,0,1]=4 104 B18R2.7189 O=C(OCCc1ccccc1)c2ccccc2 Amb4016539 [0,1,0,0,0,0|1,1,1]=4 105 B18R2.7189 OC(CCCc1ccccc1)c2ccccc2 Amb2385846 [0,1,0,0,0,0|2,0,0]=3 106 B18R2.7189 OC(CCSc1ccccc1)c2ccccc2 Amb21984422 [0,1,0,0,0,0|3,0,0]=4 107 B18R2.7189 OC(CNCc1ccccc1)c2ccccc2 Amb2726787 [0,1,0,0,0,0|2,0,0]=3 108 B18R2.7189 OC(CNCc1ccccn1)c2ccccc2 Amb2282236 [0,1,0,0,0,0|3,0,0]=4 109 B18R2.7189 OC(CNCc1cccnc1)c2ccccc2 Amb1091618 [0,1,0,0,0,0|3,0,0]=4 110 B18R2.7189 OC(CNCc1ccncc1)c2ccccc2 Amb6352162 [0,1,0,0,0,0|3,0,0]=4 111 B18R2.7189 O[C@H](CNCc1ccccc1)c2ccccc2 Amb6356900 [0,1,0,0,0,0|2,0,0]=3 112 B18R3.2098 c1ccc(CC2CNc3ccccc32)cc1 Amb17240364 [0,0,0,1,0,0|3,0,0]=4 113 B18R3.2098 c1ccc(CC2NCc3ccccc32)cc1 Amb31117817 [0,0,0,1,0,0|2,0,0]=3 114 B18R3.2098 c1ccc(CN2CCc3ccccc32)cc1 Amb10610016 [0,0,0,1,0,0|2,0,0]=3 115 B18R3.2098 c1ccc(CN2CSc3ccccc32)cc1 Amb3984940 [0,0,0,1,0,0|3,0,0]=4 116 B18R3.2098 c1ccc(C[n+]2csc3ccccc32)cc1 Amb3993671 [0,0,0,1,0,0|3,0,0]=4 117 B18R3.2098 c1ccc(Cn2ccc3ccccc32)cc1 Amb6353698 [0,0,0,1,0,0|2,0,1]=4 118 B18R3.2098 c1ccc(Cn2cnc3ccccc32)cc1 Amb1219763 [0,0,0,1,0,0|3,0,0]=4 119 B18R3.2098 c1ccc(Cn2ncc3ccccc32)cc1 Amb8563492 [0,0,0,1,0,0|2,0,1]=4 120 B18R3.2098 c1ccc(Cn2nnc3ccccc32)cc1 Amb6360273 [0,0,0,1,0,0|3,0,0]=4 121 B18R3.2100 c1ccc(CNC2Cc3ccccc32)cc1 Amb27218139 [0,0,0,1,0,0|2,0,0]=3 122 B18R3.2108 c1ccc(C2=NCCc3ccccc32)cc1 Amb5717737 [0,0,0,1,0,0|2,0,1]=4 123 B18R3.2108 c1ccc(C2=NCCc3ccccc32)cc1 Amb6773288 [0,0,0,1,0,0|2,0,1]=4 124 B18R3.2108 c1ccc(C2CCCc3ccccc32)cc1 Amb32665339 [0,0,0,1,0,0|2,0,0]=3 125 B18R3.2108 c1ccc(C2CCNc3ccccc32)cc1 Amb32670838 [0,0,0,1,0,0|3,0,0]=4 126 B18R3.2108 c1ccc(C2CNCc3ccccc32)cc1 Amb2606131 [0,0,0,1,0,0|2,0,0]=3 127 B18R3.2108 c1ccc(C2CNCc3ccccc32)cc1 Amb329182 [0,0,0,1,0,0|2,0,0]=3 128 B18R3.2108 c1ccc(C2NCCc3ccccc32)cc1 Amb2567931 [0,0,0,1,0,0|2,0,0]=3 129 B18R3.2108 c1ccc(C2NCCc3ccccc32)nc1 Amb2795565 [0,0,0,1,0,0|3,0,0]=4 130 B18R3.2108 c1ccc([C@@H]2NCCc3ccccc32)cc1 Amb19892402 [0,0,0,1,0,0|2,0,0]=3 131 B18R3.2108 c1ccc([C@H]2NCCc3ccccc32)cc1 Amb8396118 [0,0,0,1,0,0|2,0,0]=3 132 B18R3.2108 c1ccc2c(c1)CCNC2c3ccncc3 Amb1420331 [0,0,0,1,0,0|3,0,0]=4 133 B18R3.2108 c1cncc(C2NCCc3ccccc32)c1 Amb2795564 [0,0,0,1,0,0|3,0,0]=4 134 B18R3.2122 c1ccc(CC2OC2c3ccccc3)cc1 Amb9708379 [0,0,0,1,0,0|1,1,0]=3 135 B16R2.2256 C(#Cc1ccccc1)Nc2ccccc2 Amb24081250 [0,0,0,0,1,0|2,0,1]=4 136 B16R2.2256 C(=N/c1ccccc1)/Nc2ccccc2 Amb22350571 [0,0,0,0,1,0|3,0,0]=4 137 B16R2.2256 C(=N\Cc1ccccc1)/c2ccccc2 Amb33513282 [0,0,0,0,1,0|1,0,1]=3 138 B16R2.2256 C(=N\Nc1ccccc1)/c2ccccc2 Amb5720542 [0,0,0,0,1,0|2,0,1]=4 139 B16R2.2256 C(=N\c1ccccc1)/Nc2ccccc2 Amb6298318 [0,0,0,0,1,0|3,0,0]=4 140 B16R2.2256 c1cc(CCCc2ccncc2)ccn1 Amb6357749 [0,0,0,0,1,0|3,0,0]=4 141 B16R2.2256 c1cc(CNCc2ccncc2)ccn1 Amb6729586 [0,0,0,0,1,0|3,0,0]=4 142 B16R2.2256 c1cc(CNCc2ccncc2)ccn1 Amb6864949 [0,0,0,0,1,0|3,0,0]=4 143 B16R2.2256 c1ccc(CCCc2ccccc2)cc1 Amb2721029 [0,0,0,0,1,0|1,0,0]=2 144 B16R2.2256 c1ccc(CCCc2ccccn2)cc1 Amb5718975 [0,0,0,0,1,0|2,0,0]=3 145 B16R2.2256 c1ccc(CCNc2ccccc2)cc1 Amb2693183 [0,0,0,0,1,0|2,0,0]=3 146 B16R2.2256 c1ccc(CCOc2ccccc2)cc1 Amb2720867 [0,0,0,0,1,0|1,1,0]=3 147 B16R2.2256 c1ccc(CNCc2ccccc2)cc1 Amb17743700 [0,0,0,0,1,0|1,0,0]=2 148 B16R2.2256 c1ccc(CNCc2ccccn2)cc1 Amb6356033 [0,0,0,0,1,0|2,0,0]=3 149 B16R2.2256 c1ccc(CNCc2ccccn2)nc1 Amb33622775 [0,0,0,0,1,0|3,0,0]=4 150 B16R2.2256 c1ccc(CNCc2ccccn2)nc1 Amb3939204 [0,0,0,0,1,0|3,0,0]=4 151 B16R2.2256 c1ccc(CNCc2cccnc2)cc1 Amb6356030 [0,0,0,0,1,0|2,0,0]=3 152 B16R2.2256 c1ccc(CNCc2cccnc2)nc1 Amb6699051 [0,0,0,0,1,0|3,0,0]=4 153 B16R2.2256 c1ccc(CNCc2ccncc2)cc1 Amb6356034 [0,0,0,0,1,0|2,0,0]=3 154 B16R2.2256 c1ccc(CNCc2ccncc2)nc1 Amb6699053 [0,0,0,0,1,0|3,0,0]=4 155 B16R2.2256 c1ccc(CNCc2ccncn2)cc1 Amb19030316 [0,0,0,0,1,0|3,0,0]=4 156 B16R2.2256 c1ccc(CNCc2cncnc2)cc1 Amb18314258 [0,0,0,0,1,0|3,0,0]=4 157 B16R2.2256 c1ccc(CNCc2cncnc2)cc1 Amb33457833 [0,0,0,0,1,0|3,0,0]=4 158 B16R2.2256 c1ccc(NCCc2ccccn2)cc1 Amb4020684 [0,0,0,0,1,0|3,0,0]=4 159 B16R2.2256 c1ccc(SCCc2ccncc2)cc1 Amb583020 [0,0,0,0,1,0|2,0,0]=3 160 B16R2.2256 c1ccc(SCSc2ccccc2)cc1 Amb2684782 [0,0,0,0,1,0|2,0,0]=3 161 B16R2.2256 c1ccc(\N=N\Nc2ccccc2)cc1 Amb7809237 [0,0,0,0,1,0|3,0,0]=4 162 B16R2.2256 c1cncc(CNCc2cccnc2)c1 Amb6316094 [0,0,0,0,1,0|3,0,0]=4 163 B16R2.2256 c1cncc(CNCc2ccncc2)c1 Amb6332138 [0,0,0,0,1,0|3,0,0]=4 164 B16R2.2257 c1ccc(CCNCc2ccco2)cc1 Amb1130095 [0,0,0,0,1,0|3,0,0]=4 165 B16R2.2257 c1ccc(CCNCc2ccco2)cc1 Amb21972188 [0,0,0,0,1,0|3,0,0]=4 166 B16R2.2257 c1ccc(CCNCc2cccs2)cc1 Amb6355726 [0,0,0,0,1,0|3,0,0]=4 167 B16R2.2257 c1ccc(CNCCc2ccco2)cc1 Amb9249542 [0,0,0,0,1,0|3,0,0]=4 168 B16R2.2257 c1ccc(CNCCc2cccs2)cc1 Amb6697859 [0,0,0,0,1,0|3,0,0]=4 169 B16R2.2257 c1ccc(CNCCc2ccoc2)cc1 Amb27767161 [0,0,0,0,1,0|3,0,0]=4 170 B16R2.2257 c1ccc(CONCc2ccsc2)cc1 Amb27634704 [0,0,0,0,1,0|2,1,0]=4 171 B18R2.2525 C(=C\c1ccccc1)/CNCc2ccccc2 Amb1855576 [0,0,0,0,0,1|2,0,1]=4 172 B18R2.2525 C(=C\c1ccccc1)/COCc2ccccc2 Amb35781860 [0,0,0,0,0,1|1,1,1]=4 173 B18R2.2525 c1ccc(CCCCNc2ccccc2)cc1 Amb28728654 [0,0,0,0,0,1|2,0,0]=3 174 B18R2.2525 c1ccc(CCCNCc2cccnc2)cc1 Amb6729940 [0,0,0,0,0,1|3,0,0]=4 175 B18R2.2525 c1ccc(CCNCCc2ccccc2)cc1 Amb1103723 [0,0,0,0,0,1|2,0,0]=3 176 B18R2.2525 c1ccc(CCNCCc2ccccc2)cc1 Amb2119307 [0,0,0,0,0,1|2,0,0]=3 177 B18R2.2525 c1ccc(CCNCCc2ccncc2)cc1 Amb33482931 [0,0,0,0,0,1|3,0,0]=4 178 B18R2.2525 c1ccc(CCNOCc2ccccc2)cc1 Amb25231901 [0,0,0,0,0,1|1,1,0]=3 179 B18R2.2525 c1ccc(CNCCCc2ccncc2)cc1 Amb2694637 [0,0,0,0,0,1|3,0,0]=4 180 B18R2.2525 c1ccc(CNCCNc2ccccc2)cc1 Amb1086650 [0,0,0,0,0,1|2,0,0]=3 181 B18R2.2525 c1ccc(CNCCNc2ccccc2)cc1 Amb24113424 [0,0,0,0,0,1|2,0,0]=3 182 B18R2.2525 c1ccc(CNCCOc2ccccn2)cc1 Amb19920093 [0,0,0,0,0,1|3,0,0]=4 183 B18R2.2525 c1ccc(CNCCOc2ccccn2)cc1 Amb29844627 [0,0,0,0,0,1|3,0,0]=4 184 B18R2.2525 c1ccc(CNCCSc2ccccn2)cc1 Amb28145640 [0,0,0,0,0,1|3,0,0]=4 185 B18R2.2525 c1ccc(CNCCSc2ccncc2)cc1 Amb28369015 [0,0,0,0,0,1|3,0,0]=4 186 B18R2.2525 c1ccc(CNCNCc2ccccc2)cc1 Amb4004618 [0,0,0,0,0,1|2,0,0]=3 187 B18R2.2525 c1ccc(CNNOCc2ccccc2)cc1 Amb28122329 [0,0,0,0,0,1|1,1,0]=3 188 B18R2.2525 c1ccc(COCCOc2ccccc2)cc1 Amb27767737 [0,0,0,0,0,1|1,1,0]=3 189 B18R2.2525 c1ccc(COCOCc2ccccc2)cc1 Amb8505030 [0,0,0,0,0,1|0,2,0]=3 190 B18R2.2525 c1ccc(CONCCc2cccnc2)cc1 Amb27869722 [0,0,0,0,0,1|2,1,0]=4 191 B18R2.2525 c1ccc(SCCCSc2ccccc2)cc1 Amb6357086 [0,0,0,0,0,1|3,0,0]=4 192 B17R2.143 BrC(Cc1ccccc1)Cc2ccccc2 Amb17755302 [0,1,0,0,1,0|1,0,0]=3 193 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 Amb1925683 [0,1,0,0,1,0|1,0,0]=3 194 B17R2.143 NC(Cc1ccccc1)Cc2ccccc2 Amb1114019 [0,1,0,0,1,0|1,0,0]=3 195 B17R2.143 NC(Cc1ccccc1)Cc2ccccc2 Amb2816835 [0,1,0,0,1,0|1,0,0]=3 196 B17R2.143 NC(Cc1ccccc1)Cc2cccnc2 Amb19024201 [0,1,0,0,1,0|2,0,0]=4 197 B17R2.143 NN(Cc1ccccc1)Cc2ccccc2 Amb6608929 [0,1,0,0,1,0|1,0,0]=3 198 B17R2.143 O=C(Cc1ccccc1)Cc2ccccc2 Amb6354516 [0,1,0,0,1,0|1,0,0]=3 199 B17R2.143 O=C(Cc1ccccc1)Cc2cccnc2 Amb32684178 [0,1,0,0,1,0|2,0,0]=4 200 B17R2.143 O=C(Cc1ccccc1)Nc2ccccc2 Amb3099547 [0,1,0,0,1,0|2,0,0]=4 201 B17R2.143 O=S(Cc1ccccc1)Cc2ccccc2 Amb8387527 [0,1,0,0,1,0|0,0,1]=3 202 B17R2.143 OC(Cc1ccccc1)Cc2ccccc2 Amb1110031 [0,1,0,0,1,0|1,0,0]=3 203 B17R2.143 ON(Cc1ccccc1)Cc2ccccc2 Amb2226907 [0,1,0,0,1,0|1,0,0]=3 204 B17R2.143 S=C(Sc1ccccc1)Sc2ccccc2 Amb2609041 [0,1,0,0,1,0|2,0,0]=4 205 B17R2.143 SC(Cc1ccccc1)Cc2ccccc2 Amb7784708 [0,1,0,0,1,0|1,0,0]=3 206 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb22587996 [0,1,0,0,1,0|1,0,0]=3 207 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb838866 [0,1,0,0,1,0|1,0,0]=3 208 B17R2.216 Brc1ccc(CNCc2ccccc2)nc1 Amb27223602 [0,1,0,0,1,0|2,0,0]=4 209 B17R2.216 Brc1ccc(CNCc2ccccn2)cc1 Amb10610049 [0,1,0,0,1,0|2,0,0]=4 210 B17R2.216 Brc1ccc(CNCc2ccccn2)cc1 Amb6699016 [0,1,0,0,1,0|2,0,0]=4 211 B17R2.216 Brc1ccc(CNCc2cccnc2)cc1 Amb6352451 [0,1,0,0,1,0|2,0,0]=4 212 B17R2.216 Brc1ccc(CNCc2ccncc2)cc1 Amb6729560 [0,1,0,0,1,0|2,0,0]=4 213 B17R2.216 Brc1ccc(COCc2ccccc2)cc1 Amb19301961 [0,1,0,0,1,0|0,1,0]=3 214 B17R2.216 Brc1ccc(NCCc2ccccc2)cc1 Amb6696485 [0,1,0,0,1,0|2,0,0]=4 215 B17R2.216 Brc1ccc(OCCc2ccccc2)cc1 Amb6649169 [0,1,0,0,1,0|1,1,0]=4 216 B17R2.216 Cc1ccc(CNCc2ccccc2)cc1 Amb6687346 [0,1,0,0,1,0|1,0,0]=3 217 B17R2.216 Cc1ccc(CNCc2ccccn2)cc1 Amb6355683 [0,1,0,0,1,0|2,0,0]=4 218 B17R2.216 Cc1ccc(CNCc2cccnc2)cc1 Amb6355739 [0,1,0,0,1,0|2,0,0]=4 219 B17R2.216 Cc1ccc(CNCc2ccncc2)cc1 Amb6352450 [0,1,0,0,1,0|2,0,0]=4 220 B17R2.216 Cc1ccc(NCCc2ccccc2)cc1 Amb4358611 [0,1,0,0,1,0|2,0,0]=4 221 B17R2.216 Clc1ccc(CNCc2ccccc2)cc1 Amb6364679 [0,1,0,0,1,0|1,0,0]=3 222 B17R2.216 Clc1ccc(CNCc2ccccc2)nc1 Amb28342095 [0,1,0,0,1,0|2,0,0]=4 223 B17R2.216 Clc1ccc(CNCc2ccccn2)cc1 Amb6699017 [0,1,0,0,1,0|2,0,0]=4 224 B17R2.216 Clc1ccc(CNCc2cccnc2)cc1 Amb6336244 [0,1,0,0,1,0|2,0,0]=4 225 B17R2.216 Clc1ccc(CNCc2ccncc2)cc1 Amb1923364 [0,1,0,0,1,0|2,0,0]=4 226 B17R2.216 Clc1ccc(CSCc2ccccc2)cn1 Amb6675876 [0,1,0,0,1,0|1,0,0]=3 227 B17R2.216 Clc1ccc(CSCc2ccccn2)cn1 Amb21984720 [0,1,0,0,1,0|2,0,0]=4 228 B17R2.216 Clc1ccc(NCCc2ccccc2)cc1 Amb6624606 [0,1,0,0,1,0|2,0,0]=4 229 B17R2.216 Fc1ccc(CNCc2ccccc2)cc1 Amb6352461 [0,1,0,0,1,0|1,0,0]=3 230 B17R2.216 Fc1ccc(CNCc2ccccc2)cc1 Amb8468188 [0,1,0,0,1,0|1,0,0]=3 231 B17R2.216 Fc1ccc(CNCc2ccccn2)cc1 Amb6699019 [0,1,0,0,1,0|2,0,0]=4 232 B17R2.216 Fc1ccc(CNCc2cccnc2)cc1 Amb6355690 [0,1,0,0,1,0|2,0,0]=4 233 B17R2.216 Fc1ccc(CNCc2ccncc2)cc1 Amb6332080 [0,1,0,0,1,0|2,0,0]=4 234 B17R2.216 Fc1ccc(NCCc2ccccc2)cc1 Amb6696718 [0,1,0,0,1,0|2,0,0]=4 235 B17R2.216 Ic1ccc(CNCc2ccccc2)cc1 Amb27644269 [0,1,0,0,1,0|1,0,0]=3 236 B17R2.216 Ic1ccc(COCc2ccccc2)cc1 Amb28381491 [0,1,0,0,1,0|0,1,0]=3 237 B17R2.216 Ic1ccc(OCCc2ccccc2)cc1 Amb20669160 [0,1,0,0,1,0|1,1,0]=4 238 B17R2.216 Nc1ccc(CCCc2ccccc2)cc1 Amb13952637 [0,1,0,0,1,0|1,0,0]=3 239 B17R2.216 Nc1ccc(CCOc2ccccc2)cc1 Amb9380875 [0,1,0,0,1,0|1,1,0]=4 240 B17R2.216 Nc1ccc(COCc2ccccc2)cc1 Amb1138750 [0,1,0,0,1,0|0,1,0]=3 241 B17R2.216 Nc1ccc(NCCc2ccccc2)cc1 Amb1103721 [0,1,0,0,1,0|2,0,0]=4 242 B17R2.216 Nc1ccc(OCCc2ccccc2)cc1 Amb1112778 [0,1,0,0,1,0|1,1,0]=4 243 B17R2.216 Nc1ccc(SCCc2ccccn2)cc1 Amb8606761 [0,1,0,0,1,0|2,0,0]=4 244 B17R2.216 O=C1C=CC(CNCc2ccccc2)=CN1 Amb27866225 [0,1,0,0,1,0|2,0,0]=4 245 B17R2.216 O=C1C=CN(COCc2ccccc2)C=C1 Amb27485298 [0,1,0,0,1,0|1,1,0]=4 246 B17R2.216 Oc1ccc(CNCc2ccccc2)cc1 Amb6687336 [0,1,0,0,1,0|1,0,0]=3 247 B17R2.216 Oc1ccc(CNCc2ccccn2)cc1 Amb6699014 [0,1,0,0,1,0|2,0,0]=4 248 B17R2.216 Oc1ccc(CNCc2cccnc2)cc1 Amb6729778 [0,1,0,0,1,0|2,0,0]=4 249 B17R2.216 Oc1ccc(CNCc2ccncc2)cc1 Amb6729559 [0,1,0,0,1,0|2,0,0]=4 250 B17R2.216 Oc1ccc(NCCc2ccccc2)cc1 Amb33548437 [0,1,0,0,1,0|2,0,0]=4 251 B17R2.216 Oc1ccc(NCCc2ccccc2)cc1 Amb9608650 [0,1,0,0,1,0|2,0,0]=4 252 B17R2.216 Oc1ccc(OCCc2ccccc2)cc1 Amb9210954 [0,1,0,0,1,0|1,1,0]=4 253 B17R2.216 Oc1ccc(\C=N\Cc2ccccc2)cc1 Amb4297814 [0,1,0,0,1,0|1,0,1]=4 254 B17R2.216 [O-][n+]1ccc(CCCc2ccccc2)cc1 Amb2694604 [0,1,0,0,1,0|2,0,0]=4 255 B17R2.2342 CC(CCc1ccccc1)c2ccccc2 Amb23437762 [0,1,0,0,1,0|1,0,0]=3 256 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 Amb21959684 [0,1,0,0,1,0|1,0,0]=3 257 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 Amb9743575 [0,1,0,0,1,0|1,0,0]=3 258 B17R2.2342 CC(NCc1ccccc1)c2ccccn2 Amb9743592 [0,1,0,0,1,0|2,0,0]=4 259 B17R2.2342 CC(NCc1ccccn1)c2ccccc2 Amb2690283 [0,1,0,0,1,0|2,0,0]=4 260 B17R2.2342 CC(NCc1cccnc1)c2ccccc2 Amb837833 [0,1,0,0,1,0|2,0,0]=4 261 B17R2.2342 CC(NCc1ccncc1)c2ccccc2 Amb1551290 [0,1,0,0,1,0|2,0,0]=4 262 B17R2.2342 CC(OCc1ccccc1)c2ccccc2 Amb28141227 [0,1,0,0,1,0|0,1,0]=3 263 B17R2.2342 CC(\C=C\c1ccccc1)c2ccccc2 Amb17673649 [0,1,0,0,1,0|1,0,1]=4 264 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 Amb2719978 [0,1,0,0,1,0|1,0,0]=3 265 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 Amb3939870 [0,1,0,0,1,0|1,0,0]=3 266 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 Amb2786750 [0,1,0,0,1,0|1,0,0]=3 267 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 Amb32663250 [0,1,0,0,1,0|1,0,0]=3 268 B17R2.2342 ClC(\C=C\c1ccccc1)c2ccccc2 Amb24121369 [0,1,0,0,1,0|1,0,1]=4 269 B17R2.2342 Cl\C(=N\Cc1ccccc1)c2ccccc2 Amb28400953 [0,1,0,0,1,0|1,0,1]=4 270 B17R2.2342 N=C(NCc1ccccc1)c2ccccc2 Amb23447124 [0,1,0,0,1,0|1,0,1]=4 271 B17R2.2342 NC(CCc1ccccc1)c2ccccc2 Amb10609173 [0,1,0,0,1,0|1,0,0]=3 272 B17R2.2342 NC(CCc1ccccc1)c2ccccc2 Amb5737005 [0,1,0,0,1,0|1,0,0]=3 273 B17R2.2342 NC(CCc1ccccc1)c2ccccn2 Amb19003585 [0,1,0,0,1,0|2,0,0]=4 274 B17R2.2342 NC(CCc1ccccc1)c2ccccn2 Amb35745689 [0,1,0,0,1,0|2,0,0]=4 275 B17R2.2342 NC(CCc1ccccc1)c2cccnc2 Amb18303480 [0,1,0,0,1,0|2,0,0]=4 276 B17R2.2342 NC(CCc1ccccc1)c2ccncc2 Amb18303481 [0,1,0,0,1,0|2,0,0]=4 277 B17R2.2342 NC(CCc1ccccc1)c2ccncc2 Amb35745688 [0,1,0,0,1,0|2,0,0]=4 278 B17R2.2342 NC(CNc1ccccc1)c2ccccc2 Amb19009672 [0,1,0,0,1,0|2,0,0]=4 279 B17R2.2342 NC(COc1ccccc1)c2ccccc2 Amb1139757 [0,1,0,0,1,0|1,1,0]=4 280 B17R2.2342 NC(COc1ccccc1)c2ccccc2 Amb19341662 [0,1,0,0,1,0|1,1,0]=4 281 B17R2.2342 NC(CSc1ccccc1)c2ccccc2 Amb21988447 [0,1,0,0,1,0|1,0,0]=3 282 B17R2.2342 N[C@@H](CNc1ccccc1)c2ccccc2 Amb33838333 [0,1,0,0,1,0|2,0,0]=4 283 B17R2.2342 O=C(CCc1ccccc1)c2ccccc2 Amb2228399 [0,1,0,0,1,0|1,0,1]=4 284 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 Amb2703541 [0,1,0,0,1,0|1,0,1]=4 285 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 Amb6339622 [0,1,0,0,1,0|1,0,1]=4 286 B17R2.2342 O=C(OCc1ccccc1)c2ccccc2 Amb4889094 [0,1,0,0,1,0|0,1,1]=4 287 B17R2.2342 OC(CCc1ccccc1)c2ccccc2 Amb4019920 [0,1,0,0,1,0|1,0,0]=3 288 B17R2.2342 OC(CNc1ccccc1)c2ccccc2 Amb17140784 [0,1,0,0,1,0|2,0,0]=4 289 B17R2.2342 OC(COc1ccccc1)c2ccccc2 Amb22479800 [0,1,0,0,1,0|1,1,0]=4 290 B17R2.2342 OC(CSc1ccccc1)c2ccccc2 Amb21988442 [0,1,0,0,1,0|1,0,0]=3 291 B17R2.2342 OC(\C=C\c1ccccc1)c2ccccc2 Amb5493999 [0,1,0,0,1,0|1,0,1]=4 292 B17R2.2342 O[C@@H](CNc1ccccc1)c2ccccc2 Amb29838296 [0,1,0,0,1,0|2,0,0]=4 293 B17R2.2342 O[C@H](CNc1ccccc1)c2ccccc2 Amb28556777 [0,1,0,0,1,0|2,0,0]=4 294 B17R2.2342 S=C(NCc1ccccc1)c2ccccc2 Amb1212595 [0,1,0,0,1,0|1,0,1]=4 295 B17R2.3956 Brc1ccccc1NCCc2ccccc2 Amb6696373 [0,1,0,0,1,0|2,0,0]=4 296 B17R2.3956 Brc1ccccc1OCCc2ccccc2 Amb6665082 [0,1,0,0,1,0|1,1,0]=4 297 B17R2.3956 Brc1cccnc1COCc2ccccc2 Amb27215867 [0,1,0,0,1,0|1,1,0]=4 298 B17R2.3956 Cc1ccccc1CNCc2ccccc2 Amb6687345 [0,1,0,0,1,0|1,0,0]=3 299 B17R2.3956 Cc1ccccc1CNCc2ccccn2 Amb15702952 [0,1,0,0,1,0|2,0,0]=4 300 B17R2.3956 Cc1ccccc1CNCc2ccccn2 Amb2689360 [0,1,0,0,1,0|2,0,0]=4 301 B17R2.3956 Cc1ccccc1CNCc2cccnc2 Amb6355621 [0,1,0,0,1,0|2,0,0]=4 302 B17R2.3956 Cc1ccccc1CNCc2ccncc2 Amb6356681 [0,1,0,0,1,0|2,0,0]=4 303 B17R2.3956 Cc1ccccc1NCCc2ccccc2 Amb4358612 [0,1,0,0,1,0|2,0,0]=4 304 B17R2.3956 Cc1cccnc1CNCc2ccccc2 Amb13949059 [0,1,0,0,1,0|2,0,0]=4 305 B17R2.3956 Cc1cccnc1CNCc2ccccc2 Amb5559957 [0,1,0,0,1,0|2,0,0]=4 306 B17R2.3956 Clc1ccccc1CNCc2ccccc2 Amb6364680 [0,1,0,0,1,0|1,0,0]=3 307 B17R2.3956 Clc1ccccc1CNCc2ccccn2 Amb6352474 [0,1,0,0,1,0|2,0,0]=4 308 B17R2.3956 Clc1ccccc1CNCc2cccnc2 Amb6364681 [0,1,0,0,1,0|2,0,0]=4 309 B17R2.3956 Clc1ccccc1CNCc2ccncc2 Amb838186 [0,1,0,0,1,0|2,0,0]=4 310 B17R2.3956 Clc1ccccc1NCCc2ccccc2 Amb6610978 [0,1,0,0,1,0|2,0,0]=4 311 B17R2.3956 Clc1ncccc1CNCc2ccccc2 Amb25372702 [0,1,0,0,1,0|2,0,0]=4 312 B17R2.3956 Fc1ccccc1CNCc2ccccc2 Amb6352459 [0,1,0,0,1,0|1,0,0]=3 313 B17R2.3956 Fc1ccccc1CNCc2ccccn2 Amb6355715 [0,1,0,0,1,0|2,0,0]=4 314 B17R2.3956 Fc1ccccc1CNCc2cccnc2 Amb6355612 [0,1,0,0,1,0|2,0,0]=4 315 B17R2.3956 Fc1ccccc1CNCc2ccncc2 Amb6697918 [0,1,0,0,1,0|2,0,0]=4 316 B17R2.3956 Fc1ccccc1NCCc2ccccc2 Amb6697268 [0,1,0,0,1,0|2,0,0]=4 317 B17R2.3956 Nc1ccccc1CNCc2ccccc2 Amb19010879 [0,1,0,0,1,0|1,0,0]=3 318 B17R2.3956 Nc1ccccc1COCc2ccccc2 Amb6244669 [0,1,0,0,1,0|0,1,0]=3 319 B17R2.3956 Nc1ccccc1NCCc2ccccc2 Amb1103711 [0,1,0,0,1,0|2,0,0]=4 320 B17R2.3956 Nc1ccccc1NCCc2ccccc2 Amb2603080 [0,1,0,0,1,0|2,0,0]=4 321 B17R2.3956 Nc1ccccc1NNCc2ccccc2 Amb27248419 [0,1,0,0,1,0|2,0,0]=4 322 B17R2.3956 Nc1ccccc1OCCc2ccccc2 Amb1112568 [0,1,0,0,1,0|1,1,0]=4 323 B17R2.3956 Nc1ccncc1CNCc2ccccc2 Amb27969199 [0,1,0,0,1,0|2,0,0]=4 324 B17R2.3956 Nc1cnccc1CNCc2ccccc2 Amb22751233 [0,1,0,0,1,0|2,0,0]=4 325 B17R2.3956 Oc1ccccc1CNCc2ccccc2 Amb2781942 [0,1,0,0,1,0|1,0,0]=3 326 B17R2.3956 Oc1ccccc1CNCc2ccccn2 Amb33527557 [0,1,0,0,1,0|2,0,0]=4 327 B17R2.3956 Oc1ccccc1CNCc2cccnc2 Amb6729815 [0,1,0,0,1,0|2,0,0]=4 328 B17R2.3956 Oc1ccccc1CNCc2ccncc2 Amb6729601 [0,1,0,0,1,0|2,0,0]=4 329 B17R2.3956 Oc1ccccc1COCc2ccccc2 Amb27859423 [0,1,0,0,1,0|0,1,0]=3 330 B17R2.3956 Oc1ccccc1C\C=C\c2ccccc2 Amb1806020 [0,1,0,0,1,0|1,0,1]=4 331 B17R2.3956 Oc1ccccc1OCCc2ccccc2 Amb9210976 [0,1,0,0,1,0|1,1,0]=4 332 B17R2.3956 Oc1ccccc1\C=N\Cc2ccccc2 Amb576127 [0,1,0,0,1,0|1,0,1]=4 333 B17R2.5301 Brc1cccc(CNCc2ccccc2)c1 Amb22588026 [0,1,0,0,1,0|1,0,0]=3 334 B17R2.5301 Brc1cccc(CNCc2ccccc2)c1 Amb6687338 [0,1,0,0,1,0|1,0,0]=3 335 B17R2.5301 Brc1cccc(CNCc2ccccc2)n1 Amb28422591 [0,1,0,0,1,0|2,0,0]=4 336 B17R2.5301 Brc1cccc(CNCc2ccccn2)c1 Amb6456043 [0,1,0,0,1,0|2,0,0]=4 337 B17R2.5301 Brc1cccc(CNCc2cccnc2)c1 Amb837881 [0,1,0,0,1,0|2,0,0]=4 338 B17R2.5301 Brc1cccc(CNCc2ccncc2)c1 Amb6465188 [0,1,0,0,1,0|2,0,0]=4 339 B17R2.5301 Brc1cccc(COCc2ccccc2)n1 Amb27484935 [0,1,0,0,1,0|1,1,0]=4 340 B17R2.5301 Brc1cccc(NCCc2ccccc2)c1 Amb6696593 [0,1,0,0,1,0|2,0,0]=4 341 B17R2.5301 Brc1cccc(OCCc2ccccc2)c1 Amb6628830 [0,1,0,0,1,0|1,1,0]=4 342 B17R2.5301 Brc1cncc(COCc2ccccc2)c1 Amb27222014 [0,1,0,0,1,0|1,1,0]=4 343 B17R2.5301 Cc1cccc(CNCc2ccccc2)c1 Amb1833778 [0,1,0,0,1,0|1,0,0]=3 344 B17R2.5301 Cc1cccc(CNCc2ccccc2)c1 Amb6335361 [0,1,0,0,1,0|1,0,0]=3 345 B17R2.5301 Cc1cccc(CNCc2ccccc2)n1 Amb13949058 [0,1,0,0,1,0|2,0,0]=4 346 B17R2.5301 Cc1cccc(CNCc2ccccc2)n1 Amb5501628 [0,1,0,0,1,0|2,0,0]=4 347 B17R2.5301 Cc1cccc(CNCc2ccccn2)c1 Amb15702953 [0,1,0,0,1,0|2,0,0]=4 348 B17R2.5301 Cc1cccc(CNCc2ccccn2)c1 Amb6699029 [0,1,0,0,1,0|2,0,0]=4 349 B17R2.5301 Cc1cccc(CNCc2cccnc2)c1 Amb6355622 [0,1,0,0,1,0|2,0,0]=4 350 B17R2.5301 Cc1cccc(CNCc2ccncc2)c1 Amb6728547 [0,1,0,0,1,0|2,0,0]=4 351 B17R2.5301 Cc1cccc(NCCc2ccccc2)c1 Amb6684422 [0,1,0,0,1,0|2,0,0]=4 352 B17R2.5301 Clc1cc(CNCc2ccccc2)ccn1 Amb27750704 [0,1,0,0,1,0|2,0,0]=4 353 B17R2.5301 Clc1cc(COCc2ccccc2)ccn1 Amb27611493 [0,1,0,0,1,0|1,1,0]=4 354 B17R2.5301 Clc1cccc(CNCc2ccccc2)c1 Amb1923462 [0,1,0,0,1,0|1,0,0]=3 355 B17R2.5301 Clc1cccc(CNCc2ccccn2)c1 Amb1838736 [0,1,0,0,1,0|2,0,0]=4 356 B17R2.5301 Clc1cccc(CNCc2cccnc2)c1 Amb6352462 [0,1,0,0,1,0|2,0,0]=4 357 B17R2.5301 Clc1cccc(CNCc2ccncc2)c1 Amb1923502 [0,1,0,0,1,0|2,0,0]=4 358 B17R2.5301 Clc1cccc(COCc2ccccc2)n1 Amb27407587 [0,1,0,0,1,0|1,1,0]=4 359 B17R2.5301 Clc1cccc(NCCc2ccccc2)c1 Amb6649485 [0,1,0,0,1,0|2,0,0]=4 360 B17R2.5301 Fc1cccc(CNCc2ccccc2)c1 Amb6352465 [0,1,0,0,1,0|1,0,0]=3 361 B17R2.5301 Fc1cccc(CNCc2ccccn2)c1 Amb6699027 [0,1,0,0,1,0|2,0,0]=4 362 B17R2.5301 Fc1cccc(NCCc2ccccc2)c1 Amb6695783 [0,1,0,0,1,0|2,0,0]=4 363 B17R2.5301 Ic1cccc(CNCc2ccccc2)c1 Amb26550498 [0,1,0,0,1,0|1,0,0]=3 364 B17R2.5301 Nc1cc(CCCc2ccccc2)ccn1 Amb24094447 [0,1,0,0,1,0|2,0,0]=4 365 B17R2.5301 Nc1cc(COCc2ccccc2)ccn1 Amb18311838 [0,1,0,0,1,0|1,1,0]=4 366 B17R2.5301 Nc1cccc(CCCc2ccccc2)c1 Amb13952732 [0,1,0,0,1,0|1,0,0]=3 367 B17R2.5301 Nc1cccc(COCc2ccccc2)c1 Amb2699336 [0,1,0,0,1,0|0,1,0]=3 368 B17R2.5301 Nc1cccc(CSCc2ccccc2)c1 Amb6676518 [0,1,0,0,1,0|0,0,0]=2 369 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb1119309 [0,1,0,0,1,0|1,1,0]=4 370 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb2111108 [0,1,0,0,1,0|1,1,0]=4 371 B17R2.5301 Oc1cccc(CNCc2ccccc2)c1 Amb6687458 [0,1,0,0,1,0|1,0,0]=3 372 B17R2.5301 Oc1cccc(CNCc2ccccn2)c1 Amb6699165 [0,1,0,0,1,0|2,0,0]=4 373 B17R2.5301 Oc1cccc(CNCc2cccnc2)c1 Amb4552899 [0,1,0,0,1,0|2,0,0]=4 374 B17R2.5301 Oc1cccc(CNCc2ccncc2)c1 Amb6729691 [0,1,0,0,1,0|2,0,0]=4 375 B17R2.5301 Oc1cccc(OCCc2ccccc2)c1 Amb8837429 [0,1,0,0,1,0|1,1,0]=4 376 B17R2.5301 Oc1cccc(\C=N\Cc2ccccc2)c1 Amb8485956 [0,1,0,0,1,0|1,0,1]=4 377 B19R2.4361 Nc1cccc(CCNCCc2ccccc2)c1 Amb18550393 [0,1,0,0,0,1|2,0,0]=4 378 B19R2.4361 Nc1cccc(COCCOc2ccccc2)c1 Amb6249186 [0,1,0,0,0,1|1,1,0]=4 379 B19R2.4361 Nc1cccc(OCCOCc2ccccc2)c1 Amb9026880 [0,1,0,0,0,1|1,1,0]=4 380 B19R2.4361 Nc1cccc(OCCSCc2ccccc2)c1 Amb9027374 [0,1,0,0,0,1|1,0,0]=3 381 B19R2.4484 Brc1ccccc1OCCOCc2ccccc2 Amb21856647 [0,1,0,0,0,1|1,1,0]=4 382 B19R2.4484 Fc1ccccc1OCCNCc2ccccc2 Amb10608681 [0,1,0,0,0,1|2,0,0]=4 383 B19R2.4484 Fc1ccccc1OCCNCc2ccccc2 Amb22588049 [0,1,0,0,0,1|2,0,0]=4 384 B19R2.4484 Nc1ccccc1OCCOCc2ccccc2 Amb9026878 [0,1,0,0,0,1|1,1,0]=4 385 B19R2.8899 CC(CNCCc1ccccc1)c2ccccc2 Amb6729153 [0,1,0,0,0,1|2,0,0]=4 386 B19R2.8899 NC(CCCCc1ccccc1)c2ccccc2 Amb20629765 [0,1,0,0,0,1|2,0,0]=4 387 B19R2.8899 O=C(NCSCc1ccccc1)c2ccccc2 Amb21953428 [0,1,0,0,0,1|1,0,1]=4 388 B19R2.8899 OC(CCNCc1ccccc1)c2ccccc2 Amb17348825 [0,1,0,0,0,1|2,0,0]=4 389 B19R2.8899 OC(CNCCc1ccccc1)c2ccccc2 Amb6384877 [0,1,0,0,0,1|2,0,0]=4 390 B19R2.8900 CC(Cc1ccccc1)NCCc2ccccc2 Amb20222565 [0,1,0,0,0,1|2,0,0]=4 391 B19R2.8900 CN(CCOc1ccccc1)Cc2ccccc2 Amb3993121 [0,1,0,0,0,1|2,0,0]=4 392 B19R2.8900 O=C(Cc1ccccc1)NCCc2ccccc2 Amb2720817 [0,1,0,0,0,1|2,0,0]=4 393 B19R2.11855 Fc1ccc(CCNCCc2ccccc2)cc1 Amb6689374 [0,1,0,0,0,1|2,0,0]=4 394 B19R2.11855 Nc1ccc(CCNCCc2ccccc2)cc1 Amb18550350 [0,1,0,0,0,1|2,0,0]=4 395 B19R2.11855 Nc1ccc(CSCCCc2ccccc2)cc1 Amb17498293 [0,1,0,0,0,1|1,0,0]=3 396 B19R2.11855 Nc1ccc(OCCOCc2ccccc2)cc1 Amb9026881 [0,1,0,0,0,1|1,1,0]=4 397 B19R2.11855 Nc1ccc(OCCSCc2ccccc2)cc1 Amb8868238 [0,1,0,0,0,1|1,0,0]=3 398 B19R2.16162 CC(CCc1ccccc1)NCc2ccccc2 Amb875692 [0,1,0,0,0,1|2,0,0]=4 399 B19R2.16162 CN(CCc1ccccc1)CCc2ccccc2 Amb22489754 [0,1,0,0,0,1|2,0,0]=4 400 B19R2.16162 C[NH+](CCc1ccccc1)CCc2ccccc2 Amb4023451 [0,1,0,0,0,1|2,0,0]=4 401 B19R2.16162 ClP(OCc1ccccc1)OCc2ccccc2 Amb27206026 [0,1,0,0,0,1|0,2,0]=4 402 B19R2.16162 N=C(NCc1ccccc1)NCc2ccccc2 Amb27236648 [0,1,0,0,0,1|2,0,0]=4 403 B19R2.16162 NC(CCc1ccccc1)CCc2ccccc2 Amb20629669 [0,1,0,0,0,1|2,0,0]=4 404 B19R2.16162 O=C(CCc1ccccc1)CCc2ccccc2 Amb17940894 [0,1,0,0,0,1|2,0,0]=4 405 B19R2.16162 O=C(CCc1ccccc1)CCc2ccccc2 Amb33719267 [0,1,0,0,0,1|2,0,0]=4 406 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 Amb6346392 [0,1,0,0,0,1|2,0,0]=4 407 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccc2 Amb1207241 [0,1,0,0,0,1|2,0,0]=4 408 B19R2.16162 O=C(NCc1ccccc1)OCc2ccccc2 Amb5290122 [0,1,0,0,0,1|1,1,0]=4 409 B19R2.16162 O=C(OCc1ccccc1)OCc2ccccc2 Amb4013588 [0,1,0,0,0,1|0,2,0]=4 410 B19R2.16162 O=[PH](OCc1ccccc1)OCc2ccccc2 Amb8392900 [0,1,0,0,0,1|0,2,0]=4 411 B19R2.16162 OC(CCc1ccccc1)CCc2ccccc2 Amb20629668 [0,1,0,0,0,1|2,0,0]=4 412 B19R2.16162 OP(OCc1ccccc1)OCc2ccccc2 Amb8395347 [0,1,0,0,0,1|0,2,0]=4 413 B19R2.16162 S=C(NCc1ccccc1)NCc2ccccc2 Amb6357974 [0,1,0,0,0,1|2,0,0]=4 414 B19R2.16162 S=C(SCc1ccccc1)SCc2ccccc2 Amb33777152 [0,1,0,0,0,1|0,0,0]=2 415 B19R2.57 CCc1ccc(CNCCc2ccccc2)cc1 Amb837847 [0,2,0,0,0,0|2,0,0]=4 416 B19R2.57 COc1ccc(CCNCc2ccccc2)cc1 Amb19959919 [0,2,0,0,0,0|2,0,0]=4 417 B19R2.57 COc1ccc(CCNCc2ccccc2)cc1 Amb6344747 [0,2,0,0,0,0|2,0,0]=4 418 B19R2.57 COc1ccc(CNCCc2ccccc2)cc1 Amb4032124 [0,2,0,0,0,0|2,0,0]=4 419 B19R2.57 COc1ccc(CNCCc2ccccc2)cc1 Amb6315559 [0,2,0,0,0,0|2,0,0]=4 420 B19R2.57 CSc1ccc(CNCCc2ccccc2)cc1 Amb6623523 [0,2,0,0,0,0|2,0,0]=4 421 B19R2.57 N#Cc1ccc(COCCc2ccccc2)cc1 Amb9208576 [0,2,0,0,0,0|1,1,0]=4 422 B19R2.286 Nc1ccc(CNC(=O)Cc2ccccc2)cc1 Amb17158942 [0,2,0,0,0,0|2,0,0]=4 423 B19R2.295 Cc1ccc(CNCCc2ccc(N)cc2)cc1 Amb18050947 [0,2,0,0,0,0|2,0,0]=4 424 B19R2.295 Fc1ccc(CCNCc2ccc(F)cc2)cc1 Amb1068535 [0,2,0,0,0,0|2,0,0]=4 425 B19R2.295 Nc1ccc(CCNCc2ccc(Cl)cc2)cc1 Amb18550367 [0,2,0,0,0,0|2,0,0]=4 426 B19R2.295 Nc1ccc(CCNCc2ccc(F)cc2)cc1 Amb18550354 [0,2,0,0,0,0|2,0,0]=4 427 B19R2.4547 Clc1ccc(CNCCc2ccccc2)c(Cl)c1 Amb1846588 [0,2,0,0,0,0|2,0,0]=4 428 B19R2.4547 Fc1ccc(CNCCc2ccccc2)c(F)c1 Amb6695452 [0,2,0,0,0,0|2,0,0]=4 429 B19R2.11839 Cc1cc(CNOCc2ccccc2)ccc1Cl Amb33253246 [0,2,0,0,0,0|1,1,0]=4 430 B19R2.11839 Clc1ccc(CNOCc2ccccc2)cc1Cl Amb32412834 [0,2,0,0,0,0|1,1,0]=4 431 B19R2.11850 CC(NCCc1ccc(N)cc1)c2ccccc2 Amb18050953 [0,2,0,0,0,0|2,0,0]=4 432 B19R2.11850 Cc1ccc(CNCC(C)c2ccccc2)cc1 Amb6655674 [0,2,0,0,0,0|2,0,0]=4 433 B19R2.11850 Cc1ccc(CNCC(O)c2ccccc2)cc1 Amb9242065 [0,2,0,0,0,0|2,0,0]=4 434 B19R2.11850 Nc1ccc(CSCC(=O)c2ccccc2)cc1 Amb17498651 [0,2,0,0,0,0|1,0,1]=4 435 B19R2.11850 OC(CNCc1ccc(Br)cc1)c2ccccc2 Amb1931502 [0,2,0,0,0,0|2,0,0]=4 436 B19R2.11850 OC(CNCc1ccc(Cl)cc1)c2ccccc2 Amb9242092 [0,2,0,0,0,0|2,0,0]=4 437 B19R2.11850 OC(CNCc1ccc(F)cc1)c2ccccc2 Amb1930762 [0,2,0,0,0,0|2,0,0]=4 438 B19R2.11854 Cc1ccc(CNCCc2cccc(N)c2)cc1 Amb18550401 [0,2,0,0,0,0|2,0,0]=4 439 B19R2.11854 Fc1ccc(CCNCc2cccc(F)c2)cc1 Amb6689356 [0,2,0,0,0,0|2,0,0]=4 440 B19R2.11854 Nc1cccc(CCNCc2ccc(Cl)cc2)c1 Amb18051006 [0,2,0,0,0,0|2,0,0]=4 441 B19R2.11854 Nc1cccc(CCNCc2ccc(F)cc2)c1 Amb18550400 [0,2,0,0,0,0|2,0,0]=4 442 B19R2.11857 CC(Cc1ccc(N)cc1)NCc2ccccc2 Amb18550316 [0,2,0,0,0,0|2,0,0]=4 443 B19R2.11857 CN(CCc1ccccc1)Cc2ccc(O)cc2 Amb11033537 [0,2,0,0,0,0|2,0,0]=4 444 B19R2.11857 Cc1ccc(CC(=O)NCc2ccccc2)cc1 Amb3305947 [0,2,0,0,0,0|2,0,0]=4 445 B19R2.11857 Nc1ccc(CC(=O)NCc2ccccc2)cc1 Amb6242189 [0,2,0,0,0,0|2,0,0]=4 446 B19R2.11857 O=C(Cc1ccc(Br)cc1)NCc2ccccc2 Amb1798183 [0,2,0,0,0,0|2,0,0]=4 447 B19R2.11857 O=C(Cc1ccc(F)cc1)NCc2ccccc2 Amb1216124 [0,2,0,0,0,0|2,0,0]=4 448 B19R2.11857 O=C(Cc1ccc(O)cc1)NCc2ccccc2 Amb18664014 [0,2,0,0,0,0|2,0,0]=4 449 B19R2.11857 O=C(Cc1ccc(O)cc1)OCc2ccccc2 Amb3939532 [0,2,0,0,0,0|1,1,0]=4 450 B19R2.11857 S=C(Cc1ccc(Br)cc1)NCc2ccccc2 Amb8459327 [0,2,0,0,0,0|2,0,0]=4 451 B19R2.12311 Cc1ccc(CNCCc2ccccc2F)cc1 Amb6693008 [0,2,0,0,0,0|2,0,0]=4 452 B19R2.12311 Cc1ccccc1CNCCc2ccc(F)cc2 Amb6689357 [0,2,0,0,0,0|2,0,0]=4 453 B19R2.12311 Fc1ccc(CCNCc2ccccc2Cl)cc1 Amb6465200 [0,2,0,0,0,0|2,0,0]=4 454 B19R2.12311 Fc1ccc(CNCCc2ccccc2F)cc1 Amb6692999 [0,2,0,0,0,0|2,0,0]=4 455 B19R2.12311 Nc1ccc(CCNCc2ccccc2Cl)cc1 Amb18550373 [0,2,0,0,0,0|2,0,0]=4 456 B19R2.12311 Nc1ccc(CCNCc2ccccc2F)cc1 Amb18050967 [0,2,0,0,0,0|2,0,0]=4 457 B19R2.3967 CN\C(=N\c1ccccc1)SCc2ccccc2 Amb22261556 [0,2,0,0,0,0|2,0,0]=4 458 B19R2.4385 Cc1cccc(CC(=O)NCc2ccccc2)c1 Amb6504621 [0,2,0,0,0,0|2,0,0]=4 459 B19R2.4385 Nc1cccc(CC(=O)NCc2ccccc2)c1 Amb17048853 [0,2,0,0,0,0|2,0,0]=4 460 B19R2.4385 O=C(Cc1cccc(Br)c1)NCc2ccccc2 Amb4009262 [0,2,0,0,0,0|2,0,0]=4 461 B19R2.4385 O=C(Cc1cccc(F)c1)NCc2ccccc2 Amb45630 [0,2,0,0,0,0|2,0,0]=4 462 B19R2.4385 O=C(Cc1cccc(O)c1)OCc2ccccc2 Amb6357596 [0,2,0,0,0,0|1,1,0]=4 463 B19R2.4482 CC(Cc1ccccc1)NCc2ccccc2Cl Amb6328764 [0,2,0,0,0,0|2,0,0]=4 464 B19R2.4485 Nc1ccccc1CC(=O)NCc2ccccc2 Amb6247564 [0,2,0,0,0,0|2,0,0]=4 465 B19R2.4485 O=C(Cc1ccccc1Br)NCc2ccccc2 Amb16206867 [0,2,0,0,0,0|2,0,0]=4 466 B19R2.4485 O=C(Cc1ccccc1O)NCc2ccccc2 Amb27492205 [0,2,0,0,0,0|2,0,0]=4 467 B19R2.8924 O=C(Cc1ccccc1)C(=O)Cc2ccccc2 Amb17777122 [0,2,0,0,0,0|2,0,0]=4 468 B19R2.8929 CN(Cc1ccccc1)CC(Cl)c2ccccc2 Amb17546776 [0,2,0,0,0,0|2,0,0]=4 469 B19R2.8929 CN(Cc1ccccc1)CC(O)c2ccccc2 Amb10814879 [0,2,0,0,0,0|2,0,0]=4 470 B19R2.16158 CC(NCc1ccccc1)C(O)c2ccccc2 Amb18604518 [0,2,0,0,0,0|2,0,0]=4 471 B19R2.16158 NC(C(=O)NCc1ccccc1)c2ccccc2 Amb9716761 [0,2,0,0,0,0|2,0,0]=4 472 B19R2.16158 N[C@@H](C(=O)NCc1ccccc1)c2ccccc2 Amb18015030 [0,2,0,0,0,0|2,0,0]=4 473 B19R2.16158 O=C(NCc1ccccc1)C(Cl)c2ccccc2 Amb9702960 [0,2,0,0,0,0|2,0,0]=4 474 B19R2.16158 O=C(NCc1ccccc1)C(O)c2ccccc2 Amb3368805 [0,2,0,0,0,0|2,0,0]=4 475 B19R2.16158 O=C(OCc1ccccc1)[C@H](O)c2ccccc2 Amb3939683 [0,2,0,0,0,0|1,1,0]=4 476 B19R2.3387 COc1ccccc1CNCCc2ccccc2 Amb22304810 [0,2,0,0,0,0|2,0,0]=4 477 B19R2.3387 COc1ccccc1CNCCc2ccccc2 Amb2693184 [0,2,0,0,0,0|2,0,0]=4 478 B19R2.3387 N#Cc1ccccc1COCCc2ccccc2 Amb9208579 [0,2,0,0,0,0|1,1,0]=4 479 B19R2.4400 Clc1cccc(CNCCc2ccccc2)c1Cl Amb6615935 [0,2,0,0,0,0|2,0,0]=4 480 B19R2.4481 Cc1ccccc1CNCC(O)c2ccccc2 Amb9243322 [0,2,0,0,0,0|2,0,0]=4 481 B19R2.4481 OC(CNCc1ccccc1Cl)c2ccccc2 Amb9242100 [0,2,0,0,0,0|2,0,0]=4 482 B19R2.4481 OC(CNCc1ccccc1F)c2ccccc2 Amb6862671 [0,2,0,0,0,0|2,0,0]=4 483 B19R2.7681 Clc1cccc(Cl)c1CNCCc2ccccc2 Amb3693022 [0,2,0,0,0,0|2,0,0]=4 484 B19R2.7681 Fc1cccc(Cl)c1CNCCc2ccccc2 Amb838196 [0,2,0,0,0,0|2,0,0]=4 485 B19R2.47945 Nc1cccc(CCNCc2ccccc2Cl)c1 Amb18550431 [0,2,0,0,0,0|2,0,0]=4 486 B19R2.47945 Nc1cccc(CCNCc2ccccc2F)c1 Amb18550427 [0,2,0,0,0,0|2,0,0]=4 487 B19R2.50166 Nc1ccccc1CCCCc2ccccc2N Amb17777456 [0,2,0,0,0,0|2,0,0]=4 488 B19R2.50166 Nc1ccccc1CCCCc2ccccc2N Amb17777457 [0,2,0,0,0,0|2,0,0]=4 489 B19R2.50166 Nc1ccccc1CCCCc2ccccc2N Amb2385376 [0,2,0,0,0,0|2,0,0]=4 490 B19R2.906 COc1cccc(CCNCc2ccccc2)c1 Amb17159109 [0,2,0,0,0,0|2,0,0]=4 491 B19R2.906 COc1cccc(CCNCc2ccccc2)c1 Amb6760438 [0,2,0,0,0,0|2,0,0]=4 492 B19R2.906 COc1cccc(CNCCc2ccccc2)c1 Amb6335710 [0,2,0,0,0,0|2,0,0]=4 493 B19R2.906 N#Cc1cccc(COCCc2ccccc2)c1 Amb9208574 [0,2,0,0,0,0|1,1,0]=4 494 B19R2.4360 Oc1cccc(CNCCc2cccc(F)c2)c1 Amb9255611 [0,2,0,0,0,0|2,0,0]=4 495 B19R2.4369 CC(NCCc1cccc(N)c1)c2ccccc2 Amb18550404 [0,2,0,0,0,0|2,0,0]=4 496 B19R2.4369 OC(CNCc1cccc(Br)c1)c2ccccc2 Amb6456456 [0,2,0,0,0,0|2,0,0]=4 497 B19R2.4369 OC(CNCc1cccc(Cl)c1)c2ccccc2 Amb1931497 [0,2,0,0,0,0|2,0,0]=4 498 B19R2.4394 Cc1cccc(C(O)CNCc2ccccc2)c1 Amb17159141 [0,2,0,0,0,0|2,0,0]=4 499 B19R2.4394 OC(CNCc1ccccc1)c2cccc(Cl)c2 Amb17163953 [0,2,0,0,0,0|2,0,0]=4 500 B19R2.2116 BrCC(COCc1ccccc1)c2ccccc2 Amb32688255 [0,2,0,0,0,0|1,1,0]=4 501 B19R2.2116 ClCC(COCc1ccccc1)c2ccccc2 Amb32688247 [0,2,0,0,0,0|1,1,0]=4 502 B19R2.2116 N#CC(NCCc1ccccc1)c2ccccc2 Amb17043573 [0,2,0,0,0,0|2,0,0]=4 503 B19R2.2116 N#CC(NCCc1ccccc1)c2ccccc2 Amb22736570 [0,2,0,0,0,0|2,0,0]=4 504 B19R2.8898 CC(CNC(C)c1ccccc1)c2ccccc2 Amb6651920 [0,2,0,0,0,0|2,0,0]=4 505 B19R2.8898 NC(CCC(N)c1ccccc1)c2ccccc2 Amb23560198 [0,2,0,0,0,0|2,0,0]=4 506 B19R2.8898 OC(C#CC(O)c1ccccc1)c2ccccc2 Amb3432828 [0,2,0,0,0,0|2,0,0]=4 507 B19R2.8898 S=C(SSC(=S)c1ccccc1)c2ccccc2 Amb16186709 [0,2,0,0,0,0|0,0,2]=4 508 B19R2.49526 CC(O)(CCCc1ccccc1)c2ccccc2 Amb17778026 [0,2,0,0,0,0|2,0,0]=4 509 B17R3.8 C1=C(c2ccccc2)c3ccccc3C1 Amb17778883 [0,0,0,1,1,0|1,0,1]=4 510 B17R3.8 C1=CC(c2ccccc2)c3ccccc31 Amb20240702 [0,0,0,1,1,0|1,0,1]=4 511 B17R3.8 c1ccc(C2CNc3ccccc32)cc1 Amb32882496 [0,0,0,1,1,0|2,0,0]=4 512 B17R3.8 c1ccc(C2NCc3ccccc32)cc1 Amb31135052 [0,0,0,1,1,0|1,0,0]=3 513 B17R3.8 c1ccc(C2NCc3cnccc32)cc1 Amb18188884 [0,0,0,1,1,0|2,0,0]=4 514 B17R3.8 c1ccc(N2CCc3ccccc32)cc1 Amb8392756 [0,0,0,1,1,0|2,0,0]=4 515 B17R3.1927 c1ccc(C2CC2c3ccccc3)cc1 Amb4302622 [0,0,0,1,1,0|1,0,0]=3 516 B17R3.1927 c1ccc(C2OC2c3ccccc3)cc1 Amb2610165 [0,0,0,1,1,0|0,1,0]=3 517 B17R3.1927 c1ccc([C@@H]2O[C@H]2c3ccccc3)cc1 Amb8513314 [0,0,0,1,1,0|0,1,0]=3 518 B17R3.1927 c1ccc([C@H]2O[C@@H]2c3ccccc3)cc1 Amb8629192 [0,0,0,1,1,0|0,1,0]=3 519 B17R3.1939 c1ccc(CC2Cc3ccccc32)cc1 Amb17778868 [0,0,0,1,1,0|1,0,0]=3 520 B17R3.1963 c1ccc-2c(c1)CCNc3ccccc32 Amb19375172 [0,0,0,1,1,0|2,0,0]=4 521 B17R3.1963 c1ccc-2c(c1)CNCc3ccccc32 Amb13952599 [0,0,0,1,1,0|1,0,0]=3 522 B17R3.1963 c1ccc-2c(c1)CNCc3ccccc32 Amb6740263 [0,0,0,1,1,0|1,0,0]=3 523 B19R3.28 c1ccc(CC2=NCCc3ccccc32)cc1 Amb4038800 [0,0,0,1,0,1|2,0,0]=4 524 B19R3.28 c1ccc(CC2NCCc3ccccc32)cc1 Amb1254530 [0,0,0,1,0,1|2,0,0]=4 525 B19R3.28 c1ccc(CC2NCCc3ccccc32)cc1 Amb28662043 [0,0,0,1,0,1|2,0,0]=4 526 B19R3.28 c1ccc(CC2[NH2+]CCc3ccccc32)cc1 Amb17779194 [0,0,0,1,0,1|2,0,0]=4 527 B19R3.28 c1ccc(CN2CCNc3ccccc32)cc1 Amb2383684 [0,0,0,1,0,1|2,0,0]=4 528 B19R3.2370 c1ccc(CCC2NCc3ccccc32)cc1 Amb31163175 [0,0,0,1,0,1|2,0,0]=4 529 B19R3.2370 c1ccc(CNC2CCc3ccccc32)cc1 Amb6687401 [0,0,0,1,0,1|2,0,0]=4 530 B19R3.19220 c1ccc(C2CNCCc3ccccc32)cc1 Amb1823958 [0,0,0,1,0,1|2,0,0]=4 531 B19R3.19220 c1ccc(C2NCCCc3ccccc32)cc1 Amb31163174 [0,0,0,1,0,1|2,0,0]=4 532 B19R3.19220 c1ccc(C2NCCOc3ccccc32)cc1 Amb17991284 [0,0,0,1,0,1|2,0,0]=4 533 B19R3.19220 c1ccc(C2NCCOc3ccccc32)cc1 Amb5750855 [0,0,0,1,0,1|2,0,0]=4 534 B19R3.421 Cc1ccc(C2NCCc3ccccc32)cc1 Amb5735607 [0,1,0,1,0,0|2,0,0]=4 535 B19R3.421 Clc1ccc(C2NCCc3ccccc32)cc1 Amb5735613 [0,1,0,1,0,0|2,0,0]=4 536 B19R3.421 Fc1ccc(C2NCCc3ccccc32)cc1 Amb5735610 [0,1,0,1,0,0|2,0,0]=4 537 B19R3.421 Nc1ccc(C2OCCc3ccccc32)cc1 Amb13951690 [0,1,0,1,0,0|1,1,0]=4 538 B19R3.421 Oc1ccc(C2CCCc3ccccc32)cc1 Amb5719447 [0,1,0,1,0,0|2,0,0]=4 539 B19R3.434 Nc1ccc(CN2CCc3ccccc32)cc1 Amb1128741 [0,1,0,1,0,0|2,0,0]=4 540 B19R3.4066 Cc1ccc2c(c1)C(c3ccccc3)CNC2 Amb22751936 [0,1,0,1,0,0|2,0,0]=4 541 B19R3.4066 Cc1ccc2c(c1)C(c3ccccc3)NCC2 Amb5735698 [0,1,0,1,0,0|2,0,0]=4 542 B19R3.4066 Clc1ccc2c(c1)C(c3ccccc3)CNC2 Amb32584098 [0,1,0,1,0,0|2,0,0]=4 543 B19R3.4066 Fc1ccc2c(c1)C(c3ccccc3)CNC2 Amb32584096 [0,1,0,1,0,0|2,0,0]=4 544 B19R3.5866 Brc1ccc2c(c1)N(Cc3ccccc3)CC2 Amb28193319 [0,1,0,1,0,0|2,0,0]=4 545 B19R3.5866 Nc1ccc2c(c1)N(Cc3ccccc3)CC2 Amb6683312 [0,1,0,1,0,0|2,0,0]=4 546 B19R3.288 O=C1Cc2ccccc2N1Cc3ccccc3 Amb2720642 [0,1,0,1,0,0|2,0,0]=4 547 B19R3.294 O=C1Cc2ccccc2C(c3ccccc3)N1 Amb2732028 [0,1,0,1,0,0|2,0,0]=4 548 B19R3.298 O=C1NC(c2ccccc2)C1c3ccccc3 Amb33192994 [0,1,0,1,0,0|2,0,0]=4 549 B19R3.19215 c1ccc(CC2CCc3ccccc3N2)cc1 Amb32857238 [0,1,0,1,0,0|2,0,0]=4 550 B19R3.19215 c1ccc(NC2=Nc3ccccc3CS2)cc1 Amb1103999 [0,1,0,1,0,0|2,0,0]=4 551 B19R3.19255 c1ccc(CSc2nc3ccccc3o2)cc1 Amb1397104 [0,1,0,1,0,0|2,0,0]=4 552 B19R3.19255 c1ccc(CSc2nc3ccccc3s2)cc1 Amb6367587 [0,1,0,1,0,0|2,0,0]=4 553 B19R3.19273 c1ccc(CN2CC(c3ccccc3)C2)cc1 Amb22494747 [0,1,0,1,0,0|2,0,0]=4 554 B19R3.97 Cc1ccccc1C2NCCc3ccccc32 Amb5735605 [0,1,0,1,0,0|2,0,0]=4 555 B19R3.97 Clc1ccccc1C2NCCc3ccccc32 Amb5735611 [0,1,0,1,0,0|2,0,0]=4 556 B19R3.97 Fc1ccccc1C2NCCc3ccccc32 Amb5735608 [0,1,0,1,0,0|2,0,0]=4 557 B19R3.307 Nc1ccccc1CN2CCc3ccccc32 Amb6251162 [0,1,0,1,0,0|2,0,0]=4 558 B19R3.8297 Cc1cccc2c1CCNC2c3ccccc3 Amb5735634 [0,1,0,1,0,0|2,0,0]=4 559 B19R3.8297 Clc1cccc2c1CNCC2c3ccccc3 Amb32584097 [0,1,0,1,0,0|2,0,0]=4 560 B19R3.8297 Fc1cccc2c1CNCC2c3ccccc3 Amb32584094 [0,1,0,1,0,0|2,0,0]=4 561 B19R3.19286 c1ccc(C2CNCc3ccccc3O2)cc1 Amb9173935 [0,1,0,1,0,0|2,0,0]=4 562 B19R3.99 Nc1ccc2c(c1)CCN2Cc3ccccc3 Amb10609948 [0,1,0,1,0,0|2,0,0]=4 563 B19R3.99 Nc1ccc2c(c1)CCN2Cc3ccccc3 Amb6683224 [0,1,0,1,0,0|2,0,0]=4 564 B19R3.102 Cc1ccc2c(c1)CCNC2c3ccccc3 Amb5735666 [0,1,0,1,0,0|2,0,0]=4 565 B19R3.102 Fc1ccc2c(c1)CNCC2c3ccccc3 Amb32584095 [0,1,0,1,0,0|2,0,0]=4 566 B19R3.9760 Cc1cccc(C2NCCc3ccccc32)c1 Amb5735606 [0,1,0,1,0,0|2,0,0]=4 567 B19R3.9760 Clc1cccc(C2NCCc3ccccc32)c1 Amb5735612 [0,1,0,1,0,0|2,0,0]=4 568 B19R3.9760 Fc1cccc(C2NCCc3ccccc32)c1 Amb5735609 [0,1,0,1,0,0|2,0,0]=4 569 B19R3.9780 Nc1cccc(CN2CCc3ccccc32)c1 Amb6243284 [0,1,0,1,0,0|2,0,0]=4 570 B19R3.27 c1ccc(C2C[NH2+]C(c3ccccc3)C2)cc1 Amb17843502 [0,1,0,1,0,0|2,0,0]=4 571 B19R3.27 c1ccc(C2C[NH2+]C(c3ccccc3)C2)cc1 Amb17843503 [0,1,0,1,0,0|2,0,0]=4 572 B19R3.22113 NC(c1ccccc1)C2CC2c3ccccc3 Amb33299431 [0,1,0,1,0,0|2,0,0]=4 573 B19R3.22113 NC(c1ccccc1)C2CC2c3ccccc3 Amb33299432 [0,1,0,1,0,0|2,0,0]=4 574 B19R4.2073 c1ccc2c(c1)CC3=C2Cc4ccccc43 Amb4012573 [0,0,0,2,0,0|2,0,0]=4 575 B19R4.2067 c1ccc2c(c1)CC2C3Cc4ccccc43 Amb17844017 [0,0,0,2,0,0|2,0,0]=4 576 B19R4.14 C1=CC2c3ccccc3C1c4ccccc42 Amb4451126 [0,0,0,2,0,0|2,0,0]=4 577 B19R4.14 c1ccc2c(c1)C3CCC2c4ccccc43 Amb4035363 [0,0,0,2,0,0|2,0,0]=4 578 B15R2.2195 C(#Cc1ccccc1)c2ccccc2 Amb8390026 [0,0,0,0,2,0|0,0,2]=4 579 B15R2.2195 C(=C/c1ccccc1)/c2ccccc2 Amb16192901 [0,0,0,0,2,0|0,0,2]=4 580 B15R2.2195 C(=C\c1ccccc1)/c2ccccc2 Amb18511865 [0,0,0,0,2,0|0,0,2]=4 581 B15R2.2195 C(=N\c1ccccc1)/c2ccccc2 Amb32411825 [0,0,0,0,2,0|1,0,1]=4 582 B15R2.2195 c1cc(CCc2ccncc2)ccn1 Amb6336326 [0,0,0,0,2,0|2,0,0]=4 583 B15R2.2195 c1cc(SSc2ccncc2)ccn1 Amb632116 [0,0,0,0,2,0|2,0,0]=4 584 B15R2.2195 c1cc[n+](CC[n+]2ccccc2)cc1 Amb2221672 [0,0,0,0,2,0|2,0,0]=4 585 B15R2.2195 c1ccc(CCc2ccccc2)cc1 Amb17678850 [0,0,0,0,2,0|0,0,0]=2 586 B15R2.2195 c1ccc(CCc2ccccn2)cc1 Amb5494186 [0,0,0,0,2,0|1,0,0]=3 587 B15R2.2195 c1ccc(CCc2ccccn2)nc1 Amb2713299 [0,0,0,0,2,0|2,0,0]=4 588 B15R2.2195 c1ccc(CCc2cccnc2)nc1 Amb6769550 [0,0,0,0,2,0|2,0,0]=4 589 B15R2.2195 c1ccc(CCc2ccncc2)cc1 Amb2612998 [0,0,0,0,2,0|1,0,0]=3 590 B15R2.2195 c1ccc(CCc2cnccn2)cc1 Amb15695191 [0,0,0,0,2,0|2,0,0]=4 591 B15R2.2195 c1ccc(CNc2ccccc2)cc1 Amb6355841 [0,0,0,0,2,0|1,0,0]=3 592 B15R2.2195 c1ccc(CNc2ccccn2)cc1 Amb1087875 [0,0,0,0,2,0|2,0,0]=4 593 B15R2.2195 c1ccc(CNc2cccnc2)cc1 Amb2383000 [0,0,0,0,2,0|2,0,0]=4 594 B15R2.2195 c1ccc(CNc2ccncc2)cc1 Amb597752 [0,0,0,0,2,0|2,0,0]=4 595 B15R2.2195 c1ccc(COc2ccccc2)cc1 Amb24097492 [0,0,0,0,2,0|0,1,0]=3 596 B15R2.2195 c1ccc(COc2ccccc2)cc1 Amb2691207 [0,0,0,0,2,0|0,1,0]=3 597 B15R2.2195 c1ccc(COc2ccccn2)cc1 Amb16191945 [0,0,0,0,2,0|1,1,0]=4 598 B15R2.2195 c1ccc(COc2cccnc2)cc1 Amb21927728 [0,0,0,0,2,0|1,1,0]=4 599 B15R2.2195 c1ccc(COc2ccncc2)cc1 Amb10603750 [0,0,0,0,2,0|1,1,0]=4 600 B15R2.2195 c1ccc(CSc2ccccc2)cc1 Amb2684670 [0,0,0,0,2,0|0,0,0]=2 601 B15R2.2195 c1ccc(CSc2ccccn2)cc1 Amb3862159 [0,0,0,0,2,0|1,0,0]=3 602 B15R2.2195 c1ccc(CSc2cccnn2)cc1 Amb25785634 [0,0,0,0,2,0|2,0,0]=4 603 B15R2.2195 c1ccc(CSc2ncccn2)cc1 Amb1263972 [0,0,0,0,2,0|2,0,0]=4 604 B15R2.2195 c1ccc(C[SiH2]c2ccccc2)cc1 Amb22347054 [0,0,0,0,2,0|0,1,0]=3 605 B15R2.2195 c1ccc(NCc2ccccn2)cc1 Amb6356069 [0,0,0,0,2,0|2,0,0]=4 606 B15R2.2195 c1ccc(NCc2cccnc2)cc1 Amb6356070 [0,0,0,0,2,0|2,0,0]=4 607 B15R2.2195 c1ccc(NCc2ccncc2)cc1 Amb6356071 [0,0,0,0,2,0|2,0,0]=4 608 B15R2.2195 c1ccc(NNc2ccccc2)cc1 Amb28990937 [0,0,0,0,2,0|2,0,0]=4 609 B15R2.2195 c1ccc(NNc2ccccc2)cc1 Amb4000296 [0,0,0,0,2,0|2,0,0]=4 610 B15R2.2195 c1ccc(OCc2cccnc2)cc1 Amb27465872 [0,0,0,0,2,0|1,1,0]=4 611 B15R2.2195 c1ccc(OCc2ccncc2)cc1 Amb27217814 [0,0,0,0,2,0|1,1,0]=4 612 B15R2.2195 c1ccc(SC[n+]2ccccc2)cc1 Amb10568955 [0,0,0,0,2,0|1,0,0]=3 613 B15R2.2195 c1ccc(SCc2cccnc2)cc1 Amb10632429 [0,0,0,0,2,0|1,0,0]=3 614 B15R2.2195 c1ccc(SCc2cccnc2)nc1 Amb10710736 [0,0,0,0,2,0|2,0,0]=4 615 B15R2.2195 c1ccc(SCc2ccncc2)nc1 Amb25776849 [0,0,0,0,2,0|2,0,0]=4 616 B15R2.2195 c1ccc(SSc2ccccc2)cc1 Amb2687663 [0,0,0,0,2,0|0,0,0]=2 617 B15R2.2195 c1ccc(SSc2ccccn2)nc1 Amb2573305 [0,0,0,0,2,0|2,0,0]=4 618 B15R2.2195 c1ccc([Se][Se]c2ccccc2)cc1 Amb4138616 [0,0,0,0,2,0|0,2,0]=4 619 B15R2.2195 c1ccc([Te][Te]c2ccccc2)cc1 Amb6366598 [0,0,0,0,2,0|0,2,0]=4 620 B15R2.2195 c1ccc(\N=N/c2ccccc2)cc1 Amb10843899 [0,0,0,0,2,0|2,0,0]=4 621 B15R2.2195 c1ccc(\N=N\c2ccccc2)cc1 Amb4408423 [0,0,0,0,2,0|2,0,0]=4 622 B15R2.2195 c1cncc(SSc2cccnc2)c1 Amb22002419 [0,0,0,0,2,0|2,0,0]=4 623 B15R2.2196 c1ccc(CNCc2ccco2)cc1 Amb6335661 [0,0,0,0,2,0|2,0,0]=4 624 B15R2.2196 c1ccc(CNCc2ccco2)cc1 Amb6880630 [0,0,0,0,2,0|2,0,0]=4 625 B15R2.2196 c1ccc(CNCc2cccs2)cc1 Amb24121220 [0,0,0,0,2,0|2,0,0]=4 626 B15R2.2196 c1ccc(CNCc2cccs2)cc1 Amb838211 [0,0,0,0,2,0|2,0,0]=4 627 B15R2.2196 c1ccc(CNCc2ccoc2)cc1 Amb19006886 [0,0,0,0,2,0|2,0,0]=4 628 B15R2.2196 c1ccc(COCc2cccs2)cc1 Amb27633430 [0,0,0,0,2,0|1,1,0]=4 629 B15R2.2196 c1ccc(C[NH2+]Cc2ccco2)cc1 Amb33513212 [0,0,0,0,2,0|2,0,0]=4 630 B15R2.2194 c1coc(CSSCc2ccco2)c1 Amb6356701 [0,0,0,0,2,0|2,0,0]=4 631 B19R2.2628 C(#Cc1ccccc1)CNOCc2ccccc2 Amb28386795 [0,0,0,0,0,2|1,1,0]=4 632 B19R2.2628 C(=C\SCc1ccccc1)/SCc2ccccc2 Amb9786803 [0,0,0,0,0,2|0,0,0]=2 633 B19R2.2628 C(=C\c1ccccc1)/CNCCc2ccccc2 Amb6455814 [0,0,0,0,0,2|2,0,0]=4 634 B19R2.2628 c1ccc(CNCCCOc2ccccc2)cc1 Amb17308714 [0,0,0,0,0,2|2,0,0]=4 635 B19R2.2628 c1ccc(CNCCNCc2ccccc2)cc1 Amb21962135 [0,0,0,0,0,2|2,0,0]=4 636 B19R2.2628 c1ccc(CNCCNCc2ccccc2)cc1 Amb6357755 [0,0,0,0,0,2|2,0,0]=4 637 B19R2.2628 c1ccc(COCCOCc2ccccc2)cc1 Amb4012823 [0,0,0,0,0,2|0,2,0]=4 638 B19R2.2628 c1ccc(C[NH2+]CC[NH2+]Cc2ccccc2)cc1 Amb4004965 [0,0,0,0,0,2|2,0,0]=4 639 B19R2.2628 c1ccc(NCCCCOc2ccccc2)cc1 Amb17307119 [0,0,0,0,0,2|2,0,0]=4