0 B13R1.718 C#CC(=O)CNCc1ccccc1 Amb33131574 [0,0,0,0,0,0|2,0,1]=3 1 B13R1.718 C=C(C=O)COCc1ccccc1 Amb8392637 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.718 C=C(CC)CNCc1ccccc1 Amb27951926 [0,0,0,0,0,0|3,0,0]=3 3 B13R1.718 C=C(CO)COCc1ccccc1 Amb26653408 [0,0,0,0,0,0|4,0,0]=4 4 B13R1.718 C=CC(=O)CNCc1ccccc1 Amb26636176 [0,0,0,0,0,0|2,0,1]=3 5 B13R1.718 C=CC(=O)NCCc1ccccn1 Amb9480564 [0,0,0,0,0,0|3,0,1]=4 6 B13R1.718 CCC(=O)CNCc1ccccc1 Amb33131575 [0,0,0,0,0,0|2,0,0]=2 7 B13R1.718 CCC(=O)COCc1ccccc1 Amb18186198 [0,0,0,0,0,0|2,0,0]=2 8 B13R1.718 CCC(=O)CSCc1ccccc1 Amb4165971 [0,0,0,0,0,0|2,0,0]=2 9 B13R1.718 CCC(=O)NCCc1ccncc1 Amb24073074 [0,0,0,0,0,0|3,0,0]=3 10 B13R1.718 CCC(=O)N\N=C\c1ccccc1 Amb6775189 [0,0,0,0,0,0|3,0,1]=4 11 B13R1.718 CCC(=O)OCCc1ccccc1 Amb6357956 [0,0,0,0,0,0|2,0,0]=2 12 B13R1.718 CCC(=O)\C=N\Nc1ccccc1 Amb25979225 [0,0,0,0,0,0|3,0,1]=4 13 B13R1.718 CCC(C)CNCc1ccccc1 Amb6719953 [0,0,0,0,0,0|3,0,1]=4 14 B13R1.718 CCC(C)NCCc1ccccc1 Amb2119578 [0,0,0,0,0,0|3,0,1]=4 15 B13R1.718 CCC(C)NCCc1ccccc1 Amb2612139 [0,0,0,0,0,0|3,0,1]=4 16 B13R1.718 CCC(Cl)CNCc1ccccc1 Amb27407069 [0,0,0,0,0,0|3,0,1]=4 17 B13R1.718 CCC(N)CCSc1ccccc1 Amb13881553 [0,0,0,0,0,0|3,0,1]=4 18 B13R1.718 CCC(N)CNCc1ccccc1 Amb18796071 [0,0,0,0,0,0|3,0,1]=4 19 B13R1.718 CCC(N)COCc1ccccc1 Amb18809231 [0,0,0,0,0,0|3,0,1]=4 20 B13R1.718 CCC(O)CNCc1ccccc1 Amb8630542 [0,0,0,0,0,0|2,0,2]=4 21 B13R1.718 CCC(O)COCc1ccccc1 Amb18186601 [0,0,0,0,0,0|2,0,2]=4 22 B13R1.718 CCC([NH3+])COCc1ccccc1 Amb33513150 [0,0,0,0,0,0|3,0,1]=4 23 B13R1.718 CCS(=O)NOCc1ccccc1 Amb27774800 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.718 CC[C@@H](N)COCc1ccccc1 Amb6336619 [0,0,0,0,0,0|3,0,1]=4 25 B13R1.718 CC[C@@H](O)CNCc1ccccc1 Amb10067150 [0,0,0,0,0,0|2,0,2]=4 26 B13R1.718 CC[C@@H](O)COCc1ccccc1 Amb22225151 [0,0,0,0,0,0|2,0,2]=4 27 B13R1.718 CC[C@H](O)CNCc1ccccc1 Amb8630594 [0,0,0,0,0,0|2,0,2]=4 28 B13R1.718 CNC(=N)NCCc1cccnc1 Amb18804783 [0,0,0,0,0,0|4,0,0]=4 29 B13R1.718 CNC(=N)NCCc1ccncc1 Amb18184397 [0,0,0,0,0,0|4,0,0]=4 30 B13R1.718 CNC(=O)CCCc1ccccc1 Amb3886751 [0,0,0,0,0,0|1,0,0]=1 31 B13R1.718 CNC(=O)CCNc1ccccn1 Amb18186362 [0,0,0,0,0,0|3,0,0]=3 32 B13R1.718 CNC(=O)CCNc1cccnn1 Amb19023364 [0,0,0,0,0,0|4,0,0]=4 33 B13R1.718 CNC(=O)CCNc1ncccn1 Amb18796239 [0,0,0,0,0,0|4,0,0]=4 34 B13R1.718 CNC(=O)CNCc1ccccc1 Amb32674790 [0,0,0,0,0,0|2,0,0]=2 35 B13R1.718 CNC(=O)CNCc1ccccc1 Amb6707691 [0,0,0,0,0,0|2,0,0]=2 36 B13R1.718 CNC(=O)C\C=C\c1ccccc1 Amb25857434 [0,0,0,0,0,0|1,0,2]=3 37 B13R1.718 CNC(=O)NCCc1ccccc1 Amb2132768 [0,0,0,0,0,0|2,0,0]=2 38 B13R1.718 CNC(=O)NCCc1ccccn1 Amb22584238 [0,0,0,0,0,0|3,0,0]=3 39 B13R1.718 CNC(=O)NCCc1cccnc1 Amb22584252 [0,0,0,0,0,0|3,0,0]=3 40 B13R1.718 CNC(=O)NCCc1ccncc1 Amb22584239 [0,0,0,0,0,0|3,0,0]=3 41 B13R1.718 CNC(=O)NOCc1ccccc1 Amb27463347 [0,0,0,0,0,0|3,0,0]=3 42 B13R1.718 CNC(=O)NOCc1cccnc1 Amb28050944 [0,0,0,0,0,0|4,0,0]=4 43 B13R1.718 CNC(=O)O\N=C\c1ccccc1 Amb27827371 [0,0,0,0,0,0|3,0,1]=4 44 B13R1.718 CNC(=O)\C=C\Sc1ccccc1 Amb27443864 [0,0,0,0,0,0|2,0,2]=4 45 B13R1.718 CNC(=O)\C=N\Nc1ccccc1 Amb24444432 [0,0,0,0,0,0|3,0,1]=4 46 B13R1.718 CNC(=S)NCCc1cccnc1 Amb27162668 [0,0,0,0,0,0|3,1,0]=4 47 B13R1.718 CNC(=S)NCCc1ccncc1 Amb27475557 [0,0,0,0,0,0|3,1,0]=4 48 B13R1.718 CNC(=S)NNCc1ccccc1 Amb25826591 [0,0,0,0,0,0|3,1,0]=4 49 B13R1.718 CNC(=S)NOCc1ccccc1 Amb25805223 [0,0,0,0,0,0|3,1,0]=4 50 B13R1.718 CNC(C)CNCc1ccccc1 Amb18184455 [0,0,0,0,0,0|3,0,1]=4 51 B13R1.718 COC(=O)C#CCc1ccccn1 Amb27610103 [0,0,0,0,0,0|1,0,2]=3 52 B13R1.718 COC(=O)C=C=Cc1ccccc1 Amb27635444 [0,0,0,0,0,0|0,0,3]=3 53 B13R1.718 COC(=O)CCCc1ccccc1 Amb2720838 [0,0,0,0,0,0|0,0,0]=0 54 B13R1.718 COC(=O)CCCc1cccnc1 Amb24066737 [0,0,0,0,0,0|1,0,0]=1 55 B13R1.718 COC(=O)CCCc1ccncc1 Amb19888651 [0,0,0,0,0,0|1,0,0]=1 56 B13R1.718 COC(=O)CCNc1ccccc1 Amb1930724 [0,0,0,0,0,0|1,0,0]=1 57 B13R1.718 COC(=O)CCNc1ccccn1 Amb1243208 [0,0,0,0,0,0|2,0,0]=2 58 B13R1.718 COC(=O)CCNc1cccnc1 Amb18933308 [0,0,0,0,0,0|2,0,0]=2 59 B13R1.718 COC(=O)CCSc1ncccn1 Amb6760959 [0,0,0,0,0,0|3,0,0]=3 60 B13R1.718 COC(=O)CNCc1ccccc1 Amb21929289 [0,0,0,0,0,0|1,0,0]=1 61 B13R1.718 COC(=O)CNCc1ccccc1 Amb6687129 [0,0,0,0,0,0|1,0,0]=1 62 B13R1.718 COC(=O)CNCc1ccccn1 Amb6687148 [0,0,0,0,0,0|2,0,0]=2 63 B13R1.718 COC(=O)CNCc1cccnc1 Amb6686979 [0,0,0,0,0,0|2,0,0]=2 64 B13R1.718 COC(=O)CNCc1ccncc1 Amb6686985 [0,0,0,0,0,0|2,0,0]=2 65 B13R1.718 COC(=O)COCc1ccccc1 Amb7755418 [0,0,0,0,0,0|1,0,0]=1 66 B13R1.718 COC(=O)CSCc1ccccn1 Amb29848210 [0,0,0,0,0,0|2,0,0]=2 67 B13R1.718 COC(=O)NNCc1ccccc1 Amb27972025 [0,0,0,0,0,0|2,0,0]=2 68 B13R1.718 COC(=O)NOCc1ccccc1 Amb25359225 [0,0,0,0,0,0|2,0,0]=2 69 B13R1.718 COC(=O)N\C=C\c1cccnc1 Amb27751361 [0,0,0,0,0,0|2,0,2]=4 70 B13R1.718 COC(=O)N\N=C\c1ccccc1 Amb2411289 [0,0,0,0,0,0|2,0,1]=3 71 B13R1.718 COC(=O)N\N=C\c1ccncc1 Amb6558121 [0,0,0,0,0,0|3,0,1]=4 72 B13R1.718 COC(=O)\C=C\Cc1ccccc1 Amb30647398 [0,0,0,0,0,0|0,0,2]=2 73 B13R1.718 COC(=O)\C=C\Nc1ccccc1 Amb2386662 [0,0,0,0,0,0|1,0,2]=3 74 B13R1.718 COC(=O)\C=C\Sc1ccccc1 Amb33473610 [0,0,0,0,0,0|1,0,2]=3 75 B13R1.718 COC(=O)\C=N\Nc1ccccc1 Amb28131043 [0,0,0,0,0,0|2,0,1]=3 76 B13R1.718 COC(C)CNCc1ccccc1 Amb23570905 [0,0,0,0,0,0|2,0,1]=3 77 B13R1.718 CSC(=S)NCCc1ccccc1 Amb5716139 [0,0,0,0,0,0|1,2,0]=3 78 B13R1.718 C\C(=C\Cl)CNCc1ccccc1 Amb27402978 [0,0,0,0,0,0|4,0,0]=4 79 B13R1.718 C\C(=C\Cl)COCc1ccccc1 Amb27179200 [0,0,0,0,0,0|4,0,0]=4 80 B13R1.718 NCC(=O)CCCc1ccccc1 Amb33129308 [0,0,0,0,0,0|2,0,0]=2 81 B13R1.718 NCC(=O)NCCc1ccccc1 Amb13951619 [0,0,0,0,0,0|3,0,0]=3 82 B13R1.718 NCC(=O)NCCc1ccccc1 Amb5783058 [0,0,0,0,0,0|3,0,0]=3 83 B13R1.718 NCC(=O)NCCc1cccnc1 Amb5782418 [0,0,0,0,0,0|4,0,0]=4 84 B13R1.718 NCC(O)CCCc1ccccc1 Amb18564101 [0,0,0,0,0,0|2,0,2]=4 85 B13R1.718 NNC(=O)CCCc1ccccc1 Amb9206279 [0,0,0,0,0,0|2,0,0]=2 86 B13R1.718 NNC(=O)CCNc1ccccc1 Amb10607892 [0,0,0,0,0,0|3,0,0]=3 87 B13R1.718 NNC(=O)CCOc1ccccc1 Amb6242612 [0,0,0,0,0,0|3,0,0]=3 88 B13R1.718 NNC(=O)CNCc1ccccc1 Amb21967920 [0,0,0,0,0,0|3,0,0]=3 89 B13R1.718 NNC(=O)COCc1ccccc1 Amb8858497 [0,0,0,0,0,0|3,0,0]=3 90 B13R1.718 NNC(=O)CSCc1ccccc1 Amb6550464 [0,0,0,0,0,0|3,0,0]=3 91 B13R1.718 NNC(=O)C\C=C\c1ccccc1 Amb24540797 [0,0,0,0,0,0|2,0,2]=4 92 B13R1.718 NNC(=O)NCCc1ccccn1 Amb8853994 [0,0,0,0,0,0|4,0,0]=4 93 B13R1.718 NNC(=O)NCCc1cccnc1 Amb18181087 [0,0,0,0,0,0|4,0,0]=4 94 B13R1.718 NNC(=S)NCCc1ccccc1 Amb6419503 [0,0,0,0,0,0|3,1,0]=4 95 B13R1.718 N\C(=N/O)NCCc1ccccc1 Amb18809201 [0,0,0,0,0,0|4,0,0]=4 96 B13R1.718 N\C(CCCc1ccccc1)=N/O Amb9714178 [0,0,0,0,0,0|3,0,0]=3 97 B13R1.718 N\C(CCCc1ccccc1)=N\O Amb22551827 [0,0,0,0,0,0|3,0,0]=3 98 B13R1.718 N\C(CCNc1ccccc1)=N/O Amb6334238 [0,0,0,0,0,0|4,0,0]=4 99 B13R1.718 N\C(CCOc1ccccc1)=N/O Amb1116542 [0,0,0,0,0,0|4,0,0]=4 100 B13R1.718 N\C(CNCc1ccccc1)=N\O Amb27444065 [0,0,0,0,0,0|4,0,0]=4 101 B13R1.718 N\C(COCc1ccccc1)=N/O Amb6261094 [0,0,0,0,0,0|4,0,0]=4 102 B13R1.718 N\N=C(\N)COCc1ccccc1 Amb27965241 [0,0,0,0,0,0|4,0,0]=4 103 B13R1.718 O=C(CBr)NCCc1ccccc1 Amb2089064 [0,0,0,0,0,0|3,0,0]=3 104 B13R1.718 O=C(CBr)NCCc1ccccn1 Amb17323242 [0,0,0,0,0,0|4,0,0]=4 105 B13R1.718 O=C(CCCc1ccccc1)NO Amb9206288 [0,0,0,0,0,0|2,0,0]=2 106 B13R1.718 O=C(CCCc1ccccc1)O[Na] Amb8393622 [0,0,0,0,0,0|1,0,0]=1 107 B13R1.718 O=C(CCOc1ccccc1)NO Amb6279077 [0,0,0,0,0,0|3,0,0]=3 108 B13R1.718 O=C(CCl)CCCc1ccccc1 Amb22395307 [0,0,0,0,0,0|2,0,0]=2 109 B13R1.718 O=C(CCl)NCCc1ccccc1 Amb6315505 [0,0,0,0,0,0|3,0,0]=3 110 B13R1.718 O=C(CCl)NCCc1ccccn1 Amb6259596 [0,0,0,0,0,0|4,0,0]=4 111 B13R1.718 O=C(CCl)NCCc1cccnc1 Amb19056184 [0,0,0,0,0,0|4,0,0]=4 112 B13R1.718 O=C(CCl)NCCc1ccncc1 Amb17333280 [0,0,0,0,0,0|4,0,0]=4 113 B13R1.718 O=C(CCl)NOCc1ccccc1 Amb9171002 [0,0,0,0,0,0|4,0,0]=4 114 B13R1.718 O=C(CI)NCCc1ccccc1 Amb32455597 [0,0,0,0,0,0|3,0,0]=3 115 B13R1.718 O=C(CNCc1ccccc1)NO Amb27647939 [0,0,0,0,0,0|3,0,0]=3 116 B13R1.718 O=C(CO)CCCc1ccccc1 Amb33129305 [0,0,0,0,0,0|2,0,0]=2 117 B13R1.718 O=C(CO)NCCc1ccccc1 Amb1111400 [0,0,0,0,0,0|3,0,0]=3 118 B13R1.718 OCC(O)CCCc1ccccc1 Amb33129313 [0,0,0,0,0,0|2,0,2]=4 119 B12R1.8 BrCCCCCc1ccccc1 Amb2685449 [1,0,0,0,0,0|2,0,1]=4 120 B12R1.8 C#CCCCCc1ccccc1 Amb18116407 [1,0,0,0,0,0|1,0,2]=4 121 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [1,0,0,0,0,0|1,0,2]=4 122 B12R1.8 CC#CCCCc1ccccc1 Amb4035132 [1,0,0,0,0,0|1,0,1]=3 123 B12R1.8 CC#CCCOc1ccccc1 Amb28319686 [1,0,0,0,0,0|2,0,1]=4 124 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [1,0,0,0,0,0|2,0,1]=4 125 B12R1.8 CC#CCNCc1ccccc1 Amb4084953 [1,0,0,0,0,0|2,0,1]=4 126 B12R1.8 CCCCCCc1ccccc1 Amb6613187 [1,0,0,0,0,0|1,0,1]=3 127 B12R1.8 CCCCCCc1ccccn1 Amb6357996 [1,0,0,0,0,0|2,0,1]=4 128 B12R1.8 CCCCCCc1cccnc1 Amb10807465 [1,0,0,0,0,0|2,0,1]=4 129 B12R1.8 CCCCCCc1ccncc1 Amb22235257 [1,0,0,0,0,0|2,0,1]=4 130 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [1,0,0,0,0,0|2,0,1]=4 131 B12R1.8 CCCCNCc1ccccc1 Amb2684625 [1,0,0,0,0,0|2,0,1]=4 132 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [1,0,0,0,0,0|2,0,1]=4 133 B12R1.8 CCCNCCc1ccccc1 Amb4358610 [1,0,0,0,0,0|2,0,1]=4 134 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [1,0,0,0,0,0|2,0,0]=3 135 B12R1.8 CCNCCCc1ccccc1 Amb6247947 [1,0,0,0,0,0|2,0,0]=3 136 B12R1.8 CCNCCOc1ccccc1 Amb2099717 [1,0,0,0,0,0|3,0,0]=4 137 B12R1.8 CCNCCOc1ccccc1 Amb6374462 [1,0,0,0,0,0|3,0,0]=4 138 B12R1.8 CCNCCSc1ccccc1 Amb10608724 [1,0,0,0,0,0|3,0,0]=4 139 B12R1.8 CCOCOCc1ccccc1 Amb27830530 [1,0,0,0,0,0|3,0,0]=4 140 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [1,0,0,0,0,0|3,0,0]=4 141 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [1,0,0,0,0,0|1,0,1]=3 142 B12R1.8 CNCCCCc1ccccc1 Amb8841760 [1,0,0,0,0,0|1,0,1]=3 143 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [1,0,0,0,0,0|2,0,1]=4 144 B12R1.8 CNCCCOc1ccccc1 Amb30982582 [1,0,0,0,0,0|2,0,1]=4 145 B12R1.8 CNCCCOc1ccccc1 Amb6893131 [1,0,0,0,0,0|2,0,1]=4 146 B12R1.8 CNCCCSc1ccccc1 Amb10608730 [1,0,0,0,0,0|2,0,1]=4 147 B12R1.8 CNCCCSc1ccccc1 Amb22588097 [1,0,0,0,0,0|2,0,1]=4 148 B12R1.8 CNCCNCc1ccccc1 Amb9200691 [1,0,0,0,0,0|2,0,1]=4 149 B12R1.8 CNCCOCc1ccccc1 Amb20668782 [1,0,0,0,0,0|2,0,1]=4 150 B12R1.8 CNCCOCc1ccccc1 Amb6374318 [1,0,0,0,0,0|2,0,1]=4 151 B12R1.8 CNCCSCc1ccccc1 Amb18809641 [1,0,0,0,0,0|2,0,1]=4 152 B12R1.8 COCCCNc1ccccc1 Amb17232551 [1,0,0,0,0,0|1,0,1]=3 153 B12R1.8 COCCNCc1ccccc1 Amb33387674 [1,0,0,0,0,0|1,0,1]=3 154 B12R1.8 COCCNCc1ccccc1 Amb6410960 [1,0,0,0,0,0|1,0,1]=3 155 B12R1.8 COCCNCc1ccccn1 Amb1663439 [1,0,0,0,0,0|2,0,1]=4 156 B12R1.8 COCCNCc1ccccn1 Amb17622505 [1,0,0,0,0,0|2,0,1]=4 157 B12R1.8 COCCNCc1cccnc1 Amb2592096 [1,0,0,0,0,0|2,0,1]=4 158 B12R1.8 COCCNCc1cccnc1 Amb6865386 [1,0,0,0,0,0|2,0,1]=4 159 B12R1.8 COCCNCc1ccncc1 Amb2592093 [1,0,0,0,0,0|2,0,1]=4 160 B12R1.8 COCCNCc1ccncc1 Amb6865384 [1,0,0,0,0,0|2,0,1]=4 161 B12R1.8 COCCOCc1ccccc1 Amb27467682 [1,0,0,0,0,0|1,0,1]=3 162 B12R1.8 CONCCCc1ccccc1 Amb32411014 [1,0,0,0,0,0|1,0,0]=2 163 B12R1.8 C\C=C\CCNc1ccccc1 Amb28119164 [1,0,0,0,0,0|2,0,0]=3 164 B12R1.8 C\C=C\CCNc1ccncc1 Amb27831175 [1,0,0,0,0,0|3,0,0]=4 165 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [1,0,0,0,0,0|2,0,1]=4 166 B12R1.8 ICCCCCc1ccccc1 Amb32411025 [1,0,0,0,0,0|2,0,1]=4 167 B12R1.8 N#CCCCCc1ccccc1 Amb8392139 [1,0,0,0,0,0|2,0,1]=4 168 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [1,0,0,0,0,0|2,0,1]=4 169 B12R1.8 NC\C=C\CCc1ccccc1 Amb32951855 [1,0,0,0,0,0|2,0,1]=4 170 B12R1.8 NOCCOCc1ccccc1 Amb26593148 [1,0,0,0,0,0|2,0,1]=4 171 B12R1.8 O=C=NCCCc1ccccc1 Amb5750728 [1,0,0,0,0,0|3,0,0]=4 172 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [1,0,0,0,0,0|2,0,1]=4 173 B12R1.8 O=C\C=C\CCc1ccccc1 Amb32954855 [1,0,0,0,0,0|2,0,1]=4 174 B12R1.8 OC\C=C\CCc1ccccc1 Amb33082995 [1,0,0,0,0,0|2,0,1]=4 175 B12R1.8 ONCCCCc1ccccc1 Amb32679349 [1,0,0,0,0,0|2,0,1]=4 176 B12R1.8 ONCCCCc1ccccc1 Amb32679459 [1,0,0,0,0,0|2,0,1]=4 177 B12R1.8 O\C=C/NCCc1ccccc1 Amb27975397 [1,0,0,0,0,0|3,0,0]=4 178 B12R1.8 S=C=NCCCc1ccccc1 Amb5750753 [1,0,0,0,0,0|3,0,0]=4 179 B12R1.8 [C-]#[N+]CCCCc1ccccc1 Amb2690273 [1,0,0,0,0,0|1,0,2]=4 180 B12R1.8 [N-]=[N+]=NCCCc1ccccc1 Amb10572439 [1,0,0,0,0,0|3,0,0]=4 181 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [1,0,0,0,0,0|2,0,1]=4 182 B12R1.252 C=C(C)CCNc1ccncc1 Amb28322222 [1,0,0,0,0,0|3,0,0]=4 183 B12R1.252 C=C(C)CNCc1ccccc1 Amb10608684 [1,0,0,0,0,0|2,0,0]=3 184 B12R1.252 C=C(C)CNCc1ccccc1 Amb17622487 [1,0,0,0,0,0|2,0,0]=3 185 B12R1.252 C=C(C)CNCc1ccccn1 Amb17308945 [1,0,0,0,0,0|3,0,0]=4 186 B12R1.252 C=C(C)CNCc1cccnc1 Amb18800663 [1,0,0,0,0,0|3,0,0]=4 187 B12R1.252 C=C(C)CNCc1ccncc1 Amb17308927 [1,0,0,0,0,0|3,0,0]=4 188 B12R1.252 C=C(C)COCc1ccccc1 Amb28062621 [1,0,0,0,0,0|2,0,0]=3 189 B12R1.252 CC(=O)C#CCc1ccccc1 Amb27177980 [1,0,0,0,0,0|0,0,2]=3 190 B12R1.252 CC(=O)CC#Cc1ccccc1 Amb28122481 [1,0,0,0,0,0|0,0,2]=3 191 B12R1.252 CC(=O)CCCc1ccccc1 Amb4358586 [1,0,0,0,0,0|0,0,0]=1 192 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [1,0,0,0,0,0|1,0,0]=2 193 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [1,0,0,0,0,0|1,0,0]=2 194 B12R1.252 CC(=O)CCNc1ccccc1 Amb26422328 [1,0,0,0,0,0|1,0,0]=2 195 B12R1.252 CC(=O)CCOc1ccccc1 Amb7777351 [1,0,0,0,0,0|1,0,0]=2 196 B12R1.252 CC(=O)CCSc1ccccc1 Amb4020770 [1,0,0,0,0,0|1,0,0]=2 197 B12R1.252 CC(=O)COCc1ccccc1 Amb3433615 [1,0,0,0,0,0|1,0,0]=2 198 B12R1.252 CC(=O)CONc1ccccc1 Amb28243855 [1,0,0,0,0,0|2,0,0]=3 199 B12R1.252 CC(=O)CSCc1ccccc1 Amb4018341 [1,0,0,0,0,0|1,0,0]=2 200 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [1,0,0,0,0,0|0,0,2]=3 201 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [1,0,0,0,0,0|1,0,1]=3 202 B12R1.252 CC(=O)NCCc1ccccc1 Amb2781514 [1,0,0,0,0,0|1,0,0]=2 203 B12R1.252 CC(=O)NCCc1cnccn1 Amb25277212 [1,0,0,0,0,0|3,0,0]=4 204 B12R1.252 CC(=O)NCSc1ccccc1 Amb27797274 [1,0,0,0,0,0|2,0,0]=3 205 B12R1.252 CC(=O)NNCc1ccccn1 Amb28366245 [1,0,0,0,0,0|3,0,0]=4 206 B12R1.252 CC(=O)N\N=C\c1ccccc1 Amb2732164 [1,0,0,0,0,0|2,0,1]=4 207 B12R1.252 CC(=O)OCCc1ccccc1 Amb6357159 [1,0,0,0,0,0|1,0,0]=2 208 B12R1.252 CC(=O)OCCc1ccccn1 Amb8391177 [1,0,0,0,0,0|2,0,0]=3 209 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [1,0,0,0,0,0|1,0,2]=4 210 B12R1.252 CC(=O)\C=C/Nc1ccccc1 Amb28461253 [1,0,0,0,0,0|1,0,2]=4 211 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb32954414 [1,0,0,0,0,0|0,0,2]=3 212 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [1,0,0,0,0,0|1,0,2]=4 213 B12R1.252 CC(=O)\C=C\Oc1ccccc1 Amb26528572 [1,0,0,0,0,0|1,0,2]=4 214 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb35789855 [1,0,0,0,0,0|1,0,2]=4 215 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [1,0,0,0,0,0|2,0,1]=4 216 B12R1.252 CC(=O)\[C+]=N\[N-]c1ccccc1 Amb27614630 [1,0,0,0,0,0|2,0,1]=4 217 B12R1.252 CC(=S)NCCc1ccccc1 Amb27412033 [1,0,0,0,0,0|1,1,0]=3 218 B12R1.252 CC(Br)CCCc1ccccc1 Amb32951525 [1,0,0,0,0,0|1,0,1]=3 219 B12R1.252 CC(Br)CCSc1ccccc1 Amb20623511 [1,0,0,0,0,0|2,0,1]=4 220 B12R1.252 CC(Br)COCc1ccccc1 Amb27481240 [1,0,0,0,0,0|2,0,1]=4 221 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [1,0,0,0,0,0|1,0,1]=3 222 B12R1.252 CC(C)=CCCc1cccnc1 Amb35582905 [1,0,0,0,0,0|2,0,1]=4 223 B12R1.252 CC(C)=CCNc1ccccc1 Amb27638094 [1,0,0,0,0,0|2,0,1]=4 224 B12R1.252 CC(C)=CCSc1ccccc1 Amb8394723 [1,0,0,0,0,0|2,0,1]=4 225 B12R1.252 CC(C)=NOCc1ccccc1 Amb27827763 [1,0,0,0,0,0|3,0,0]=4 226 B12R1.252 CC(C)CCCc1ccncc1 Amb2613010 [1,0,0,0,0,0|2,0,1]=4 227 B12R1.252 CC(C)CCNc1ccccc1 Amb4016589 [1,0,0,0,0,0|2,0,1]=4 228 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [1,0,0,0,0,0|2,0,1]=4 229 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [1,0,0,0,0,0|2,0,1]=4 230 B12R1.252 CC(C)CNCc1ccccc1 Amb6687359 [1,0,0,0,0,0|2,0,1]=4 231 B12R1.252 CC(C)NCCc1ccccc1 Amb2111109 [1,0,0,0,0,0|2,0,1]=4 232 B12R1.252 CC(C)NCCc1ccccc1 Amb6246148 [1,0,0,0,0,0|2,0,1]=4 233 B12R1.252 CC(Cl)CNCc1ccccc1 Amb27656927 [1,0,0,0,0,0|2,0,1]=4 234 B12R1.252 CC(F)CCCc1ccccc1 Amb22229780 [1,0,0,0,0,0|1,0,1]=3 235 B12R1.252 CC(N)CCCc1ccccc1 Amb2721865 [1,0,0,0,0,0|1,0,1]=3 236 B12R1.252 CC(N)CCCc1cccnc1 Amb17232504 [1,0,0,0,0,0|2,0,1]=4 237 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [1,0,0,0,0,0|2,0,1]=4 238 B12R1.252 CC(N)CCOc1ccccc1 Amb7772215 [1,0,0,0,0,0|2,0,1]=4 239 B12R1.252 CC(N)CCSc1ccccc1 Amb13881552 [1,0,0,0,0,0|2,0,1]=4 240 B12R1.252 CC(N)COCc1ccccc1 Amb1124568 [1,0,0,0,0,0|2,0,1]=4 241 B12R1.252 CC(N)CSCc1ccccc1 Amb18648554 [1,0,0,0,0,0|2,0,1]=4 242 B12R1.252 CC(O)CCCc1ccccc1 Amb17138575 [1,0,0,0,0,0|0,0,2]=3 243 B12R1.252 CC(O)CCCc1cccnc1 Amb22292250 [1,0,0,0,0,0|1,0,2]=4 244 B12R1.252 CC(O)CCOc1ccccc1 Amb6298179 [1,0,0,0,0,0|1,0,2]=4 245 B12R1.252 CC(O)CNCc1ccccc1 Amb837676 [1,0,0,0,0,0|1,0,2]=4 246 B12R1.252 CC(O)COCc1ccccc1 Amb4020574 [1,0,0,0,0,0|1,0,2]=4 247 B12R1.252 CC(S)COCc1ccccc1 Amb32788346 [1,0,0,0,0,0|1,1,1]=4 248 B12R1.252 CN(C)CCCc1ccccc1 Amb1085936 [1,0,0,0,0,0|2,0,0]=3 249 B12R1.252 CN(C)CCNc1ccccc1 Amb6477740 [1,0,0,0,0,0|3,0,0]=4 250 B12R1.252 CN(C)CCOc1ccccc1 Amb2876295 [1,0,0,0,0,0|3,0,0]=4 251 B12R1.252 CN(N)CCOc1ccccc1 Amb18563757 [1,0,0,0,0,0|3,0,0]=4 252 B12R1.252 CN(O)CCCc1ccccc1 Amb32951844 [1,0,0,0,0,0|1,0,1]=3 253 B12R1.252 CS(=O)\N=C\Cc1ccccc1 Amb35681654 [1,0,0,0,0,0|2,0,1]=4 254 B12R1.252 C[C@@H](N)CCCc1ccccc1 Amb33081452 [1,0,0,0,0,0|1,0,1]=3 255 B12R1.252 C[C@@H](N)CCCc1cccnc1 Amb22388607 [1,0,0,0,0,0|2,0,1]=4 256 B12R1.252 C[C@@H](N)CCOc1ccccc1 Amb33081226 [1,0,0,0,0,0|2,0,1]=4 257 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [1,0,0,0,0,0|2,0,1]=4 258 B12R1.252 C[C@@H](O)CCCc1ccccc1 Amb33082320 [1,0,0,0,0,0|0,0,2]=3 259 B12R1.252 C[C@@H](O)CCOc1ccccc1 Amb32951805 [1,0,0,0,0,0|1,0,2]=4 260 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [1,0,0,0,0,0|1,0,2]=4 261 B12R1.252 C[C@H](N)CCCc1ccccc1 Amb32954284 [1,0,0,0,0,0|1,0,1]=3 262 B12R1.252 C[C@H](N)CCOc1ccccc1 Amb32954086 [1,0,0,0,0,0|2,0,1]=4 263 B12R1.252 C[C@H](N)COCc1ccccc1 Amb17061656 [1,0,0,0,0,0|2,0,1]=4 264 B12R1.252 C[C@H](O)CCCc1ccccc1 Amb32954841 [1,0,0,0,0,0|0,0,2]=3 265 B12R1.252 C[C@H](O)CCOc1ccccc1 Amb32952875 [1,0,0,0,0,0|1,0,2]=4 266 B12R1.252 C[C@H](O)CNCc1ccccc1 Amb27862492 [1,0,0,0,0,0|1,0,2]=4 267 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [1,0,0,0,0,0|1,0,2]=4 268 B12R1.252 C\C(Cl)=C\CNc1ccccc1 Amb4303986 [1,0,0,0,0,0|2,0,1]=4 269 B12R1.252 C\C(N)=N\OCc1ccccc1 Amb27760408 [1,0,0,0,0,0|3,0,0]=4 270 B12R1.252 ClC(Cl)=CCCc1ccccc1 Amb27443084 [1,0,0,0,0,0|2,0,1]=4 271 B12R1.252 N=C(N)CCCc1ccccc1 Amb6276737 [1,0,0,0,0,0|2,0,0]=3 272 B12R1.252 N=C(N)CCCc1ccccn1 Amb21618753 [1,0,0,0,0,0|3,0,0]=4 273 B12R1.252 N=C(N)CCCc1cccnc1 Amb24062322 [1,0,0,0,0,0|3,0,0]=4 274 B12R1.252 N=C(N)CCOc1ccccc1 Amb6279642 [1,0,0,0,0,0|3,0,0]=4 275 B12R1.252 N=C(N)COCc1ccccc1 Amb6266963 [1,0,0,0,0,0|3,0,0]=4 276 B12R1.252 N=C(N)COCc1ccccc1 Amb8630424 [1,0,0,0,0,0|3,0,0]=4 277 B12R1.252 N=C(N)CSCc1ccccc1 Amb28555674 [1,0,0,0,0,0|3,0,0]=4 278 B12R1.252 N=C(N)CSCc1ccccc1 Amb6678181 [1,0,0,0,0,0|3,0,0]=4 279 B12R1.252 N=C(N)NCCc1ccccc1 Amb22736089 [1,0,0,0,0,0|3,0,0]=4 280 B12R1.252 N=C(N)NCCc1ccccc1 Amb22736599 [1,0,0,0,0,0|3,0,0]=4 281 B12R1.252 N=C(N)NCCc1ccccc1 Amb28974714 [1,0,0,0,0,0|3,0,0]=4 282 B12R1.252 N=C(N)NCCc1ccccc1 Amb6761287 [1,0,0,0,0,0|3,0,0]=4 283 B12R1.252 N=C(N)NCCc1ccccc1 Amb838720 [1,0,0,0,0,0|3,0,0]=4 284 B12R1.252 N=C(N)SCCc1ccccc1 Amb20675983 [1,0,0,0,0,0|3,0,0]=4 285 B12R1.252 NC(=O)CC#Cc1ccccc1 Amb28256571 [1,0,0,0,0,0|1,0,2]=4 286 B12R1.252 NC(=O)CCCc1ccccc1 Amb3886649 [1,0,0,0,0,0|1,0,0]=2 287 B12R1.252 NC(=O)CCNc1ccccc1 Amb453169 [1,0,0,0,0,0|2,0,0]=3 288 B12R1.252 NC(=O)CCOc1ccccc1 Amb8997689 [1,0,0,0,0,0|2,0,0]=3 289 B12R1.252 NC(=O)CCSc1ccccc1 Amb3836115 [1,0,0,0,0,0|2,0,0]=3 290 B12R1.252 NC(=O)CNCc1ccccc1 Amb2696395 [1,0,0,0,0,0|2,0,0]=3 291 B12R1.252 NC(=O)CNCc1ccccn1 Amb6661065 [1,0,0,0,0,0|3,0,0]=4 292 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [1,0,0,0,0,0|3,0,0]=4 293 B12R1.252 NC(=O)CNCc1cccnc1 Amb33545533 [1,0,0,0,0,0|3,0,0]=4 294 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [1,0,0,0,0,0|3,0,0]=4 295 B12R1.252 NC(=O)COCc1ccccc1 Amb8858432 [1,0,0,0,0,0|2,0,0]=3 296 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [1,0,0,0,0,0|2,0,0]=3 297 B12R1.252 NC(=O)NCCc1ccccn1 Amb6274566 [1,0,0,0,0,0|3,0,0]=4 298 B12R1.252 NC(=O)NCCc1cccnc1 Amb19515015 [1,0,0,0,0,0|3,0,0]=4 299 B12R1.252 NC(=O)NCSc1ccccc1 Amb28200898 [1,0,0,0,0,0|3,0,0]=4 300 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [1,0,0,0,0,0|3,0,0]=4 301 B12R1.252 NC(=S)CCCc1ccccc1 Amb6244938 [1,0,0,0,0,0|1,1,0]=3 302 B12R1.252 NC(=S)CCOc1ccccc1 Amb5542247 [1,0,0,0,0,0|2,1,0]=4 303 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [1,0,0,0,0,0|2,1,0]=4 304 B12R1.252 NC(=S)COCc1ccccc1 Amb6276568 [1,0,0,0,0,0|2,1,0]=4 305 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [1,0,0,0,0,0|2,1,0]=4 306 B12R1.252 O=C(Cl)CCCc1ccccc1 Amb2792925 [1,0,0,0,0,0|1,0,0]=2 307 B12R1.252 O=C(Cl)CCOc1ccccc1 Amb33528394 [1,0,0,0,0,0|2,0,0]=3 308 B12R1.252 O=C(Cl)CCSc1ccccc1 Amb10064363 [1,0,0,0,0,0|2,0,0]=3 309 B12R1.252 O=C(Cl)COCc1ccccc1 Amb3939158 [1,0,0,0,0,0|2,0,0]=3 310 B12R1.252 O=C(Cl)CSCc1ccccc1 Amb10880013 [1,0,0,0,0,0|2,0,0]=3 311 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [1,0,0,0,0,0|1,0,2]=4 312 B12R1.252 O=C(Cl)NCCc1ccccn1 Amb35637082 [1,0,0,0,0,0|3,0,0]=4 313 B12R1.252 O=C(Cl)NCCc1cccnc1 Amb35625524 [1,0,0,0,0,0|3,0,0]=4 314 B12R1.252 O=C(Cl)NCCc1ccncc1 Amb35625591 [1,0,0,0,0,0|3,0,0]=4 315 B12R1.252 O=C(Cl)OCCc1ccccc1 Amb32661047 [1,0,0,0,0,0|2,0,0]=3 316 B12R1.252 O=C(Cl)OCCc1ccccn1 Amb33297001 [1,0,0,0,0,0|3,0,0]=4 317 B12R1.252 O=C(Cl)OCCc1cccnc1 Amb33297282 [1,0,0,0,0,0|3,0,0]=4 318 B12R1.252 O=C(O)C#CSc1ccccc1 Amb27645390 [1,0,0,0,0,0|1,0,2]=4 319 B12R1.252 O=C(O)C=C=Cc1ccccc1 Amb25102534 [1,0,0,0,0,0|0,0,3]=4 320 B12R1.252 O=C(O)CC#Cc1ccccc1 Amb18296382 [1,0,0,0,0,0|0,0,2]=3 321 B12R1.252 O=C(O)CC#Cc1ccccn1 Amb27222218 [1,0,0,0,0,0|1,0,2]=4 322 B12R1.252 O=C(O)CC#Cc1cccnc1 Amb25159668 [1,0,0,0,0,0|1,0,2]=4 323 B12R1.252 O=C(O)CC#Cc1ccncc1 Amb24423393 [1,0,0,0,0,0|1,0,2]=4 324 B12R1.252 O=C(O)CCCC1=CCC=CC1 Amb6295892 [1,0,0,0,0,0|0,0,2]=3 325 B12R1.252 O=C(O)CCCc1ccccc1 Amb2388283 [1,0,0,0,0,0|0,0,0]=1 326 B12R1.252 O=C(O)CCCc1ccccn1 Amb1099328 [1,0,0,0,0,0|1,0,0]=2 327 B12R1.252 O=C(O)CCCc1ccccn1 Amb19356883 [1,0,0,0,0,0|1,0,0]=2 328 B12R1.252 O=C(O)CCCc1cccnc1 Amb17232526 [1,0,0,0,0,0|1,0,0]=2 329 B12R1.252 O=C(O)CCCc1cccnc1 Amb33529414 [1,0,0,0,0,0|1,0,0]=2 330 B12R1.252 O=C(O)CCCc1cccnc1 Amb33541549 [1,0,0,0,0,0|1,0,0]=2 331 B12R1.252 O=C(O)CCCc1ccncc1 Amb1099336 [1,0,0,0,0,0|1,0,0]=2 332 B12R1.252 O=C(O)CCCc1ccncc1 Amb19929548 [1,0,0,0,0,0|1,0,0]=2 333 B12R1.252 O=C(O)CCCc1ccncn1 Amb33172094 [1,0,0,0,0,0|2,0,0]=3 334 B12R1.252 O=C(O)CCCc1cncnc1 Amb18827885 [1,0,0,0,0,0|2,0,0]=3 335 B12R1.252 O=C(O)CCCc1ncccn1 Amb18862661 [1,0,0,0,0,0|2,0,0]=3 336 B12R1.252 O=C(O)CCCc1nccnn1 Amb18862703 [1,0,0,0,0,0|3,0,0]=4 337 B12R1.252 O=C(O)CCCc1ncncn1 Amb18862704 [1,0,0,0,0,0|3,0,0]=4 338 B12R1.252 O=C(O)CCNc1ccccc1 Amb1207377 [1,0,0,0,0,0|1,0,0]=2 339 B12R1.252 O=C(O)CCNc1ccccn1 Amb10609119 [1,0,0,0,0,0|2,0,0]=3 340 B12R1.252 O=C(O)CCNc1ccccn1 Amb6258091 [1,0,0,0,0,0|2,0,0]=3 341 B12R1.252 O=C(O)CCNc1cccnc1 Amb18269696 [1,0,0,0,0,0|2,0,0]=3 342 B12R1.252 O=C(O)CCNc1ccncc1 Amb33456130 [1,0,0,0,0,0|2,0,0]=3 343 B12R1.252 O=C(O)CCNc1ccncc1 Amb6280380 [1,0,0,0,0,0|2,0,0]=3 344 B12R1.252 O=C(O)CCNc1ccncn1 Amb19011486 [1,0,0,0,0,0|3,0,0]=4 345 B12R1.252 O=C(O)CCNc1cncnc1 Amb18933238 [1,0,0,0,0,0|3,0,0]=4 346 B12R1.252 O=C(O)CCNc1ncccn1 Amb33526612 [1,0,0,0,0,0|3,0,0]=4 347 B12R1.252 O=C(O)CCOc1ccccc1 Amb1206804 [1,0,0,0,0,0|1,0,0]=2 348 B12R1.252 O=C(O)CCOc1cccnc1 Amb33527345 [1,0,0,0,0,0|2,0,0]=3 349 B12R1.252 O=C(O)CCSc1ccccc1 Amb1036581 [1,0,0,0,0,0|1,0,0]=2 350 B12R1.252 O=C(O)CCSc1ccccn1 Amb1133894 [1,0,0,0,0,0|2,0,0]=3 351 B12R1.252 O=C(O)CCSc1ncccn1 Amb6258426 [1,0,0,0,0,0|3,0,0]=4 352 B12R1.252 O=C(O)CNCc1ccccc1 Amb2720113 [1,0,0,0,0,0|1,0,0]=2 353 B12R1.252 O=C(O)CNCc1ccccc1 Amb6357824 [1,0,0,0,0,0|1,0,0]=2 354 B12R1.252 O=C(O)CNCc1ccccn1 Amb1111426 [1,0,0,0,0,0|2,0,0]=3 355 B12R1.252 O=C(O)CNCc1ccccn1 Amb13951702 [1,0,0,0,0,0|2,0,0]=3 356 B12R1.252 O=C(O)CNCc1cccnc1 Amb1111197 [1,0,0,0,0,0|2,0,0]=3 357 B12R1.252 O=C(O)CNCc1cccnc1 Amb6893093 [1,0,0,0,0,0|2,0,0]=3 358 B12R1.252 O=C(O)CNCc1ccncc1 Amb1110916 [1,0,0,0,0,0|2,0,0]=3 359 B12R1.252 O=C(O)CNCc1ccncc1 Amb32729434 [1,0,0,0,0,0|2,0,0]=3 360 B12R1.252 O=C(O)CNCc1cnccn1 Amb19030033 [1,0,0,0,0,0|3,0,0]=4 361 B12R1.252 O=C(O)COCc1ccccc1 Amb3939856 [1,0,0,0,0,0|1,0,0]=2 362 B12R1.252 O=C(O)COCc1ccccn1 Amb32680346 [1,0,0,0,0,0|2,0,0]=3 363 B12R1.252 O=C(O)COCc1ccccn1 Amb33548165 [1,0,0,0,0,0|2,0,0]=3 364 B12R1.252 O=C(O)COCc1cccnc1 Amb28653073 [1,0,0,0,0,0|2,0,0]=3 365 B12R1.252 O=C(O)COCc1ccncc1 Amb13883046 [1,0,0,0,0,0|2,0,0]=3 366 B12R1.252 O=C(O)COCc1ccncc1 Amb8010071 [1,0,0,0,0,0|2,0,0]=3 367 B12R1.252 O=C(O)CSCc1ccccc1 Amb6357378 [1,0,0,0,0,0|1,0,0]=2 368 B12R1.252 O=C(O)CSCc1ccccn1 Amb1126746 [1,0,0,0,0,0|2,0,0]=3 369 B12R1.252 O=C(O)CSCc1cccnc1 Amb1129471 [1,0,0,0,0,0|2,0,0]=3 370 B12R1.252 O=C(O)CSCc1ccncc1 Amb1134758 [1,0,0,0,0,0|2,0,0]=3 371 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb24113880 [1,0,0,0,0,0|1,0,0]=2 372 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb6366026 [1,0,0,0,0,0|1,0,0]=2 373 B12R1.252 O=C(O)C\C=C\c1ccccc1 Amb6280352 [1,0,0,0,0,0|0,0,2]=3 374 B12R1.252 O=C(O)C\C=C\c1ccccn1 Amb25073201 [1,0,0,0,0,0|1,0,2]=4 375 B12R1.252 O=C(O)C\C=C\c1cccnc1 Amb26478515 [1,0,0,0,0,0|1,0,2]=4 376 B12R1.252 O=C(O)C\C=C\c1ccncc1 Amb24571194 [1,0,0,0,0,0|1,0,2]=4 377 B12R1.252 O=C(O)C\N=C/c1cccnc1 Amb27232669 [1,0,0,0,0,0|2,0,1]=4 378 B12R1.252 O=C(O)C\N=C\c1cccnc1 Amb28077098 [1,0,0,0,0,0|2,0,1]=4 379 B12R1.252 O=C(O)C\N=C\c1ccncc1 Amb27455443 [1,0,0,0,0,0|2,0,1]=4 380 B12R1.252 O=C(O)C\N=N\c1ccccc1 Amb27863405 [1,0,0,0,0,0|2,0,0]=3 381 B12R1.252 O=C(O)\C=C/Sc1ccccc1 Amb3940780 [1,0,0,0,0,0|1,0,2]=4 382 B12R1.252 O=C(O)\C=C\Cc1ccccc1 Amb8392409 [1,0,0,0,0,0|0,0,2]=3 383 B12R1.252 O=C(O)\C=C\Cc1cccnc1 Amb25849857 [1,0,0,0,0,0|1,0,2]=4 384 B12R1.252 O=C(O)\C=C\Cc1ccncc1 Amb26841073 [1,0,0,0,0,0|1,0,2]=4 385 B12R1.252 O=C(O)\C=C\Sc1ccccc1 Amb1661597 [1,0,0,0,0,0|1,0,2]=4 386 B12R1.252 O=C(O)\C=N/Nc1ccccc1 Amb24068313 [1,0,0,0,0,0|2,0,1]=4 387 B12R1.252 O=C(O)\C=N\Nc1ccccc1 Amb17594064 [1,0,0,0,0,0|2,0,1]=4 388 B12R1.252 O=C([O-])CCCc1ccccc1 Amb15690987 [1,0,0,0,0,0|0,0,1]=2 389 B12R1.252 O=C([O-])CC[NH2+]c1ccccc1 Amb22499683 [1,0,0,0,0,0|1,0,1]=3 390 B12R1.252 O=S([O-])CCCc1ccccc1 Amb32755679 [1,0,0,0,0,0|1,0,1]=3 391 B12R1.252 O=S([O-])CCOc1ccccc1 Amb32755206 [1,0,0,0,0,0|2,0,1]=4 392 B12R1.252 O=[PH](O)CNCc1ccccc1 Amb28383469 [1,0,0,0,0,0|2,0,0]=3 393 B14R1.13 C#CC(=O)NCCc1ccc(Cl)cc1 Amb35701559 [0,1,0,0,0,0|2,0,1]=4 394 B14R1.13 C#CC(=O)NCCc1ccc(F)cc1 Amb30017608 [0,1,0,0,0,0|2,0,1]=4 395 B14R1.13 CCC(=O)CSCc1ccc(Cl)cc1 Amb32682969 [0,1,0,0,0,0|2,0,0]=3 396 B14R1.13 CCC(=O)NCCc1ccc(N)cc1 Amb17139366 [0,1,0,0,0,0|2,0,0]=3 397 B14R1.13 CCC(=O)NCCc1ccc(O)cc1 Amb5797466 [0,1,0,0,0,0|2,0,0]=3 398 B14R1.13 CNC(=N)NCCc1ccc(Br)cc1 Amb27183967 [0,1,0,0,0,0|3,0,0]=4 399 B14R1.13 CNC(=N)NCCc1ccc(O)cc1 Amb19061800 [0,1,0,0,0,0|3,0,0]=4 400 B14R1.13 CNC(=O)CCCc1ccc(N)cc1 Amb17336479 [0,1,0,0,0,0|1,0,0]=2 401 B14R1.13 CNC(=O)CCNc1ccc(F)cn1 Amb19082298 [0,1,0,0,0,0|3,0,0]=4 402 B14R1.13 CNC(=O)CCNc1ccc(N)nc1 Amb19080037 [0,1,0,0,0,0|3,0,0]=4 403 B14R1.13 CNC(=O)CCOc1ccc(Br)cc1 Amb17266149 [0,1,0,0,0,0|2,0,0]=3 404 B14R1.13 CNC(=O)CCOc1ccc(N)cc1 Amb18538554 [0,1,0,0,0,0|2,0,0]=3 405 B14R1.13 CNC(=O)COCc1ccc(N)cc1 Amb6703083 [0,1,0,0,0,0|2,0,0]=3 406 B14R1.13 CNC(=O)CSCc1ccc(N)cc1 Amb17498722 [0,1,0,0,0,0|2,0,0]=3 407 B14R1.13 CNC(=O)NCCc1ccc(C)cn1 Amb30029835 [0,1,0,0,0,0|3,0,0]=4 408 B14R1.13 CNC(=O)NCCc1ccc(N)cc1 Amb28079482 [0,1,0,0,0,0|2,0,0]=3 409 B14R1.13 CNC(=O)NCCc1ccc(O)cc1 Amb2132787 [0,1,0,0,0,0|2,0,0]=3 410 B14R1.13 COC(=O)C#CCc1ccc(Br)cc1 Amb27837275 [0,1,0,0,0,0|0,0,2]=3 411 B14R1.13 COC(=O)C#CCc1ccc(C)cc1 Amb27448192 [0,1,0,0,0,0|0,0,2]=3 412 B14R1.13 COC(=O)CCCc1ccc(Br)cc1 Amb18629275 [0,1,0,0,0,0|0,0,0]=1 413 B14R1.13 COC(=O)CCCc1ccc(C)cc1 Amb18110189 [0,1,0,0,0,0|0,0,0]=1 414 B14R1.13 COC(=O)CCCc1ccc(Cl)cc1 Amb18629276 [0,1,0,0,0,0|0,0,0]=1 415 B14R1.13 COC(=O)CCCc1ccc(F)cc1 Amb18110191 [0,1,0,0,0,0|0,0,0]=1 416 B14R1.13 COC(=O)CCCc1ccc(N)cc1 Amb22728278 [0,1,0,0,0,0|0,0,0]=1 417 B14R1.13 COC(=O)CCCc1ccc(N)cc1 Amb8391153 [0,1,0,0,0,0|0,0,0]=1 418 B14R1.13 COC(=O)CCNc1ccc(Br)cc1 Amb1981435 [0,1,0,0,0,0|1,0,0]=2 419 B14R1.13 COC(=O)CCNc1ccc(C)cc1 Amb9024004 [0,1,0,0,0,0|1,0,0]=2 420 B14R1.13 COC(=O)CCNc1ccc(C)cn1 Amb19051544 [0,1,0,0,0,0|2,0,0]=3 421 B14R1.13 COC(=O)CCNc1ccc(Cl)cc1 Amb2737282 [0,1,0,0,0,0|1,0,0]=2 422 B14R1.13 COC(=O)CCNc1ccc(F)cc1 Amb9026328 [0,1,0,0,0,0|1,0,0]=2 423 B14R1.13 COC(=O)CCNc1ccc(O)cc1 Amb30588582 [0,1,0,0,0,0|1,0,0]=2 424 B14R1.13 COC(=O)CCOc1ccc(Br)cc1 Amb7773736 [0,1,0,0,0,0|1,0,0]=2 425 B14R1.13 COC(=O)CCOc1ccc(F)cc1 Amb9204521 [0,1,0,0,0,0|1,0,0]=2 426 B14R1.13 COC(=O)CCOc1ccc(N)cc1 Amb13951735 [0,1,0,0,0,0|1,0,0]=2 427 B14R1.13 COC(=O)CNCc1ccc(C)cc1 Amb6686949 [0,1,0,0,0,0|1,0,0]=2 428 B14R1.13 COC(=O)CNCc1ccc(Cl)cc1 Amb10609077 [0,1,0,0,0,0|1,0,0]=2 429 B14R1.13 COC(=O)CNCc1ccc(Cl)cc1 Amb6686925 [0,1,0,0,0,0|1,0,0]=2 430 B14R1.13 COC(=O)CNCc1ccc(F)cc1 Amb6686928 [0,1,0,0,0,0|1,0,0]=2 431 B14R1.13 COC(=O)CSCc1ccc(Cl)cc1 Amb6383265 [0,1,0,0,0,0|1,0,0]=2 432 B14R1.13 COC(=O)CSCc1ccc(N)cc1 Amb9482336 [0,1,0,0,0,0|1,0,0]=2 433 B14R1.13 COC(=O)NCCc1ccc(C)cc1 Amb28482985 [0,1,0,0,0,0|1,0,0]=2 434 B14R1.13 COC(=O)NCCc1ccc(N)cc1 Amb8390016 [0,1,0,0,0,0|1,0,0]=2 435 B14R1.13 COC(=O)N\N=C\c1ccc(C)cc1 Amb3363191 [0,1,0,0,0,0|2,0,1]=4 436 B14R1.13 COC(=O)\C=C\Nc1ccc(C)cc1 Amb27951188 [0,1,0,0,0,0|1,0,2]=4 437 B14R1.13 Cc1ccc(CCNC(=O)CCl)cc1 Amb10075558 [0,1,0,0,0,0|3,0,0]=4 438 B14R1.13 Cc1ccc(CCNC(=O)CN)cc1 Amb17401668 [0,1,0,0,0,0|3,0,0]=4 439 B14R1.13 Cc1ccc(CCNC(=O)CO)cc1 Amb17401775 [0,1,0,0,0,0|3,0,0]=4 440 B14R1.13 Cc1ccc(CSCC(=O)NN)cc1 Amb6854908 [0,1,0,0,0,0|3,0,0]=4 441 B14R1.13 Cc1ccc(NCCC(=O)NN)cc1 Amb17605080 [0,1,0,0,0,0|3,0,0]=4 442 B14R1.13 Cc1ccc(SCCC(=O)NN)cc1 Amb1105982 [0,1,0,0,0,0|3,0,0]=4 443 B14R1.13 NCC(=O)NCCc1ccc(Br)cc1 Amb17414922 [0,1,0,0,0,0|3,0,0]=4 444 B14R1.13 NCC(=O)NCCc1ccc(Cl)cc1 Amb5783121 [0,1,0,0,0,0|3,0,0]=4 445 B14R1.13 NCC(=O)NCCc1ccc(F)cc1 Amb5783061 [0,1,0,0,0,0|3,0,0]=4 446 B14R1.13 NNC(=O)CCCc1ccc(O)cc1 Amb1822852 [0,1,0,0,0,0|2,0,0]=3 447 B14R1.13 NNC(=O)CCSc1ccc(F)cc1 Amb434294 [0,1,0,0,0,0|3,0,0]=4 448 B14R1.13 NNC(=O)CSCc1ccc(Br)cc1 Amb6854962 [0,1,0,0,0,0|3,0,0]=4 449 B14R1.13 NNC(=O)CSCc1ccc(Cl)cc1 Amb6334960 [0,1,0,0,0,0|3,0,0]=4 450 B14R1.13 NNC(=O)CSCc1ccc(F)cc1 Amb6854412 [0,1,0,0,0,0|3,0,0]=4 451 B14R1.13 O=C(CBr)NCCc1ccc(F)cc1 Amb17325725 [0,1,0,0,0,0|3,0,0]=4 452 B14R1.13 O=C(CBr)NCCc1ccc(O)cc1 Amb17325592 [0,1,0,0,0,0|3,0,0]=4 453 B14R1.13 O=C(CCl)NCCc1ccc(Br)cc1 Amb17421889 [0,1,0,0,0,0|3,0,0]=4 454 B14R1.13 O=C(CCl)NCCc1ccc(Cl)cc1 Amb6573290 [0,1,0,0,0,0|3,0,0]=4 455 B14R1.13 O=C(CCl)NCCc1ccc(F)cc1 Amb1635500 [0,1,0,0,0,0|3,0,0]=4 456 B14R1.13 O=C(CCl)NCCc1ccc(O)cc1 Amb6761713 [0,1,0,0,0,0|3,0,0]=4 457 B14R1.13 O=C(CO)NCCc1ccc(Br)cc1 Amb17415250 [0,1,0,0,0,0|3,0,0]=4 458 B14R1.13 O=C(CO)NCCc1ccc(Cl)cc1 Amb1110300 [0,1,0,0,0,0|3,0,0]=4 459 B14R1.13 O=C(CO)NCCc1ccc(F)cc1 Amb1109713 [0,1,0,0,0,0|3,0,0]=4 460 B14R1.13 O=C(CO)NCCc1ccc(O)cc1 Amb5798085 [0,1,0,0,0,0|3,0,0]=4 461 B14R1.163 C#CC(=O)NCC(C)c1ccccc1 Amb35701553 [0,1,0,0,0,0|2,0,1]=4 462 B14R1.163 C#CC(=O)NCC(O)c1ccccc1 Amb9361433 [0,1,0,0,0,0|2,0,1]=4 463 B14R1.163 CC(CNC(=O)CCl)c1ccccc1 Amb1657748 [0,1,0,0,0,0|3,0,0]=4 464 B14R1.163 CC(NCC(=O)NN)c1ccccc1 Amb376133 [0,1,0,0,0,0|3,0,0]=4 465 B14R1.163 CCC(=O)NCC(=O)c1ccccc1 Amb17336295 [0,1,0,0,0,0|2,0,1]=4 466 B14R1.163 CCC(=O)NCC(O)c1ccccc1 Amb4035680 [0,1,0,0,0,0|2,0,0]=3 467 B14R1.163 CNC(=O)CCC(=O)c1ccccc1 Amb17336307 [0,1,0,0,0,0|1,0,1]=3 468 B14R1.163 CNC(=O)CCC(O)c1ccccc1 Amb17336618 [0,1,0,0,0,0|1,0,0]=2 469 B14R1.163 CNC(=O)NCC(C)c1ccccn1 Amb30010351 [0,1,0,0,0,0|3,0,0]=4 470 B14R1.163 CNC(=O)NCC(O)c1ccccc1 Amb24181770 [0,1,0,0,0,0|2,0,0]=3 471 B14R1.163 COC(=O)C#C[C@@H](O)c1ccccc1 Amb27664199 [0,1,0,0,0,0|0,0,2]=3 472 B14R1.163 COC(=O)CCC(=O)c1ccccc1 Amb2720969 [0,1,0,0,0,0|0,0,1]=2 473 B14R1.163 COC(=O)CCC(N)c1ccccc1 Amb10610596 [0,1,0,0,0,0|0,0,0]=1 474 B14R1.163 COC(=O)CCC(N)c1ccccc1 Amb19373309 [0,1,0,0,0,0|0,0,0]=1 475 B14R1.163 COC(=O)CCC(N)c1ccccn1 Amb33358494 [0,1,0,0,0,0|1,0,0]=2 476 B14R1.163 COC(=O)CCC(N)c1cccnc1 Amb33448579 [0,1,0,0,0,0|1,0,0]=2 477 B14R1.163 COC(=O)CCC(N)c1ccncc1 Amb33171526 [0,1,0,0,0,0|1,0,0]=2 478 B14R1.163 COC(=O)CCC(N)c1ccncn1 Amb33268571 [0,1,0,0,0,0|2,0,0]=3 479 B14R1.163 COC(=O)CCC(N)c1cnccn1 Amb33429667 [0,1,0,0,0,0|2,0,0]=3 480 B14R1.163 COC(=O)CCC(N)c1cncnc1 Amb32876394 [0,1,0,0,0,0|2,0,0]=3 481 B14R1.163 COC(=O)CCC(N)c1ncccn1 Amb33270019 [0,1,0,0,0,0|2,0,0]=3 482 B14R1.163 COC(=O)CC[C@@H](N)c1ncccn1 Amb32716298 [0,1,0,0,0,0|2,0,0]=3 483 B14R1.163 COC(=O)CNC(=O)c1ccccc1 Amb1006962 [0,1,0,0,0,0|1,0,1]=3 484 B14R1.163 COC(=O)CNC(=S)c1ccccc1 Amb22495668 [0,1,0,0,0,0|1,0,1]=3 485 B14R1.163 COC(=O)CNC(C)c1ccccc1 Amb4035922 [0,1,0,0,0,0|1,0,0]=2 486 B14R1.163 COC(=O)CN[C@@H](C)c1ccccc1 Amb34158023 [0,1,0,0,0,0|1,0,0]=2 487 B14R1.163 COC(=O)NNC(=O)c1ccccc1 Amb3724158 [0,1,0,0,0,0|2,0,1]=4 488 B14R1.163 COC(=O)\C=C\C(=O)c1ccccc1 Amb2435415 [0,1,0,0,0,0|0,0,3]=4 489 B14R1.163 O=C(CBr)NCC(O)c1ccccc1 Amb17332028 [0,1,0,0,0,0|3,0,0]=4 490 B14R1.163 O=C(CCl)NCC(O)c1ccccc1 Amb17326215 [0,1,0,0,0,0|3,0,0]=4 491 B14R1.292 CCS(=O)(=O)NCCc1ccccc1 Amb6493193 [0,1,0,0,0,0|3,0,0]=4 492 B14R1.292 CNS(=O)(=O)CCCc1ccccc1 Amb32692005 [0,1,0,0,0,0|2,0,0]=3 493 B14R1.520 C#CCC(=O)CNCc1ccccc1 Amb33131579 [0,1,0,0,0,0|2,0,1]=4 494 B14R1.520 C#CCC(=O)COCc1ccccc1 Amb27781310 [0,1,0,0,0,0|2,0,1]=4 495 B14R1.520 C=C(CCO)COCc1ccccc1 Amb27394738 [0,1,0,0,0,0|3,0,0]=4 496 B14R1.520 CCCC(=O)CNCc1ccccc1 Amb33308018 [0,1,0,0,0,0|2,0,0]=3 497 B14R1.520 CCCC(=O)COCc1ccccc1 Amb19078959 [0,1,0,0,0,0|2,0,0]=3 498 B14R1.520 CCCC(=O)CSCc1ccccc1 Amb32683101 [0,1,0,0,0,0|2,0,0]=3 499 B14R1.520 CCCC(=O)NOCc1ccccc1 Amb15742562 [0,1,0,0,0,0|3,0,0]=4 500 B14R1.520 CCNC(=N)COCc1ccccc1 Amb28385912 [0,1,0,0,0,0|3,0,0]=4 501 B14R1.520 CCOC(=N)CCCc1cccnc1 Amb24066215 [0,1,0,0,0,0|2,0,0]=3 502 B14R1.520 CCOC(=N)CCCc1ccncc1 Amb24083113 [0,1,0,0,0,0|2,0,0]=3 503 B14R1.520 CCOC(=O)C#CCc1ccccc1 Amb26505964 [0,1,0,0,0,0|0,0,2]=3 504 B14R1.520 CCOC(=O)C#CCc1ccccn1 Amb27393438 [0,1,0,0,0,0|1,0,2]=4 505 B14R1.520 CCOC(=O)C#CSc1ccccc1 Amb28124566 [0,1,0,0,0,0|1,0,2]=4 506 B14R1.520 CCOC(=O)CCCc1ccccc1 Amb3939013 [0,1,0,0,0,0|0,0,0]=1 507 B14R1.520 CCOC(=O)CCNc1ccccc1 Amb9026190 [0,1,0,0,0,0|1,0,0]=2 508 B14R1.520 CCOC(=O)CCNc1ccccn1 Amb8395311 [0,1,0,0,0,0|2,0,0]=3 509 B14R1.520 CCOC(=O)CCNc1ncccn1 Amb19080633 [0,1,0,0,0,0|3,0,0]=4 510 B14R1.520 CCOC(=O)CCOc1ccccc1 Amb6357771 [0,1,0,0,0,0|1,0,0]=2 511 B14R1.520 CCOC(=O)CCSc1ccccc1 Amb8867120 [0,1,0,0,0,0|1,0,0]=2 512 B14R1.520 CCOC(=O)CNCc1ccccc1 Amb2720025 [0,1,0,0,0,0|1,0,0]=2 513 B14R1.520 CCOC(=O)CNCc1ccccc1 Amb6335212 [0,1,0,0,0,0|1,0,0]=2 514 B14R1.520 CCOC(=O)CNCc1ncccn1 Amb33531291 [0,1,0,0,0,0|3,0,0]=4 515 B14R1.520 CCOC(=O)COCc1ccccc1 Amb7764605 [0,1,0,0,0,0|1,0,0]=2 516 B14R1.520 CCOC(=O)C\C=C\c1ccccc1 Amb34916573 [0,1,0,0,0,0|0,0,2]=3 517 B14R1.520 CCOC(=O)C\N=C\c1ccccc1 Amb8394336 [0,1,0,0,0,0|1,0,1]=3 518 B14R1.520 CCOC(=O)NCCc1ccccc1 Amb6358963 [0,1,0,0,0,0|1,0,0]=2 519 B14R1.520 CCOC(=O)NOCc1ccccc1 Amb27611822 [0,1,0,0,0,0|2,0,0]=3 520 B14R1.520 CCOC(=O)N\C=N\c1ccccc1 Amb27957763 [0,1,0,0,0,0|2,0,1]=4 521 B14R1.520 CCOC(=O)\C=C/Cc1ccccc1 Amb6295788 [0,1,0,0,0,0|0,0,2]=3 522 B14R1.520 CCOC(=O)\C=C\Cc1ccccc1 Amb10873144 [0,1,0,0,0,0|0,0,2]=3 523 B14R1.520 CCO[PH](=O)CNCc1ccccc1 Amb28203972 [0,1,0,0,0,0|2,0,0]=3 524 B14R1.520 CN(CCN)CCCc1ccccc1 Amb8956756 [0,1,0,0,0,0|3,0,0]=4 525 B14R1.520 CN(CCO)CCCc1ccccc1 Amb17336738 [0,1,0,0,0,0|3,0,0]=4 526 B14R1.520 CNCC(=O)NCCc1ccccc1 Amb15740954 [0,1,0,0,0,0|2,0,0]=3 527 B14R1.520 CNCC(=O)NCCc1ccccc1 Amb6258813 [0,1,0,0,0,0|2,0,0]=3 528 B14R1.520 COCC(=O)CCCc1ccccc1 Amb19073932 [0,1,0,0,0,0|0,0,0]=1 529 B14R1.520 COCC(=O)CNCc1ccccc1 Amb33130886 [0,1,0,0,0,0|1,0,0]=2 530 B14R1.520 COCC(=O)CSCc1ccccc1 Amb32683203 [0,1,0,0,0,0|1,0,0]=2 531 B14R1.520 COCC(=O)NOCc1ccccc1 Amb10682506 [0,1,0,0,0,0|2,0,0]=3 532 B14R1.520 COCC(C)NCCc1ccccc1 Amb6689549 [0,1,0,0,0,0|2,0,1]=4 533 B14R1.520 COCC(N)CCCc1ccccc1 Amb19062066 [0,1,0,0,0,0|1,0,1]=3 534 B14R1.520 COCC(N)COCc1ccccc1 Amb28071645 [0,1,0,0,0,0|2,0,1]=4 535 B14R1.520 COCC(O)CCCc1ccccc1 Amb18324748 [0,1,0,0,0,0|0,0,2]=3 536 B14R1.520 COC[C@@H](O)COCc1ccccc1 Amb27977834 [0,1,0,0,0,0|1,0,2]=4 537 B14R1.520 CONC(=O)CNCc1ccccc1 Amb27973952 [0,1,0,0,0,0|1,0,0]=2 538 B14R1.520 CONC(=O)COCc1ccccc1 Amb27483753 [0,1,0,0,0,0|1,0,0]=2 539 B14R1.520 CSCC(=O)CCCc1ccccc1 Amb33129304 [0,1,0,0,0,0|0,1,0]=2 540 B14R1.520 CSCC(N)CCCc1ccccc1 Amb33129325 [0,1,0,0,0,0|1,1,1]=4 541 B14R1.520 C\C(=C\CO)COCc1ccccc1 Amb26050116 [0,1,0,0,0,0|3,0,0]=4 542 B14R1.520 C\C=C\C(=O)CNCc1ccccc1 Amb33307401 [0,1,0,0,0,0|2,0,0]=3 543 B14R1.520 C\C=C\C(=O)NOCc1ccccc1 Amb27594869 [0,1,0,0,0,0|3,0,0]=4 544 B14R1.520 N#CCC(=O)COCc1ccccc1 Amb26017924 [0,1,0,0,0,0|2,0,1]=4 545 B14R1.520 N#CCC(=O)NCCc1ccccc1 Amb6334433 [0,1,0,0,0,0|2,0,1]=4 546 B14R1.520 N#CCC(=O)OCCc1ccccc1 Amb17210534 [0,1,0,0,0,0|2,0,1]=4 547 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb1131212 [0,1,0,0,0,0|2,0,0]=3 548 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb15741009 [0,1,0,0,0,0|2,0,0]=3 549 B14R1.520 O=C(C#CBr)NCCc1ccccc1 Amb27592282 [0,1,0,0,0,0|2,0,1]=4 550 B14R1.520 O=C(CCBr)NCCc1ccccc1 Amb17324032 [0,1,0,0,0,0|2,0,0]=3 551 B14R1.520 O=C(CCBr)NCCc1ccccn1 Amb17329338 [0,1,0,0,0,0|3,0,0]=4 552 B14R1.520 O=C(CCCl)NCCc1ccccc1 Amb33543242 [0,1,0,0,0,0|2,0,0]=3 553 B14R1.520 O=C(CCCl)NCCc1ccccn1 Amb6264023 [0,1,0,0,0,0|3,0,0]=4 554 B14R1.520 O=C(CCCl)NCCc1ccncc1 Amb17329185 [0,1,0,0,0,0|3,0,0]=4 555 B14R1.520 O=C(CCCl)NOCc1ccccc1 Amb27471657 [0,1,0,0,0,0|3,0,0]=4 556 B14R1.520 O=C=NC(=O)CCOc1ccccc1 Amb17235024 [0,1,0,0,0,0|2,0,1]=4 557 B14R1.546 CCN(C=O)CNCc1ccccc1 Amb28186571 [0,1,0,0,0,0|3,0,0]=4 558 B14R1.546 CC[C@@H](C=O)COCc1ccccc1 Amb28240468 [0,1,0,0,0,0|2,0,1]=4 559 B14R1.546 COC(C=O)COCc1ccccc1 Amb27952668 [0,1,0,0,0,0|1,0,1]=3 560 B14R1.546 COC(CCCc1ccccc1)OC Amb10559986 [0,1,0,0,0,0|0,0,2]=3 561 B14R1.546 COC(CCSc1ccccc1)OC Amb32682628 [0,1,0,0,0,0|1,0,2]=4 562 B14R1.546 COC(CNCc1ccccc1)OC Amb6740262 [0,1,0,0,0,0|1,0,2]=4 563 B14R1.546 COC(CO)COCc1ccccc1 Amb27411561 [0,1,0,0,0,0|1,0,2]=4 564 B14R1.546 COC(COCc1ccccc1)OC Amb10807987 [0,1,0,0,0,0|1,0,2]=4 565 B14R1.546 COC(CSCc1ccccc1)OC Amb33249624 [0,1,0,0,0,0|1,0,2]=4 566 B14R1.546 CO[C@@H](CO)COCc1ccccc1 Amb27946931 [0,1,0,0,0,0|1,0,2]=4 567 B14R1.546 C\C=C(\C=O)COCc1ccccc1 Amb27171065 [0,1,0,0,0,0|2,0,0]=3 568 B14R1.546 C\N=C(\NC)NCCc1ccccc1 Amb24710194 [0,1,0,0,0,0|3,0,0]=4 569 B14R1.743 C#CC(=O)NC(C)Cc1ccccc1 Amb35724226 [0,1,0,0,0,0|2,0,1]=4 570 B14R1.743 CC(Cc1ccccc1)NC(=O)CBr Amb17333679 [0,1,0,0,0,0|3,0,0]=4 571 B14R1.743 CCC(=O)CC(=O)Nc1ccccc1 Amb27453598 [0,1,0,0,0,0|2,0,1]=4 572 B14R1.743 CN(CC(=O)NN)Cc1ccccc1 Amb19651325 [0,1,0,0,0,0|3,0,0]=4 573 B14R1.743 CNC(=N)NC(C)Cc1ccccc1 Amb19041369 [0,1,0,0,0,0|3,0,0]=4 574 B14R1.743 CNC(=O)NC(=O)Cc1ccccc1 Amb27387925 [0,1,0,0,0,0|2,0,1]=4 575 B14R1.743 CNC(=O)NC(C)Cc1ccccn1 Amb35692252 [0,1,0,0,0,0|3,0,0]=4 576 B14R1.743 COC(=O)CC(=O)Cc1ccccc1 Amb2689984 [0,1,0,0,0,0|0,0,1]=2 577 B14R1.743 COC(=O)CC(=O)Nc1ccccc1 Amb6811741 [0,1,0,0,0,0|1,0,1]=3 578 B14R1.743 COC(=O)CC(Br)Cc1ccccc1 Amb18111203 [0,1,0,0,0,0|0,0,0]=1 579 B14R1.743 COC(=O)CC(Cl)Cc1ccccc1 Amb18111202 [0,1,0,0,0,0|0,0,0]=1 580 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb18110742 [0,1,0,0,0,0|0,0,0]=1 581 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb21964184 [0,1,0,0,0,0|0,0,0]=1 582 B14R1.743 COC(=O)C[C@@H](N)Cc1ccccc1 Amb32719255 [0,1,0,0,0,0|0,0,0]=1 583 B14R1.743 COC(=O)C[C@@H](N)Cc1ccccc1 Amb32719261 [0,1,0,0,0,0|0,0,0]=1 584 B14R1.743 COC(=O)C[C@H](N)Cc1ccccc1 Amb32719262 [0,1,0,0,0,0|0,0,0]=1 585 B14R1.743 COC(=O)C[C@H](N)Cc1ccccc1 Amb32719263 [0,1,0,0,0,0|0,0,0]=1 586 B14R1.743 COC(=O)NC(=S)Nc1ccccc1 Amb25906654 [0,1,0,0,0,0|2,0,1]=4 587 B14R1.743 COC(=O)NC(C)Cc1ccccc1 Amb33552136 [0,1,0,0,0,0|1,0,0]=2 588 B14R1.743 COC(=O)\C=C(/C)Nc1ccccc1 Amb6808898 [0,1,0,0,0,0|1,0,2]=4 589 B14R1.743 COC(=O)\C=C(\C)Nc1ccccc1 Amb2386652 [0,1,0,0,0,0|1,0,2]=4 590 B14R1.756 CC(SCc1ccccc1)C(=O)NN Amb6773973 [0,1,0,0,0,0|3,0,0]=4 591 B14R1.756 CCC(=O)C(C)OCc1ccccc1 Amb25708039 [0,1,0,0,0,0|2,0,0]=3 592 B14R1.756 CCC(=O)C(C)SCc1ccccc1 Amb32683030 [0,1,0,0,0,0|2,0,0]=3 593 B14R1.756 CN(CCc1ccccc1)C(=O)CCl Amb17241042 [0,1,0,0,0,0|3,0,0]=4 594 B14R1.756 CN(CCc1ccccc1)C(=O)CN Amb17235470 [0,1,0,0,0,0|3,0,0]=4 595 B14R1.756 CN(CCc1ccccc1)C(=O)CO Amb17401768 [0,1,0,0,0,0|3,0,0]=4 596 B14R1.756 CNC(=O)C(=O)NCc1ccccc1 Amb2422863 [0,1,0,0,0,0|2,0,1]=4 597 B14R1.756 CNC(=O)C(C)OCc1ccccc1 Amb28340850 [0,1,0,0,0,0|2,0,0]=3 598 B14R1.756 CNC(=O)C(O)CNc1ccncc1 Amb27456001 [0,1,0,0,0,0|3,0,0]=4 599 B14R1.756 CNC(=O)C(O)\C=C\c1ccccc1 Amb25243537 [0,1,0,0,0,0|1,0,2]=4 600 B14R1.756 COC(=O)C(=O)\C=C\c1ccccc1 Amb31029020 [0,1,0,0,0,0|0,0,3]=4 601 B14R1.756 COC(=O)C(C)CCc1ccccc1 Amb17844109 [0,1,0,0,0,0|0,0,0]=1 602 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb20625132 [0,1,0,0,0,0|1,0,0]=2 603 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb22741033 [0,1,0,0,0,0|1,0,0]=2 604 B14R1.756 COC(=O)C(C)NCc1ccccn1 Amb19042488 [0,1,0,0,0,0|2,0,0]=3 605 B14R1.756 COC(=O)C(C)NCc1cccnc1 Amb19042487 [0,1,0,0,0,0|2,0,0]=3 606 B14R1.756 COC(=O)C(C)OCc1ccccc1 Amb2699315 [0,1,0,0,0,0|1,0,0]=2 607 B14R1.756 COC(=O)C(C)\N=C\c1ccccc1 Amb2426902 [0,1,0,0,0,0|1,0,1]=3 608 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb19042065 [0,1,0,0,0,0|0,0,0]=1 609 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb23439021 [0,1,0,0,0,0|0,0,0]=1 610 B14R1.756 COC(=O)C(N)CCc1ccccn1 Amb33736468 [0,1,0,0,0,0|1,0,0]=2 611 B14R1.756 COC(=O)C(N)CCc1ccncc1 Amb33746371 [0,1,0,0,0,0|1,0,0]=2 612 B14R1.756 COC(=O)C(N)COc1cccnc1 Amb22643009 [0,1,0,0,0,0|2,0,0]=3 613 B14R1.756 COC(=O)C(N)CSc1ccccc1 Amb22642641 [0,1,0,0,0,0|1,0,0]=2 614 B14R1.756 COC(=O)C(N)CSc1ccccc1 Amb32662448 [0,1,0,0,0,0|1,0,0]=2 615 B14R1.756 COC(=O)C(N)CSc1ccccn1 Amb22642645 [0,1,0,0,0,0|2,0,0]=3 616 B14R1.756 COC(=O)C(N)CSc1ccccn1 Amb32662452 [0,1,0,0,0,0|2,0,0]=3 617 B14R1.756 COC(=O)C(N)CSc1ncccn1 Amb22642644 [0,1,0,0,0,0|3,0,0]=4 618 B14R1.756 COC(=O)C(N)CSc1ncccn1 Amb32662451 [0,1,0,0,0,0|3,0,0]=4 619 B14R1.756 COC(=O)C(N)\C=C\c1ccccc1 Amb33081314 [0,1,0,0,0,0|0,0,2]=3 620 B14R1.756 COC(=O)C(O)C#Cc1ccccc1 Amb27478725 [0,1,0,0,0,0|0,0,2]=3 621 B14R1.756 COC(=O)C(O)OCc1ccccc1 Amb28065943 [0,1,0,0,0,0|1,0,0]=2 622 B14R1.756 COC(=O)C(O)\C=C\c1ccccc1 Amb32952079 [0,1,0,0,0,0|0,0,2]=3 623 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb16183003 [0,1,0,0,0,0|1,0,0]=2 624 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb22746683 [0,1,0,0,0,0|1,0,0]=2 625 B14R1.756 COC(=O)[C@@H](C)OCc1ccccc1 Amb17617220 [0,1,0,0,0,0|1,0,0]=2 626 B14R1.756 COC(=O)[C@@H](N)CCc1ccccc1 Amb33738062 [0,1,0,0,0,0|0,0,0]=1 627 B14R1.756 COC(=O)[C@@H](N)\C=C\c1ccccc1 Amb30647374 [0,1,0,0,0,0|0,0,2]=3 628 B14R1.756 COC(=O)[C@@H](O)C#Cc1ccccc1 Amb28455648 [0,1,0,0,0,0|0,0,2]=3 629 B14R1.756 COC(=O)[C@H](C)NCc1ccccc1 Amb33757896 [0,1,0,0,0,0|1,0,0]=2 630 B14R1.756 COC(=O)[C@H](C)NCc1ccccc1 Amb9228619 [0,1,0,0,0,0|1,0,0]=2 631 B14R1.756 COC(=O)[C@H](N)CCc1ccccc1 Amb33737035 [0,1,0,0,0,0|0,0,0]=1 632 B14R1.756 COC(=O)\C(C)=N\Nc1ccccc1 Amb4019441 [0,1,0,0,0,0|2,0,1]=4 633 B14R1.756 COC(=O)\C(Cl)=N\Nc1ccccc1 Amb24277024 [0,1,0,0,0,0|2,0,1]=4 634 B14R1.756 COC(=O)\C(N)=C\Nc1ccccc1 Amb28384498 [0,1,0,0,0,0|1,0,2]=4 635 B14R1.756 COC(C)C(C)NCc1ccccc1 Amb27981487 [0,1,0,0,0,0|2,0,1]=4 636 B14R1.756 COC(C)[C@H](C)NCc1ccccc1 Amb27241761 [0,1,0,0,0,0|2,0,1]=4 637 B14R1.756 CON(C)C(=O)CCc1ccccc1 Amb8388514 [0,1,0,0,0,0|2,0,1]=4 638 B14R1.756 C[C@H](OCc1ccccc1)C(=O)CCl Amb27172814 [0,1,0,0,0,0|3,0,0]=4 639 B14R1.756 C[C@H](OCc1ccccc1)C(=O)NN Amb28129351 [0,1,0,0,0,0|3,0,0]=4 640 B14R1.837 C#CC(=O)NCCc1ccccc1C Amb35694230 [0,1,0,0,0,0|2,0,1]=4 641 B14R1.837 C#CC(=O)NCCc1ccccc1F Amb35694240 [0,1,0,0,0,0|2,0,1]=4 642 B14R1.837 CCC(=O)CSCc1ccccc1C Amb32682986 [0,1,0,0,0,0|2,0,0]=3 643 B14R1.837 CCC(=O)CSCc1ccccc1Cl Amb32682968 [0,1,0,0,0,0|2,0,0]=3 644 B14R1.837 CNC(=N)NCCc1ccccc1C Amb28397678 [0,1,0,0,0,0|3,0,0]=4 645 B14R1.837 CNC(=O)CCNc1ccncc1Br Amb28124368 [0,1,0,0,0,0|3,0,0]=4 646 B14R1.837 CNC(=O)CCNc1ccncc1F Amb35655016 [0,1,0,0,0,0|3,0,0]=4 647 B14R1.837 CNC(=O)CCNc1ccncc1N Amb19080038 [0,1,0,0,0,0|3,0,0]=4 648 B14R1.837 CNC(=O)CCNc1cnccc1N Amb27837241 [0,1,0,0,0,0|3,0,0]=4 649 B14R1.837 CNC(=O)CCNc1ncccc1I Amb27598217 [0,1,0,0,0,0|3,0,0]=4 650 B14R1.837 CNC(=O)CCOc1ccccc1Br Amb17266147 [0,1,0,0,0,0|2,0,0]=3 651 B14R1.837 CNC(=O)CCOc1ccccc1N Amb17235928 [0,1,0,0,0,0|2,0,0]=3 652 B14R1.837 CNC(=O)NCCc1ccccc1F Amb26462456 [0,1,0,0,0,0|2,0,0]=3 653 B14R1.837 CNC(=O)NCCc1ncccc1C Amb30029834 [0,1,0,0,0,0|3,0,0]=4 654 B14R1.837 COC(=O)C#CCc1ccccc1Br Amb29860819 [0,1,0,0,0,0|0,0,2]=3 655 B14R1.837 COC(=O)C#CCc1ccccc1Cl Amb27464193 [0,1,0,0,0,0|0,0,2]=3 656 B14R1.837 COC(=O)CCCc1ccccc1N Amb17595065 [0,1,0,0,0,0|0,0,0]=1 657 B14R1.837 COC(=O)CCCc1ccccc1O Amb30982170 [0,1,0,0,0,0|0,0,0]=1 658 B14R1.837 COC(=O)CCNc1ccccc1C Amb9026356 [0,1,0,0,0,0|1,0,0]=2 659 B14R1.837 COC(=O)CCNc1cccnc1Cl Amb18095536 [0,1,0,0,0,0|2,0,0]=3 660 B14R1.837 COC(=O)CCOc1ccccc1N Amb19080574 [0,1,0,0,0,0|1,0,0]=2 661 B14R1.837 COC(=O)CCOc1ccccc1N Amb19148869 [0,1,0,0,0,0|1,0,0]=2 662 B14R1.837 COC(=O)CCSc1ncccc1N Amb9482044 [0,1,0,0,0,0|2,0,0]=3 663 B14R1.837 COC(=O)CNCc1ccccc1Br Amb6687151 [0,1,0,0,0,0|1,0,0]=2 664 B14R1.837 COC(=O)CNCc1ccccc1C Amb10610000 [0,1,0,0,0,0|1,0,0]=2 665 B14R1.837 COC(=O)CNCc1ccccc1C Amb6686948 [0,1,0,0,0,0|1,0,0]=2 666 B14R1.837 COC(=O)CNCc1ccccc1Cl Amb33550194 [0,1,0,0,0,0|1,0,0]=2 667 B14R1.837 COC(=O)CNCc1ccccc1Cl Amb6686921 [0,1,0,0,0,0|1,0,0]=2 668 B14R1.837 COC(=O)NCCc1ccccc1N Amb17777450 [0,1,0,0,0,0|1,0,0]=2 669 B14R1.837 COC(=O)N\C=C\c1ccccc1Cl Amb26078541 [0,1,0,0,0,0|1,0,2]=4 670 B14R1.837 COC(=O)N\N=C\c1ccccc1Cl Amb2411285 [0,1,0,0,0,0|2,0,1]=4 671 B14R1.837 COC(=O)N\N=C\c1ccccc1O Amb3355123 [0,1,0,0,0,0|2,0,1]=4 672 B14R1.837 COC(=O)\C=C\Nc1ccccc1Cl Amb27465041 [0,1,0,0,0,0|1,0,2]=4 673 B14R1.837 Cc1ccccc1CCNC(=O)CBr Amb17331119 [0,1,0,0,0,0|3,0,0]=4 674 B14R1.837 Cc1ccccc1CCNC(=O)CCl Amb1677630 [0,1,0,0,0,0|3,0,0]=4 675 B14R1.837 Cc1ccccc1CCNC(=O)CN Amb17401666 [0,1,0,0,0,0|3,0,0]=4 676 B14R1.837 Cc1ccccc1CCNC(=O)CO Amb17401770 [0,1,0,0,0,0|3,0,0]=4 677 B14R1.837 Cc1ccccc1CSCC(=O)NN Amb6854199 [0,1,0,0,0,0|3,0,0]=4 678 B14R1.837 Cc1ccccc1NCCC(=O)NN Amb28283106 [0,1,0,0,0,0|3,0,0]=4 679 B14R1.837 Cc1ccccc1NCCC(=O)NO Amb27419084 [0,1,0,0,0,0|3,0,0]=4 680 B14R1.837 NCC(=O)NCCc1ccccc1Cl Amb17404214 [0,1,0,0,0,0|3,0,0]=4 681 B14R1.837 NCC(=O)NCCc1ccccc1F Amb5783060 [0,1,0,0,0,0|3,0,0]=4 682 B14R1.837 NNC(=O)CCNc1ccccc1N Amb27773780 [0,1,0,0,0,0|3,0,0]=4 683 B14R1.837 NNC(=O)CSCc1ccccc1Br Amb6550888 [0,1,0,0,0,0|3,0,0]=4 684 B14R1.837 NNC(=O)CSCc1ccccc1Cl Amb6550810 [0,1,0,0,0,0|3,0,0]=4 685 B14R1.837 NNC(=O)CSCc1ccccc1F Amb6854240 [0,1,0,0,0,0|3,0,0]=4 686 B14R1.837 NNC(=O)NCCc1ccccc1O Amb27789942 [0,1,0,0,0,0|3,0,0]=4 687 B14R1.837 O=C(CCl)NCCc1ccccc1Cl Amb17407824 [0,1,0,0,0,0|3,0,0]=4 688 B14R1.837 O=C(CCl)NCCc1ccccc1F Amb461631 [0,1,0,0,0,0|3,0,0]=4 689 B14R1.837 O=C(CO)NCCc1ccccc1Cl Amb17404293 [0,1,0,0,0,0|3,0,0]=4 690 B14R1.837 O=C(CO)NCCc1ccccc1F Amb17402182 [0,1,0,0,0,0|3,0,0]=4 691 B14R1.1025 C#CC(=O)NCCc1cccc(C)c1 Amb35694383 [0,1,0,0,0,0|2,0,1]=4 692 B14R1.1025 C#CC(=O)NCCc1cccc(Cl)c1 Amb35694231 [0,1,0,0,0,0|2,0,1]=4 693 B14R1.1025 C#CC(=O)NCCc1cccc(F)c1 Amb30017603 [0,1,0,0,0,0|2,0,1]=4 694 B14R1.1025 C=CC(=O)CCOc1cccc(F)c1 Amb33417450 [0,1,0,0,0,0|2,0,1]=4 695 B14R1.1025 CCC(=O)CSCc1cccc(C)c1 Amb32682984 [0,1,0,0,0,0|2,0,0]=3 696 B14R1.1025 CNC(=O)CCCc1cccc(N)c1 Amb17336480 [0,1,0,0,0,0|1,0,0]=2 697 B14R1.1025 CNC(=O)CCNc1cccc(Br)c1 Amb27765027 [0,1,0,0,0,0|2,0,0]=3 698 B14R1.1025 CNC(=O)CCNc1cccc(Cl)n1 Amb27493747 [0,1,0,0,0,0|3,0,0]=4 699 B14R1.1025 CNC(=O)CCNc1cccc(N)c1 Amb19079410 [0,1,0,0,0,0|2,0,0]=3 700 B14R1.1025 CNC(=O)CCNc1cccc(N)n1 Amb27182148 [0,1,0,0,0,0|3,0,0]=4 701 B14R1.1025 CNC(=O)CCNc1ccnc(F)c1 Amb27215201 [0,1,0,0,0,0|3,0,0]=4 702 B14R1.1025 CNC(=O)CCNc1cncc(Br)c1 Amb27244647 [0,1,0,0,0,0|3,0,0]=4 703 B14R1.1025 CNC(=O)CCNc1cncc(Cl)c1 Amb29864889 [0,1,0,0,0,0|3,0,0]=4 704 B14R1.1025 CNC(=O)CCNc1cncc(N)c1 Amb27263460 [0,1,0,0,0,0|3,0,0]=4 705 B14R1.1025 CNC(=O)CCOc1cccc(Br)c1 Amb17266148 [0,1,0,0,0,0|2,0,0]=3 706 B14R1.1025 CNC(=O)CCOc1cccc(N)c1 Amb17235929 [0,1,0,0,0,0|2,0,0]=3 707 B14R1.1025 CNC(=O)NCCc1cccc(C)n1 Amb30017833 [0,1,0,0,0,0|3,0,0]=4 708 B14R1.1025 CNC(=O)NCCc1cccc(F)c1 Amb25257022 [0,1,0,0,0,0|2,0,0]=3 709 B14R1.1025 COC(=O)C#CCc1cccc(Cl)c1 Amb27749372 [0,1,0,0,0,0|0,0,2]=3 710 B14R1.1025 COC(=O)CCCc1cc(C)ccn1 Amb32429834 [0,1,0,0,0,0|1,0,0]=2 711 B14R1.1025 COC(=O)CCCc1cccc(C)n1 Amb32429829 [0,1,0,0,0,0|1,0,0]=2 712 B14R1.1025 COC(=O)CCCc1cccc(N)c1 Amb33726854 [0,1,0,0,0,0|0,0,0]=1 713 B14R1.1025 COC(=O)CCNc1cccc(Br)c1 Amb9026327 [0,1,0,0,0,0|1,0,0]=2 714 B14R1.1025 COC(=O)CCNc1cccc(C)c1 Amb9026184 [0,1,0,0,0,0|1,0,0]=2 715 B14R1.1025 COC(=O)CCNc1cccc(C)n1 Amb19051545 [0,1,0,0,0,0|2,0,0]=3 716 B14R1.1025 COC(=O)CCNc1cccc(Cl)c1 Amb9026318 [0,1,0,0,0,0|1,0,0]=2 717 B14R1.1025 COC(=O)CCNc1cccc(F)c1 Amb33548149 [0,1,0,0,0,0|1,0,0]=2 718 B14R1.1025 COC(=O)CCOC1=CC(=O)NN=C1 Amb22301614 [0,1,0,0,0,0|3,0,0]=4 719 B14R1.1025 COC(=O)CCOc1cc(Cl)ccn1 Amb22301620 [0,1,0,0,0,0|2,0,0]=3 720 B14R1.1025 COC(=O)CCOc1cnnc(Cl)c1 Amb22301582 [0,1,0,0,0,0|3,0,0]=4 721 B14R1.1025 COC(=O)CCSc1cc(Cl)ccn1 Amb22301623 [0,1,0,0,0,0|2,0,0]=3 722 B14R1.1025 COC(=O)CCSc1cccc(Cl)n1 Amb33328843 [0,1,0,0,0,0|2,0,0]=3 723 B14R1.1025 COC(=O)CCSc1cccc(N)c1 Amb22058830 [0,1,0,0,0,0|1,0,0]=2 724 B14R1.1025 COC(=O)CNCc1cccc(Br)c1 Amb28600446 [0,1,0,0,0,0|1,0,0]=2 725 B14R1.1025 COC(=O)CNCc1cccc(C)c1 Amb6686952 [0,1,0,0,0,0|1,0,0]=2 726 B14R1.1025 COC(=O)CNCc1cccc(F)c1 Amb10609869 [0,1,0,0,0,0|1,0,0]=2 727 B14R1.1025 COC(=O)CNCc1cccc(F)c1 Amb6686943 [0,1,0,0,0,0|1,0,0]=2 728 B14R1.1025 COC(=O)CSCc1cccc(N)c1 Amb9482322 [0,1,0,0,0,0|1,0,0]=2 729 B14R1.1025 COC(=O)\C=C\Nc1cccc(F)c1 Amb27495123 [0,1,0,0,0,0|1,0,2]=4 730 B14R1.1025 Cc1cccc(CCNC(=O)CCl)c1 Amb17322980 [0,1,0,0,0,0|3,0,0]=4 731 B14R1.1025 Cc1cccc(CCNC(=O)CN)c1 Amb17401667 [0,1,0,0,0,0|3,0,0]=4 732 B14R1.1025 Cc1cccc(CCNC(=O)CO)c1 Amb17401772 [0,1,0,0,0,0|3,0,0]=4 733 B14R1.1025 Cc1cccc(CCNC(=O)NN)c1 Amb19061784 [0,1,0,0,0,0|3,0,0]=4 734 B14R1.1025 Cc1cccc(CSCC(=O)NN)c1 Amb6854411 [0,1,0,0,0,0|3,0,0]=4 735 B14R1.1025 Cc1cccc(OCCC(=O)NO)c1 Amb33532700 [0,1,0,0,0,0|3,0,0]=4 736 B14R1.1025 NCC(=O)CCOc1cccc(F)c1 Amb33417792 [0,1,0,0,0,0|3,0,0]=4 737 B14R1.1025 NCC(=O)NCCc1cccc(Br)c1 Amb17414918 [0,1,0,0,0,0|3,0,0]=4 738 B14R1.1025 NCC(=O)NCCc1cccc(Cl)c1 Amb5783182 [0,1,0,0,0,0|3,0,0]=4 739 B14R1.1025 NCC(=O)NCCc1cccc(F)c1 Amb9429198 [0,1,0,0,0,0|3,0,0]=4 740 B14R1.1025 NNC(=O)CSCc1cccc(Cl)c1 Amb6550904 [0,1,0,0,0,0|3,0,0]=4 741 B14R1.1025 NNC(=O)CSCc1cccc(F)c1 Amb6854414 [0,1,0,0,0,0|3,0,0]=4 742 B14R1.1025 O=C(CCl)CCOc1cccc(F)c1 Amb17140999 [0,1,0,0,0,0|3,0,0]=4 743 B14R1.1025 O=C(CCl)NCCc1cccc(Br)c1 Amb17421888 [0,1,0,0,0,0|3,0,0]=4 744 B14R1.1025 O=C(CCl)NCCc1cccc(Cl)c1 Amb1676616 [0,1,0,0,0,0|3,0,0]=4 745 B14R1.1025 O=C(CCl)NCCc1cccc(F)c1 Amb9429159 [0,1,0,0,0,0|3,0,0]=4 746 B14R1.1025 O=C(CO)NCCc1cccc(Br)c1 Amb17415247 [0,1,0,0,0,0|3,0,0]=4 747 B14R1.1025 O=C(CO)NCCc1cccc(Cl)c1 Amb9421454 [0,1,0,0,0,0|3,0,0]=4 748 B14R1.6449 C=C(C)C(=O)CNCc1ccccc1 Amb33307880 [0,1,0,0,0,0|2,0,0]=3 749 B14R1.6449 C=C(COCc1ccccc1)C(C)O Amb27605356 [0,1,0,0,0,0|3,0,0]=4 750 B14R1.6449 C=C(COCc1ccccc1)[C@@H](C)O Amb28065829 [0,1,0,0,0,0|3,0,0]=4 751 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 Amb17401500 [0,1,0,0,0,0|2,0,0]=3 752 B14R1.6449 CC(Br)C(=O)NCCc1ccccc1 Amb6364802 [0,1,0,0,0,0|2,0,0]=3 753 B14R1.6449 CC(Br)C(=O)NCCc1ccncc1 Amb17322874 [0,1,0,0,0,0|3,0,0]=4 754 B14R1.6449 CC(C)C(=O)CNCc1ccccc1 Amb28368450 [0,1,0,0,0,0|2,0,0]=3 755 B14R1.6449 CC(C)C(=O)COCc1ccccc1 Amb27490892 [0,1,0,0,0,0|2,0,0]=3 756 B14R1.6449 CC(C)C(=O)CSCc1ccccc1 Amb32682957 [0,1,0,0,0,0|2,0,0]=3 757 B14R1.6449 CC(C)C(=O)NOCc1ccccc1 Amb10699573 [0,1,0,0,0,0|3,0,0]=4 758 B14R1.6449 CC(Cl)C(=O)NCCc1ccccc1 Amb9746403 [0,1,0,0,0,0|2,0,0]=3 759 B14R1.6449 CC(Cl)C(=O)NCCc1ccccn1 Amb6259731 [0,1,0,0,0,0|3,0,0]=4 760 B14R1.6449 CC(Cl)C(=O)NOCc1ccccc1 Amb27419439 [0,1,0,0,0,0|3,0,0]=4 761 B14R1.6449 CC(N)C(=O)NCCc1ccccc1 Amb6276617 [0,1,0,0,0,0|2,0,0]=3 762 B14R1.6449 CC(O)C(=O)NCCc1ccccc1 Amb17401758 [0,1,0,0,0,0|2,0,0]=3 763 B14R1.6449 CC(O)C(=O)NCCc1ccncc1 Amb32651848 [0,1,0,0,0,0|3,0,0]=4 764 B14R1.6449 CN(C)C(=N)COCc1ccccc1 Amb27455240 [0,1,0,0,0,0|3,0,0]=4 765 B14R1.6449 CN(C)C(=O)CNCc1ccccc1 Amb3092543 [0,1,0,0,0,0|2,0,0]=3 766 B14R1.6449 CN(C)C(=O)CNCc1ccccn1 Amb6713288 [0,1,0,0,0,0|3,0,0]=4 767 B14R1.6449 CN(C)C(=O)CNCc1cccnc1 Amb6629603 [0,1,0,0,0,0|3,0,0]=4 768 B14R1.6449 CN(C)C(=O)CNCc1ccncc1 Amb6648075 [0,1,0,0,0,0|3,0,0]=4 769 B14R1.6449 CN(C)C(=O)COCc1ccccc1 Amb28350564 [0,1,0,0,0,0|2,0,0]=3 770 B14R1.6449 CN(C)C(=O)C\C=C\c1ccccc1 Amb24110298 [0,1,0,0,0,0|1,0,2]=4 771 B14R1.6449 CN(C)C(=S)CCCc1ccccc1 Amb24072816 [0,1,0,0,0,0|1,1,0]=3 772 B14R1.6449 C[C@@H](N)C(=O)NCCc1ccccc1 Amb18014657 [0,1,0,0,0,0|2,0,0]=3 773 B14R1.6449 C[C@@H](N)C(=O)NCCc1cccnc1 Amb18527767 [0,1,0,0,0,0|3,0,0]=4 774 B14R1.6449 C[C@H](N)C(=O)NCCc1ccccc1 Amb5783224 [0,1,0,0,0,0|2,0,0]=3 775 B14R1.6449 C[C@H](O)C(=O)COCc1ccccc1 Amb27405244 [0,1,0,0,0,0|2,0,0]=3 776 B14R1.6449 O=C(CCCc1ccccc1)C(F)F Amb35744490 [0,1,0,0,0,0|2,0,0]=3 777 B14R1.6449 O=C(O)C(=O)NCCc1ccccc1 Amb9303971 [0,1,0,0,0,0|3,0,0]=4 778 B14R2.8 CNC1=NC(c2ccccc2)CS1 Amb28321658 [0,0,0,1,0,0|3,0,0]=4 779 B14R2.8 CNC1CCC(c2ccccc2)C1 Amb18065568 [0,0,0,1,0,0|2,0,1]=4 780 B14R2.8 COC1=NC(c2ccccc2)CN1 Amb27827838 [0,0,0,1,0,0|2,0,0]=3 781 B14R2.8 CSC1=NC(c2ccccc2)CN1 Amb27851456 [0,0,0,1,0,0|2,1,0]=4 782 B14R2.8 O\N=C1\CCC(c2ccccc2)C1 Amb27226256 [0,0,0,1,0,0|3,0,0]=4 783 B14R2.19 BrC1CCC(Cc2ccccc2)C1 Amb25345569 [0,0,0,1,0,0|2,0,1]=4 784 B14R2.19 C=C1CCN(Cc2ccccc2)C1 Amb19334016 [0,0,0,1,0,0|3,0,0]=4 785 B14R2.19 CC1=NC(Cc2ccccc2)CO1 Amb26964500 [0,0,0,1,0,0|2,0,0]=3 786 B14R2.19 CC1CC(Cc2ccccc2)CN1 Amb9777222 [0,0,0,1,0,0|2,0,1]=4 787 B14R2.19 CC1CC(Nc2ccccc2)CO1 Amb35679125 [0,0,0,1,0,0|2,0,1]=4 788 B14R2.19 ClC1CCC(Cc2ccccc2)C1 Amb27443400 [0,0,0,1,0,0|2,0,1]=4 789 B14R2.19 NC1=NC(Cc2ccccc2)CO1 Amb23449444 [0,0,0,1,0,0|2,0,0]=3 790 B14R2.19 NC1=NC(Cc2ccccc2)CS1 Amb27400638 [0,0,0,1,0,0|2,1,0]=4 791 B14R2.19 NC1=NCC(Cc2ccccc2)N1 Amb27800741 [0,0,0,1,0,0|3,0,0]=4 792 B14R2.19 NC1=N[C@H](Cc2ccccc2)CO1 Amb27464486 [0,0,0,1,0,0|2,0,0]=3 793 B14R2.19 NC1CCC(Cc2ccccc2)C1 Amb25337996 [0,0,0,1,0,0|2,0,1]=4 794 B14R2.19 O=C1C=C(Cc2ccccc2)CC1 Amb25900544 [0,0,0,1,0,0|1,0,2]=4 795 B14R2.19 O=C1C=C(Sc2ccccc2)CO1 Amb21928058 [0,0,0,1,0,0|1,0,2]=4 796 B14R2.19 O=C1CC(Cc2ccccc2)=NO1 Amb1099037 [0,0,0,1,0,0|1,0,1]=3 797 B14R2.19 O=C1CC(Cc2ccccc2)CN1 Amb10608007 [0,0,0,1,0,0|1,0,0]=2 798 B14R2.19 O=C1CC(Cc2ccccc2)CO1 Amb8487117 [0,0,0,1,0,0|0,0,0]=1 799 B14R2.19 O=C1CC(Cc2ccccc2)NN1 Amb29862360 [0,0,0,1,0,0|2,0,0]=3 800 B14R2.19 O=C1CC(Cc2cccnc2)CN1 Amb27412618 [0,0,0,1,0,0|2,0,0]=3 801 B14R2.19 O=C1CC(Nc2ccccc2)CO1 Amb27415556 [0,0,0,1,0,0|1,0,0]=2 802 B14R2.19 O=C1CCC(Cc2ccccc2)C1 Amb24455173 [0,0,0,1,0,0|1,0,0]=2 803 B14R2.19 O=C1CCC(Cc2ccccc2)N1 Amb6404055 [0,0,0,1,0,0|2,0,0]=3 804 B14R2.19 O=C1CCC(Cc2ccccc2)O1 Amb20669272 [0,0,0,1,0,0|2,0,0]=3 805 B14R2.19 O=C1CCC(Cc2ccncc2)N1 Amb27972750 [0,0,0,1,0,0|3,0,0]=4 806 B14R2.19 O=C1CCC(Nc2ccccc2)C1 Amb28137731 [0,0,0,1,0,0|2,0,0]=3 807 B14R2.19 O=C1CCC(Nc2ccccc2)N1 Amb27816227 [0,0,0,1,0,0|3,0,0]=4 808 B14R2.19 O=C1CCC(Sc2ccccc2)C1 Amb25815229 [0,0,0,1,0,0|2,0,0]=3 809 B14R2.19 O=C1CCC(Sc2ccccc2)N1 Amb27799846 [0,0,0,1,0,0|3,0,0]=4 810 B14R2.19 O=C1CCC(Sc2ccncc2)C1 Amb27416047 [0,0,0,1,0,0|3,0,0]=4 811 B14R2.19 O=C1CCN(Cc2ccccc2)C1 Amb1680105 [0,0,0,1,0,0|2,0,0]=3 812 B14R2.19 O=C1CCN(Cc2ccccc2)C1 Amb18048933 [0,0,0,1,0,0|2,0,0]=3 813 B14R2.19 O=C1CCN(Cc2ccccc2)N1 Amb2423894 [0,0,0,1,0,0|3,0,0]=4 814 B14R2.19 O=C1CN(Cc2ccccc2)CO1 Amb27861590 [0,0,0,1,0,0|1,0,0]=2 815 B14R2.19 O=C1COC(Cc2ccccc2)C1 Amb35718934 [0,0,0,1,0,0|2,0,0]=3 816 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CN1 Amb27777300 [0,0,0,1,0,0|1,0,0]=2 817 B14R2.19 O=C1NC(Cc2ccccc2)CO1 Amb9809273 [0,0,0,1,0,0|1,0,0]=2 818 B14R2.19 O=C1NC(Cc2ccccc2)CS1 Amb27618346 [0,0,0,1,0,0|1,1,0]=3 819 B14R2.19 O=C1NC(Cc2ccncc2)CO1 Amb27607810 [0,0,0,1,0,0|2,0,0]=3 820 B14R2.19 O=C1NCC(Cc2ccccc2)N1 Amb18061673 [0,0,0,1,0,0|2,0,0]=3 821 B14R2.19 O=C1NCC(Cc2ccccc2)O1 Amb18061675 [0,0,0,1,0,0|2,0,0]=3 822 B14R2.19 O=C1NC[C@H](Cc2ccccc2)N1 Amb27772403 [0,0,0,1,0,0|2,0,0]=3 823 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CO1 Amb2725669 [0,0,0,1,0,0|1,0,0]=2 824 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CS1 Amb19887642 [0,0,0,1,0,0|1,1,0]=3 825 B14R2.19 O=C1N[C@H](Cc2ccccc2)CO1 Amb6357181 [0,0,0,1,0,0|1,0,0]=2 826 B14R2.19 O=C1N[C@H](Cc2ccccc2)CS1 Amb19888420 [0,0,0,1,0,0|1,1,0]=3 827 B14R2.19 O=C1N\C(=C/c2ccccc2)CO1 Amb27815226 [0,0,0,1,0,0|1,0,2]=4 828 B14R2.19 O=C1N\C(=C\c2ccccc2)CO1 Amb27981988 [0,0,0,1,0,0|1,0,2]=4 829 B14R2.19 O=C1OCC(Oc2ccccn2)O1 Amb28182698 [0,0,0,1,0,0|3,0,0]=4 830 B14R2.19 OC1CC(Cc2ccccc2)CO1 Amb22752560 [0,0,0,1,0,0|0,0,2]=3 831 B14R2.19 OC1CCC(Cc2ccccc2)C1 Amb27664443 [0,0,0,1,0,0|1,0,2]=4 832 B14R2.19 S=C1NC(Cc2ccccc2)CO1 Amb25938312 [0,0,0,1,0,0|1,1,0]=3 833 B14R2.19 S=C1NC(Cc2ccccc2)CS1 Amb24079058 [0,0,0,1,0,0|1,2,0]=4 834 B14R2.19 S=C1NCC(Cc2ccccc2)S1 Amb27798328 [0,0,0,1,0,0|2,1,0]=4 835 B14R2.19 S=C1N[C@@H](Cc2ccccc2)CO1 Amb8629174 [0,0,0,1,0,0|1,1,0]=3 836 B14R2.19 S=C1N[C@@H](Cc2ccccc2)CS1 Amb8629263 [0,0,0,1,0,0|1,2,0]=4 837 B14R2.19 S=C1N[C@H](Cc2ccccc2)CO1 Amb8629175 [0,0,0,1,0,0|1,1,0]=3 838 B14R2.19 S=C1N[C@H](Cc2ccccc2)CS1 Amb8629264 [0,0,0,1,0,0|1,2,0]=4 839 B14R2.31 O=C1CCC1C#Cc2ccccc2 Amb28201043 [0,0,0,1,0,0|1,0,2]=4 840 B14R2.31 O=C1CCC1OCc2ccccc2 Amb22896544 [0,0,0,1,0,0|2,0,0]=3 841 B14R2.31 O=C1CC[C@@H]1OCc2ccccc2 Amb24494962 [0,0,0,1,0,0|2,0,0]=3 842 B14R2.31 O=C1CC[C@H]1OCc2ccccc2 Amb27972934 [0,0,0,1,0,0|2,0,0]=3 843 B14R2.31 O=C1NCC1OCc2ccccc2 Amb27969209 [0,0,0,1,0,0|2,0,0]=3 844 B14R2.31 OC1CCC1CCc2ccccc2 Amb32944290 [0,0,0,1,0,0|1,0,2]=4 845 B14R2.68 BrC1CCC(c2ccccc2)CC1 Amb9190949 [0,0,0,1,0,0|2,0,1]=4 846 B14R2.68 Br[C@H]1CC[C@@H](c2ccccc2)CC1 Amb32679414 [0,0,0,1,0,0|2,0,1]=4 847 B14R2.68 CC1CCC(c2ccccc2)CC1 Amb27148176 [0,0,0,1,0,0|2,0,1]=4 848 B14R2.68 CC1CCC(c2ccccc2)CN1 Amb18065574 [0,0,0,1,0,0|2,0,1]=4 849 B14R2.68 CC1CNC(c2ccccc2)CO1 Amb18065683 [0,0,0,1,0,0|2,0,1]=4 850 B14R2.68 CC1CN[C@H](c2ccccc2)CO1 Amb31291165 [0,0,0,1,0,0|2,0,1]=4 851 B14R2.68 CN1CCC(c2ccccc2)CC1 Amb24064815 [0,0,0,1,0,0|3,0,0]=4 852 B14R2.68 C[C@@H]1CN[C@H](c2ccccc2)CO1 Amb27201665 [0,0,0,1,0,0|2,0,1]=4 853 B14R2.68 C[C@@H]1CN[C@H](c2ccccc2)CO1 Amb30586555 [0,0,0,1,0,0|2,0,1]=4 854 B14R2.68 C[C@H]1CN[C@@H](c2ccccc2)CO1 Amb33871616 [0,0,0,1,0,0|2,0,1]=4 855 B14R2.68 ClC1CCC(c2ccccc2)CC1 Amb7766839 [0,0,0,1,0,0|2,0,1]=4 856 B14R2.68 NC1=NCC(c2ccccc2)CC1 Amb27657666 [0,0,0,1,0,0|2,0,0]=3 857 B14R2.68 NC1=NCC(c2ccccc2)CN1 Amb18127515 [0,0,0,1,0,0|3,0,0]=4 858 B14R2.68 NC1=NCC(c2ccccc2)CN1 Amb35751146 [0,0,0,1,0,0|3,0,0]=4 859 B14R2.68 NC1CCC(c2ccccc2)CC1 Amb1120391 [0,0,0,1,0,0|2,0,1]=4 860 B14R2.68 N[C@H]1CC[C@@H](c2ccccc2)CC1 Amb27444642 [0,0,0,1,0,0|2,0,1]=4 861 B14R2.68 N[C@H]1CC[C@H](c2ccccc2)CC1 Amb27415602 [0,0,0,1,0,0|2,0,1]=4 862 B14R2.68 O=C1C=CC(c2ccccc2)CC1 Amb28131957 [0,0,0,1,0,0|1,0,1]=3 863 B14R2.68 O=C1C=CC(c2ccccc2)OC1 Amb27587340 [0,0,0,1,0,0|2,0,1]=4 864 B14R2.68 O=C1C=C[C@@H](c2ccccc2)CC1 Amb27772525 [0,0,0,1,0,0|1,0,1]=3 865 B14R2.68 O=C1CC=C(c2ccccc2)CC1 Amb34104182 [0,0,0,1,0,0|1,0,2]=4 866 B14R2.68 O=C1CCC(c2ccccc2)=NN1 Amb1017246 [0,0,0,1,0,0|2,0,1]=4 867 B14R2.68 O=C1CCC(c2ccccc2)CC1 Amb1208394 [0,0,0,1,0,0|1,0,0]=2 868 B14R2.68 O=C1CCC(c2ccccc2)CN1 Amb17400501 [0,0,0,1,0,0|1,0,0]=2 869 B14R2.68 O=C1CCC(c2ccccc2)CO1 Amb28122923 [0,0,0,1,0,0|0,0,0]=1 870 B14R2.68 O=C1CCC(c2ccccc2)NN1 Amb27185822 [0,0,0,1,0,0|2,0,0]=3 871 B14R2.68 O=C1CCC(c2ccccn2)CC1 Amb18065557 [0,0,0,1,0,0|2,0,0]=3 872 B14R2.68 O=C1CCC(c2cccnc2)CC1 Amb18065558 [0,0,0,1,0,0|2,0,0]=3 873 B14R2.68 O=C1CCC(c2ccncc2)CC1 Amb18065559 [0,0,0,1,0,0|2,0,0]=3 874 B14R2.68 O=C1CCN(c2ccccc2)CC1 Amb6280694 [0,0,0,1,0,0|2,0,0]=3 875 B14R2.68 O=C1CCN(c2ccccn2)CC1 Amb33532725 [0,0,0,1,0,0|3,0,0]=4 876 B14R2.68 O=C1CCN(c2ccncc2)CC1 Amb6281478 [0,0,0,1,0,0|3,0,0]=4 877 B14R2.68 O=C1CNC(c2ccccc2)=NO1 Amb28398006 [0,0,0,1,0,0|2,0,1]=4 878 B14R2.68 O=C1CNC(c2ccccc2)CN1 Amb23452781 [0,0,0,1,0,0|2,0,0]=3 879 B14R2.68 O=C1CNC(c2ccccn2)CN1 Amb28292391 [0,0,0,1,0,0|3,0,0]=4 880 B14R2.68 O=C1CNC(c2cccnc2)CN1 Amb23452782 [0,0,0,1,0,0|3,0,0]=4 881 B14R2.68 O=C1CNC(c2ccncc2)CN1 Amb23452783 [0,0,0,1,0,0|3,0,0]=4 882 B14R2.68 O=C1CN[C@@H](c2ccccc2)CO1 Amb24052958 [0,0,0,1,0,0|1,0,0]=2 883 B14R2.68 O=C1CN[C@@H](c2ccccc2)CO1 Amb8629097 [0,0,0,1,0,0|1,0,0]=2 884 B14R2.68 O=C1CN[C@H](c2ccccc2)CN1 Amb27657425 [0,0,0,1,0,0|2,0,0]=3 885 B14R2.68 O=C1CN[C@H](c2ccccc2)CO1 Amb22748846 [0,0,0,1,0,0|1,0,0]=2 886 B14R2.68 O=C1CN[C@H](c2ccccc2)CO1 Amb8629096 [0,0,0,1,0,0|1,0,0]=2 887 B14R2.68 O=C1COC(c2ccccc2)CN1 Amb18224547 [0,0,0,1,0,0|2,0,0]=3 888 B14R2.68 O=C1COC(c2ccccc2)OC1 Amb27668915 [0,0,0,1,0,0|3,0,0]=4 889 B14R2.68 O=C1COC(c2ccccn2)CN1 Amb27760040 [0,0,0,1,0,0|3,0,0]=4 890 B14R2.68 O=C1COC(c2ccncc2)CN1 Amb27461377 [0,0,0,1,0,0|3,0,0]=4 891 B14R2.68 O=C1CO[C@@H](c2ccccc2)CN1 Amb28077004 [0,0,0,1,0,0|2,0,0]=3 892 B14R2.68 O=C1CSC(c2ccccc2)CN1 Amb25897921 [0,0,0,1,0,0|2,0,0]=3 893 B14R2.68 O=C1CSC(c2ccccc2)CO1 Amb28289733 [0,0,0,1,0,0|1,0,0]=2 894 B14R2.68 O=C1NCC(c2ccccc2)CN1 Amb25295398 [0,0,0,1,0,0|2,0,0]=3 895 B14R2.68 O=C1NCC(c2ccccc2)CO1 Amb28208260 [0,0,0,1,0,0|1,0,0]=2 896 B14R2.68 O=C1NCC(c2ccccn2)CN1 Amb26489324 [0,0,0,1,0,0|3,0,0]=4 897 B14R2.68 O=C1NCC(c2cccnc2)CN1 Amb25776935 [0,0,0,1,0,0|3,0,0]=4 898 B14R2.68 O=C1NCC(c2ccncc2)CN1 Amb27945923 [0,0,0,1,0,0|3,0,0]=4 899 B14R2.68 O=C1NN=C(c2ccccc2)CO1 Amb24715861 [0,0,0,1,0,0|2,0,1]=4 900 B14R2.68 OC1=NCC(c2ccccc2)CC1 Amb4434103 [0,0,0,1,0,0|1,0,1]=3 901 B14R2.68 OC1CCC(c2ccccc2)CC1 Amb1786614 [0,0,0,1,0,0|1,0,2]=4 902 B14R2.68 O[C@H]1CC[C@H](c2ccccc2)CC1 Amb9787013 [0,0,0,1,0,0|1,0,2]=4 903 B14R2.68 SC1CCC(c2ccccc2)CC1 Amb7784767 [0,0,0,1,0,0|1,1,1]=4 904 B14R2.87 COC1CC1CNc2ccccc2 Amb35671317 [0,0,0,1,0,0|2,0,1]=4 905 B14R2.90 COC1CC(Nc2ccccc2)C1 Amb27167172 [0,0,0,1,0,0|2,0,1]=4 906 B14R2.90 COC1CN(Cc2ccccc2)C1 Amb27802439 [0,0,0,1,0,0|2,0,1]=4 907 B14R2.95 C#CC(=O)N1CCc2ccccc21 Amb28248698 [0,0,0,1,0,0|2,0,1]=4 908 B14R2.95 C=C(CBr)C1CCc2ccccc21 Amb33431327 [0,0,0,1,0,0|3,0,0]=4 909 B14R2.95 C=C(CN)C1CCc2ccccc21 Amb33145107 [0,0,0,1,0,0|3,0,0]=4 910 B14R2.95 C=CC(=O)C1CCc2ccccc21 Amb25133333 [0,0,0,1,0,0|1,0,1]=3 911 B14R2.95 C=CC(=O)C1COc2ccccc21 Amb27450655 [0,0,0,1,0,0|2,0,1]=4 912 B14R2.95 C=CC(=O)N1CCc2ccccc21 Amb9480444 [0,0,0,1,0,0|2,0,1]=4 913 B14R2.95 CC(ON)C1CCc2ccccc21 Amb33145735 [0,0,0,1,0,0|2,0,1]=4 914 B14R2.95 CCC(=O)C1COc2ccccc21 Amb27780720 [0,0,0,1,0,0|2,0,0]=3 915 B14R2.95 CCC(=O)N1CCc2ccccc21 Amb1672516 [0,0,0,1,0,0|2,0,0]=3 916 B14R2.95 CCC(=O)N1CCc2cccnc21 Amb28063734 [0,0,0,1,0,0|3,0,0]=4 917 B14R2.95 CCC(=O)N1CCc2cnccc21 Amb28064855 [0,0,0,1,0,0|3,0,0]=4 918 B14R2.95 CCC(Cl)C1CCc2ccccc21 Amb27485302 [0,0,0,1,0,0|2,0,1]=4 919 B14R2.95 CCC(N)C1CCc2ccccc21 Amb27590750 [0,0,0,1,0,0|2,0,1]=4 920 B14R2.95 CCC(O)C1CCc2ccccc21 Amb27179944 [0,0,0,1,0,0|1,0,2]=4 921 B14R2.95 CC[C@H](O)C1CCc2ccccc21 Amb27619104 [0,0,0,1,0,0|1,0,2]=4 922 B14R2.95 CNC(=N)C1CCc2ccccc21 Amb27412920 [0,0,0,1,0,0|2,0,0]=3 923 B14R2.95 CNC(=O)C1CCc2ccccc21 Amb24658312 [0,0,0,1,0,0|1,0,0]=2 924 B14R2.95 CNC(=O)N1CCc2cnccc21 Amb27388509 [0,0,0,1,0,0|3,0,0]=4 925 B14R2.95 CNC(C)C1CCc2ccccc21 Amb27593592 [0,0,0,1,0,0|2,0,1]=4 926 B14R2.95 COC(=O)C1=CCc2ccccc21 Amb2691225 [0,0,0,1,0,0|0,0,2]=3 927 B14R2.95 COC(=O)C1C=Cc2ccncc21 Amb27165289 [0,0,0,1,0,0|1,0,2]=4 928 B14R2.95 COC(=O)C1CCc2ccccc21 Amb10563171 [0,0,0,1,0,0|0,0,0]=1 929 B14R2.95 COC(=O)C1CCc2cccnc21 Amb27229886 [0,0,0,1,0,0|1,0,0]=2 930 B14R2.95 COC(=O)C1CCc2ccncc21 Amb27180122 [0,0,0,1,0,0|1,0,0]=2 931 B14R2.95 COC(=O)C1CCc2ncccc21 Amb25262859 [0,0,0,1,0,0|1,0,0]=2 932 B14R2.95 COC(=O)C1CCc2ncncc21 Amb23596897 [0,0,0,1,0,0|2,0,0]=3 933 B14R2.95 COC(=O)C1CNc2ccccc21 Amb19320764 [0,0,0,1,0,0|1,0,0]=2 934 B14R2.95 COC(=O)C1CNc2ccccc21 Amb22234034 [0,0,0,1,0,0|1,0,0]=2 935 B14R2.95 COC(=O)C1COc2ccccc21 Amb22059417 [0,0,0,1,0,0|1,0,0]=2 936 B14R2.95 COC(=O)C1CSc2ccccc21 Amb24489808 [0,0,0,1,0,0|1,0,0]=2 937 B14R2.95 COC(=O)C1NCc2ncncc21 Amb31156673 [0,0,0,1,0,0|3,0,0]=4 938 B14R2.95 COC(=O)C1NCc2ncncc21 Amb32683413 [0,0,0,1,0,0|3,0,0]=4 939 B14R2.95 COC(=O)N1CCc2ccccc21 Amb6317361 [0,0,0,1,0,0|1,0,0]=2 940 B14R2.95 COC(=O)N1CCc2cnccc21 Amb28320214 [0,0,0,1,0,0|2,0,0]=3 941 B14R2.95 COC(=O)[C@H]1CNc2ccccc21 Amb28140145 [0,0,0,1,0,0|1,0,0]=2 942 B14R2.95 COC(=O)c1coc2ccccc12 Amb22269388 [0,0,0,1,0,0|1,0,2]=4 943 B14R2.95 COC(=O)c1csc2ccccc12 Amb18330285 [0,0,0,1,0,0|1,0,2]=4 944 B14R2.95 COC(=O)c1noc2ccccc12 Amb23437527 [0,0,0,1,0,0|2,0,1]=4 945 B14R2.95 COC(=O)c1snc2ccccc12 Amb27851664 [0,0,0,1,0,0|2,0,1]=4 946 B14R2.95 NCC(=O)C1CCc2ccccc21 Amb33146124 [0,0,0,1,0,0|2,0,0]=3 947 B14R2.95 NCC(=O)C1CNc2ccccc21 Amb27442005 [0,0,0,1,0,0|3,0,0]=4 948 B14R2.95 NCC(=O)N1CCc2ccccc21 Amb13952606 [0,0,0,1,0,0|3,0,0]=4 949 B14R2.95 NCC(=O)N1CCc2ccccc21 Amb5783074 [0,0,0,1,0,0|3,0,0]=4 950 B14R2.95 NNC(=O)C1CSc2ccccc21 Amb28240804 [0,0,0,1,0,0|3,0,0]=4 951 B14R2.95 N\C(=N\O)C1CCc2ccccc21 Amb24366744 [0,0,0,1,0,0|3,0,0]=4 952 B14R2.95 O=C(CBr)C1NCc2ccccc21 Amb25300659 [0,0,0,1,0,0|3,0,0]=4 953 B14R2.95 O=C(CBr)N1CCc2ccccc21 Amb2089065 [0,0,0,1,0,0|3,0,0]=4 954 B14R2.95 O=C(CCl)C1NCc2ccccc21 Amb26559781 [0,0,0,1,0,0|3,0,0]=4 955 B14R2.95 O=C(CCl)N1CCc2ccccc21 Amb6334866 [0,0,0,1,0,0|3,0,0]=4 956 B14R2.95 O=C(CI)N1CCc2ccccc21 Amb28243724 [0,0,0,1,0,0|3,0,0]=4 957 B14R2.95 O=C(CO)C1CCc2ccccc21 Amb27772744 [0,0,0,1,0,0|2,0,0]=3 958 B14R2.95 O=C(CO)N1CCc2ccccc21 Amb9421614 [0,0,0,1,0,0|3,0,0]=4 959 B14R2.95 O=C(CS)N1CCc2ccccc21 Amb20413873 [0,0,0,1,0,0|3,0,0]=4 960 B14R2.95 O=C(NO)C1CNc2ccccc21 Amb27226261 [0,0,0,1,0,0|3,0,0]=4 961 B14R2.95 O=C(NO)C1COc2ccccc21 Amb25128026 [0,0,0,1,0,0|3,0,0]=4 962 B14R2.143 COC1=Nc2ccccc2SCC1 Amb33218463 [0,0,0,1,0,0|2,0,0]=3 963 B14R2.143 CSC1=Nc2ccccc2CCN1 Amb28187131 [0,0,0,1,0,0|2,1,0]=4 964 B14R2.143 CSC1=Nc2ccccc2NCC1 Amb27230246 [0,0,0,1,0,0|2,1,0]=4 965 B14R2.143 CSC1=Nc2ccccc2SCC1 Amb27808679 [0,0,0,1,0,0|2,1,0]=4 966 B14R2.143 NNC1=Nc2ccccc2CCC1 Amb28316580 [0,0,0,1,0,0|3,0,0]=4 967 B14R2.143 O\N=C1/CCCc2ccccc2N1 Amb2637714 [0,0,0,1,0,0|3,0,0]=4 968 B14R2.279 C=C1CCCc2ccccc2C1=O Amb28122390 [0,0,0,1,0,0|3,0,0]=4 969 B14R2.279 CC1C(=O)CCOc2ccccc21 Amb27421869 [0,0,0,1,0,0|2,0,0]=3 970 B14R2.279 CC1C(=O)CCSc2ccccc21 Amb28326247 [0,0,0,1,0,0|2,0,0]=3 971 B14R2.279 CN1C(=O)CCCc2ccccc21 Amb6359491 [0,0,0,1,0,0|1,0,0]=2 972 B14R2.279 CN1C(=O)CCNc2ccccc21 Amb18224515 [0,0,0,1,0,0|2,0,0]=3 973 B14R2.279 CN1C(=O)CCOc2ccccc21 Amb17570222 [0,0,0,1,0,0|2,0,0]=3 974 B14R2.279 CN1C(=O)CCSc2ccccc21 Amb4168100 [0,0,0,1,0,0|2,0,0]=3 975 B14R2.279 CN1C(=O)CNCc2ccccc21 Amb27947873 [0,0,0,1,0,0|2,0,0]=3 976 B14R2.279 CN1C(=O)CNCc2ccccc21 Amb32666973 [0,0,0,1,0,0|2,0,0]=3 977 B14R2.279 NC1C(=O)NCCc2ccccc21 Amb10067379 [0,0,0,1,0,0|3,0,0]=4 978 B14R2.280 O=C1CCNc2ccccc2CN1 Amb23403550 [0,0,0,1,0,0|2,0,0]=3 979 B14R2.280 O=C1CCc2ccccc2CCN1 Amb6359613 [0,0,0,1,0,0|2,0,0]=3 980 B14R2.427 CC1C(=O)CN1Cc2ccccc2 Amb28070005 [0,0,0,1,0,0|2,0,0]=3 981 B14R2.427 C[C@@H]1C(=O)N[C@H]1Cc2ccccc2 Amb27623877 [0,0,0,1,0,0|2,0,0]=3 982 B14R2.427 C[C@H]1C(=O)C[C@@H]1Cc2ccccc2 Amb28202308 [0,0,0,1,0,0|1,0,0]=2 983 B14R2.427 C[C@H]1C(=O)N[C@H]1Cc2ccccc2 Amb27203336 [0,0,0,1,0,0|2,0,0]=3 984 B14R2.427 NC1C(=O)NC1Cc2ccccc2 Amb18196732 [0,0,0,1,0,0|3,0,0]=4 985 B14R2.427 O=C1N[C@@H](Cc2ccccc2)[C@H]1O Amb27653339 [0,0,0,1,0,0|3,0,0]=4 986 B14R2.958 CCC(=O)[C@H]1CC1c2ccccc2 Amb28126605 [0,0,0,1,0,0|1,0,0]=2 987 B14R2.958 CC[C@@H](O)[C@@H]1C[C@H]1c2ccccc2 Amb27218654 [0,0,0,1,0,0|1,0,2]=4 988 B14R2.958 CNC(=O)C1CC1c2ccncc2 Amb25132180 [0,0,0,1,0,0|2,0,0]=3 989 B14R2.958 CNC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27255278 [0,0,0,1,0,0|2,0,0]=3 990 B14R2.958 COC(=O)C1CC1c2ccccc2 Amb6740592 [0,0,0,1,0,0|0,0,0]=1 991 B14R2.958 COC(=O)C1CC1c2ccccn2 Amb25957540 [0,0,0,1,0,0|1,0,0]=2 992 B14R2.958 COC(=O)C1CC1c2cccnc2 Amb25852071 [0,0,0,1,0,0|1,0,0]=2 993 B14R2.958 COC(=O)C1N=C1c2ccccc2 Amb22325239 [0,0,0,1,0,0|1,0,1]=3 994 B14R2.958 COC(=O)C1NC1c2ccccc2 Amb33624814 [0,0,0,1,0,0|1,0,0]=2 995 B14R2.958 COC(=O)C1OC1c2ccccc2 Amb3940627 [0,0,0,1,0,0|1,0,0]=2 996 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb24526297 [0,0,0,1,0,0|0,0,0]=1 997 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccn2 Amb24617301 [0,0,0,1,0,0|1,0,0]=2 998 B14R2.958 COC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb27626014 [0,0,0,1,0,0|1,0,0]=2 999 B14R2.958 COC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25961866 [0,0,0,1,0,0|1,0,0]=2 1000 B14R2.958 COC(=O)[C@H]1O[C@H]1c2ccccc2 Amb26612812 [0,0,0,1,0,0|1,0,0]=2 1001 B14R2.958 C\C(=N\O)C1CC1c2ccccc2 Amb29838174 [0,0,0,1,0,0|3,0,0]=4 1002 B14R2.958 NCC(=O)C1CC1c2ccccc2 Amb27811597 [0,0,0,1,0,0|2,0,0]=3 1003 B14R2.958 NNC(=O)C1CC1c2ccccc2 Amb1799991 [0,0,0,1,0,0|2,0,0]=3 1004 B14R2.958 NNC(=O)C1CC1c2cccnc2 Amb27440256 [0,0,0,1,0,0|3,0,0]=4 1005 B14R2.958 NNC(=O)C1CC1c2ccncc2 Amb27217927 [0,0,0,1,0,0|3,0,0]=4 1006 B14R2.958 NNC(=O)C1OC1c2ccccc2 Amb28045849 [0,0,0,1,0,0|3,0,0]=4 1007 B14R2.958 NNC(=O)[C@@H]1CC1c2ccccc2 Amb27758203 [0,0,0,1,0,0|2,0,0]=3 1008 B14R2.958 NNC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb6565396 [0,0,0,1,0,0|2,0,0]=3 1009 B14R2.958 NNC(=O)[C@@H]1C[C@@H]1c2ccccn2 Amb28134843 [0,0,0,1,0,0|3,0,0]=4 1010 B14R2.958 NNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb17939352 [0,0,0,1,0,0|2,0,0]=3 1011 B14R2.958 NNC(=O)[C@@H]1C[C@H]1c2ccccn2 Amb27817847 [0,0,0,1,0,0|3,0,0]=4 1012 B14R2.958 NNC(=O)[C@H]1C[C@@H]1c2ccncc2 Amb27627675 [0,0,0,1,0,0|3,0,0]=4 1013 B14R2.958 NNC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27650747 [0,0,0,1,0,0|3,0,0]=4 1014 B14R2.958 O=C(CBr)[C@@H]1C[C@H]1c2ccccc2 Amb35752595 [0,0,0,1,0,0|2,0,0]=3 1015 B14R2.958 O=C(CCl)C1CC1c2ccccc2 Amb27609156 [0,0,0,1,0,0|2,0,0]=3 1016 B14R2.958 O=C(NO)C1CC1c2ccncc2 Amb27825987 [0,0,0,1,0,0|3,0,0]=4 1017 B14R2.3019 c1ccc(CNCC2CCO2)cc1 Amb27848210 [0,0,0,1,0,0|2,0,1]=4 1018 B14R2.3019 c1ccc(COC[C@H]2CCO2)cc1 Amb27486196 [0,0,0,1,0,0|2,0,1]=4 1019 B14R2.4514 C=C1C(=O)CCC1c2ccccc2 Amb27802593 [0,0,0,1,0,0|1,0,1]=3 1020 B14R2.4514 CC1=C(c2ccccc2)CNC1=O Amb27625681 [0,0,0,1,0,0|2,0,1]=4 1021 B14R2.4514 CC1C(=O)CCC1c2ccccc2 Amb24051457 [0,0,0,1,0,0|1,0,0]=2 1022 B14R2.4514 CC1C(=O)NCC1c2ccccc2 Amb24312552 [0,0,0,1,0,0|2,0,0]=3 1023 B14R2.4514 CC1C(=O)NNC1c2ccccc2 Amb35686094 [0,0,0,1,0,0|3,0,0]=4 1024 B14R2.4514 CC1C(Br)CCC1c2ccccc2 Amb28461113 [0,0,0,1,0,0|2,0,1]=4 1025 B14R2.4514 CC1C(O)CCC1c2ccccc2 Amb27607035 [0,0,0,1,0,0|1,0,2]=4 1026 B14R2.4514 CN1C(=O)CCC1c2ccccn2 Amb10069450 [0,0,0,1,0,0|2,0,0]=3 1027 B14R2.4514 CN1C(=O)CCC1c2ccccn2 Amb24064826 [0,0,0,1,0,0|2,0,0]=3 1028 B14R2.4514 CN1C(=O)CCC1c2cccnc2 Amb10845303 [0,0,0,1,0,0|2,0,0]=3 1029 B14R2.4514 CN1C(=O)CC[C@@H]1c2cccnc2 Amb10071651 [0,0,0,1,0,0|2,0,0]=3 1030 B14R2.4514 CN1C(=O)CC[C@H]1c2cccnc2 Amb536023 [0,0,0,1,0,0|2,0,0]=3 1031 B14R2.4514 CN1C(=O)CNC1c2ccccc2 Amb25964177 [0,0,0,1,0,0|2,0,0]=3 1032 B14R2.4514 CN1C(=O)NCC1c2ccccc2 Amb25218843 [0,0,0,1,0,0|2,0,0]=3 1033 B14R2.4514 CN1C(=O)NCC1c2ccccn2 Amb24718293 [0,0,0,1,0,0|3,0,0]=4 1034 B14R2.4514 CN1C(=O)NCC1c2cccnc2 Amb25689003 [0,0,0,1,0,0|3,0,0]=4 1035 B14R2.4514 CN1C(=O)NCC1c2ccncc2 Amb24672456 [0,0,0,1,0,0|3,0,0]=4 1036 B14R2.4514 CN1C(=O)OC[C@H]1c2ccccc2 Amb28463841 [0,0,0,1,0,0|2,0,0]=3 1037 B14R2.4514 C[C@@H]1C(=O)C=C[C@H]1c2ccccc2 Amb28054304 [0,0,0,1,0,0|1,0,2]=4 1038 B14R2.4514 C[C@@H]1C(=O)NC[C@H]1c2ccccc2 Amb27197156 [0,0,0,1,0,0|2,0,0]=3 1039 B14R2.4514 C[C@H]1C(=O)CC[C@@H]1c2ccccc2 Amb27428256 [0,0,0,1,0,0|1,0,0]=2 1040 B14R2.4514 C[C@H]1[C@H](O)CC[C@H]1c2ccccc2 Amb28321346 [0,0,0,1,0,0|1,0,2]=4 1041 B14R2.4514 NC1C(=O)NCC1c2ccccc2 Amb9777200 [0,0,0,1,0,0|3,0,0]=4 1042 B14R2.4514 N[C@@H]1C(=O)NC[C@@H]1c2ccccc2 Amb27446526 [0,0,0,1,0,0|3,0,0]=4 1043 B14R2.4514 N[C@@H]1C(=O)NC[C@H]1c2ccccc2 Amb28320723 [0,0,0,1,0,0|3,0,0]=4 1044 B14R2.4514 O=C1CCN(c2ccccc2)C1=O Amb18795566 [0,0,0,1,0,0|3,0,0]=4 1045 B14R2.4514 O=C1CNC(c2ccccc2)N1O Amb27415808 [0,0,0,1,0,0|3,0,0]=4 1046 B14R2.4514 O=C1NCC(c2ccccc2)C1=O Amb27455161 [0,0,0,1,0,0|3,0,0]=4 1047 B14R2.4514 O=C1OCC(c2ccccc2)C1O Amb27653185 [0,0,0,1,0,0|3,0,0]=4 1048 B14R2.4881 CC1(CCOc2ccccc2)CO1 Amb33080523 [0,0,0,1,0,0|2,0,1]=4 1049 B14R2.4881 CC1(COCc2ccccc2)CO1 Amb22347502 [0,0,0,1,0,0|2,0,1]=4 1050 B14R2.4881 NC1(CCCc2ccccc2)CC1 Amb18560538 [0,0,0,1,0,0|2,0,1]=4 1051 B14R2.4881 OC1(CCCc2ccccc2)CC1 Amb18184097 [0,0,0,1,0,0|1,0,2]=4 1052 B14R2.35816 CCN(C)CC1Cc2ccccc21 Amb27197364 [0,0,0,1,0,0|3,0,0]=4 1053 B14R2.35816 CON(C)CC1Cc2ccccc21 Amb27220077 [0,0,0,1,0,0|2,0,0]=3 1054 B14R2.35816 C\N=C(\N)NC1Cc2ccccc21 Amb27412712 [0,0,0,1,0,0|3,0,0]=4 1055 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,0,0,0,1,0|1,0,1]=3 1056 B12R1.27 C#CC(=O)CCc1ccccn1 Amb27411050 [0,0,0,0,1,0|2,0,1]=4 1057 B12R1.27 C#CC(=O)CSc1ccccc1 Amb27961049 [0,0,0,0,1,0|2,0,1]=4 1058 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [0,0,0,0,1,0|2,0,1]=4 1059 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [0,0,0,0,1,0|2,0,1]=4 1060 B12R1.27 C=C(CBr)CCc1ccccc1 Amb32951881 [0,0,0,0,1,0|3,0,0]=4 1061 B12R1.27 C=C(CCl)CCc1ccccc1 Amb32951884 [0,0,0,0,1,0|3,0,0]=4 1062 B12R1.27 C=C(CN)CCc1ccccc1 Amb32954092 [0,0,0,0,1,0|3,0,0]=4 1063 B12R1.27 C=C(CNc1ccccc1)SC Amb27394285 [0,0,0,0,1,0|2,1,0]=4 1064 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,0,0,0,1,0|1,0,1]=3 1065 B12R1.27 C=CC(=O)CNc1ccccc1 Amb27840511 [0,0,0,0,1,0|2,0,1]=4 1066 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,0,0,0,1,0|2,0,1]=4 1067 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,0,0,0,1,0|2,0,1]=4 1068 B12R1.27 CC(CCc1ccccc1)ON Amb32951848 [0,0,0,0,1,0|2,0,1]=4 1069 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [0,0,0,0,1,0|3,0,0]=4 1070 B12R1.27 CCC(=O)C#Cc1ccccc1 Amb10562235 [0,0,0,0,1,0|1,0,2]=4 1071 B12R1.27 CCC(=O)CCc1ccccc1 Amb3940674 [0,0,0,0,1,0|1,0,0]=2 1072 B12R1.27 CCC(=O)CNc1ccccc1 Amb27643385 [0,0,0,0,1,0|2,0,0]=3 1073 B12R1.27 CCC(=O)CSc1ccccc1 Amb4165963 [0,0,0,0,1,0|2,0,0]=3 1074 B12R1.27 CCC(=O)NCc1ccccc1 Amb3097295 [0,0,0,0,1,0|2,0,0]=3 1075 B12R1.27 CCC(=O)NCc1ccccn1 Amb17736593 [0,0,0,0,1,0|3,0,0]=4 1076 B12R1.27 CCC(=O)NNc1ccccc1 Amb2720825 [0,0,0,0,1,0|3,0,0]=4 1077 B12R1.27 CCC(=O)NOc1ccccc1 Amb27827163 [0,0,0,0,1,0|3,0,0]=4 1078 B12R1.27 CCC(=O)OCc1ccccc1 Amb6357157 [0,0,0,0,1,0|2,0,0]=3 1079 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [0,0,0,0,1,0|1,0,2]=4 1080 B12R1.27 CCC(=S)OCc1ccccc1 Amb28078330 [0,0,0,0,1,0|2,1,0]=4 1081 B12R1.27 CCC(N)CCc1ccccc1 Amb9031865 [0,0,0,0,1,0|2,0,1]=4 1082 B12R1.27 CCC(O)CCc1ccccc1 Amb17138574 [0,0,0,0,1,0|1,0,2]=4 1083 B12R1.27 CNC(=N)CCc1ccccn1 Amb30007681 [0,0,0,0,1,0|3,0,0]=4 1084 B12R1.27 CNC(=N)SCc1ccccc1 Amb26537028 [0,0,0,0,1,0|3,0,0]=4 1085 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [0,0,0,0,1,0|1,0,0]=2 1086 B12R1.27 CNC(=O)CCc1cccnc1 Amb27256880 [0,0,0,0,1,0|2,0,0]=3 1087 B12R1.27 CNC(=O)CCc1ccncn1 Amb27982663 [0,0,0,0,1,0|3,0,0]=4 1088 B12R1.27 CNC(=O)CCc1ncccn1 Amb28291945 [0,0,0,0,1,0|3,0,0]=4 1089 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [0,0,0,0,1,0|2,0,0]=3 1090 B12R1.27 CNC(=O)CSc1ccccn1 Amb13953848 [0,0,0,0,1,0|3,0,0]=4 1091 B12R1.27 CNC(=O)NCc1ccccn1 Amb2132790 [0,0,0,0,1,0|3,0,0]=4 1092 B12R1.27 CNC(=O)NCc1cccnc1 Amb2132774 [0,0,0,0,1,0|3,0,0]=4 1093 B12R1.27 CNC(=O)NCc1ccncc1 Amb2132791 [0,0,0,0,1,0|3,0,0]=4 1094 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,0,0,0,1,0|3,0,0]=4 1095 B12R1.27 CNC(=O)NOc1ccccc1 Amb27848154 [0,0,0,0,1,0|3,0,0]=4 1096 B12R1.27 CNC(=O)OCc1ccccc1 Amb26883461 [0,0,0,0,1,0|2,0,0]=3 1097 B12R1.27 CNC(=O)OCc1ccccn1 Amb27616729 [0,0,0,0,1,0|3,0,0]=4 1098 B12R1.27 CNC(=O)OCc1cccnc1 Amb24532586 [0,0,0,0,1,0|3,0,0]=4 1099 B12R1.27 CNC(=O)OCc1ccncc1 Amb27798878 [0,0,0,0,1,0|3,0,0]=4 1100 B12R1.27 CNC(=O)SCc1ccccc1 Amb28243771 [0,0,0,0,1,0|2,0,0]=3 1101 B12R1.27 CNC(=S)CCc1ccccc1 Amb4430624 [0,0,0,0,1,0|1,1,0]=3 1102 B12R1.27 CNC(=S)NCc1ccccc1 Amb2684640 [0,0,0,0,1,0|2,1,0]=4 1103 B12R1.27 CNC(=S)SCc1ccccc1 Amb27202269 [0,0,0,0,1,0|2,1,0]=4 1104 B12R1.27 CNC(C)CCc1ccccc1 Amb1138722 [0,0,0,0,1,0|2,0,1]=4 1105 B12R1.27 COC(=N)CCc1ccccn1 Amb18563625 [0,0,0,0,1,0|2,0,0]=3 1106 B12R1.27 COC(=N)CCc1cccnc1 Amb18563630 [0,0,0,0,1,0|2,0,0]=3 1107 B12R1.27 COC(=N)CCc1ccncc1 Amb18563635 [0,0,0,0,1,0|2,0,0]=3 1108 B12R1.27 COC(=N)CSc1ccccc1 Amb29847972 [0,0,0,0,1,0|2,0,0]=3 1109 B12R1.27 COC(=O)C#Cc1ccccc1 Amb4019367 [0,0,0,0,1,0|0,0,2]=3 1110 B12R1.27 COC(=O)C#Cc1ccccn1 Amb1039304 [0,0,0,0,1,0|1,0,2]=4 1111 B12R1.27 COC(=O)C#Cc1cccnc1 Amb28122840 [0,0,0,0,1,0|1,0,2]=4 1112 B12R1.27 COC(=O)C#Cc1ccncc1 Amb27227860 [0,0,0,0,1,0|1,0,2]=4 1113 B12R1.27 COC(=O)CCc1ccccc1 Amb843216 [0,0,0,0,1,0|0,0,0]=1 1114 B12R1.27 COC(=O)CCc1cccnc1 Amb6357821 [0,0,0,0,1,0|1,0,0]=2 1115 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [0,0,0,0,1,0|1,0,0]=2 1116 B12R1.27 COC(=O)CCc1cncnc1 Amb21922892 [0,0,0,0,1,0|2,0,0]=3 1117 B12R1.27 COC(=O)CNc1ccccc1 Amb33548260 [0,0,0,0,1,0|1,0,0]=2 1118 B12R1.27 COC(=O)CNc1ccccc1 Amb6323391 [0,0,0,0,1,0|1,0,0]=2 1119 B12R1.27 COC(=O)CNc1ccccn1 Amb6649089 [0,0,0,0,1,0|2,0,0]=3 1120 B12R1.27 COC(=O)CNc1cccnc1 Amb18270093 [0,0,0,0,1,0|2,0,0]=3 1121 B12R1.27 COC(=O)CNc1ccncc1 Amb6631083 [0,0,0,0,1,0|2,0,0]=3 1122 B12R1.27 COC(=O)CNc1cncnc1 Amb18270088 [0,0,0,0,1,0|3,0,0]=4 1123 B12R1.27 COC(=O)CNc1ncccn1 Amb6651392 [0,0,0,0,1,0|3,0,0]=4 1124 B12R1.27 COC(=O)COc1ccccc1 Amb2689596 [0,0,0,0,1,0|1,0,0]=2 1125 B12R1.27 COC(=O)COc1ccccn1 Amb24095859 [0,0,0,0,1,0|2,0,0]=3 1126 B12R1.27 COC(=O)CSc1ccccc1 Amb2689638 [0,0,0,0,1,0|1,0,0]=2 1127 B12R1.27 COC(=O)CSc1cnccn1 Amb29845365 [0,0,0,0,1,0|3,0,0]=4 1128 B12R1.27 COC(=O)CSc1ncccn1 Amb4330318 [0,0,0,0,1,0|3,0,0]=4 1129 B12R1.27 COC(=O)NCc1ccccc1 Amb2746993 [0,0,0,0,1,0|1,0,0]=2 1130 B12R1.27 COC(=O)NCc1cccnn1 Amb28197550 [0,0,0,0,1,0|3,0,0]=4 1131 B12R1.27 COC(=O)NCc1cnccn1 Amb35654789 [0,0,0,0,1,0|3,0,0]=4 1132 B12R1.27 COC(=O)NCc1ncccn1 Amb27766428 [0,0,0,0,1,0|3,0,0]=4 1133 B12R1.27 COC(=O)NNc1ccccn1 Amb28350961 [0,0,0,0,1,0|3,0,0]=4 1134 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [0,0,0,0,1,0|1,0,0]=2 1135 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb33716217 [0,0,0,0,1,0|0,0,2]=3 1136 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb8515074 [0,0,0,0,1,0|0,0,2]=3 1137 B12R1.27 COC(=O)\C=C\c1ccccn1 Amb25036096 [0,0,0,0,1,0|1,0,2]=4 1138 B12R1.27 COC(=O)\C=C\c1cccnc1 Amb17844385 [0,0,0,0,1,0|1,0,2]=4 1139 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb20668041 [0,0,0,0,1,0|1,0,2]=4 1140 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb24074160 [0,0,0,0,1,0|1,0,2]=4 1141 B12R1.27 COC(=S)NCc1ccccc1 Amb27388388 [0,0,0,0,1,0|1,1,0]=3 1142 B12R1.27 CSC(=N)NCc1ccccc1 Amb25760156 [0,0,0,0,1,0|2,1,0]=4 1143 B12R1.27 CSC(=S)NCc1ccccc1 Amb5716138 [0,0,0,0,1,0|1,2,0]=4 1144 B12R1.27 CSC(=S)OCc1ccccc1 Amb4035354 [0,0,0,0,1,0|1,2,0]=4 1145 B12R1.27 C\C(=C\Cl)CCc1ccccc1 Amb27658993 [0,0,0,0,1,0|3,0,0]=4 1146 B12R1.27 C\N=C(\C)OCc1ccccc1 Amb27784725 [0,0,0,0,1,0|3,0,0]=4 1147 B12R1.27 N#CC(=O)OCc1ccccc1 Amb9786353 [0,0,0,0,1,0|3,0,0]=4 1148 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,0,0,0,1,0|2,0,0]=3 1149 B12R1.27 NCC(=O)CCc1ccccc1 Amb35788694 [0,0,0,0,1,0|2,0,0]=3 1150 B12R1.27 NCC(=O)NCc1ccccc1 Amb6477742 [0,0,0,0,1,0|3,0,0]=4 1151 B12R1.27 NCC(=O)NCc1ccccc1 Amb7969763 [0,0,0,0,1,0|3,0,0]=4 1152 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,0,0,0,1,0|3,0,0]=4 1153 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,0,0,0,1,0|3,0,0]=4 1154 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,0,0,0,1,0|2,0,0]=3 1155 B12R1.27 NNC(=O)CCc1cccnc1 Amb8387840 [0,0,0,0,1,0|3,0,0]=4 1156 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,0,0,0,1,0|3,0,0]=4 1157 B12R1.27 NNC(=O)CNc1ccccc1 Amb29844457 [0,0,0,0,1,0|3,0,0]=4 1158 B12R1.27 NNC(=O)COc1ccccc1 Amb6402305 [0,0,0,0,1,0|3,0,0]=4 1159 B12R1.27 NNC(=O)CSc1ccccc1 Amb4065797 [0,0,0,0,1,0|3,0,0]=4 1160 B12R1.27 NNC(=O)NCc1ccccc1 Amb8853874 [0,0,0,0,1,0|3,0,0]=4 1161 B12R1.27 NNC(=O)OCc1ccccc1 Amb33422006 [0,0,0,0,1,0|3,0,0]=4 1162 B12R1.27 NNC(=O)OCc1ccccc1 Amb8516532 [0,0,0,0,1,0|3,0,0]=4 1163 B12R1.27 NNC(=S)CCc1ccccc1 Amb27492786 [0,0,0,0,1,0|2,1,0]=4 1164 B12R1.27 N\C(CCc1ccccc1)=N/O Amb1115853 [0,0,0,0,1,0|3,0,0]=4 1165 B12R1.27 N\C(CCc1ccccc1)=N\O Amb22053006 [0,0,0,0,1,0|3,0,0]=4 1166 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,0,0,0,1,0|2,0,0]=3 1167 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,0,0,0,1,0|3,0,0]=4 1168 B12R1.27 O=C(CBr)NCc1ccccc1 Amb2221074 [0,0,0,0,1,0|3,0,0]=4 1169 B12R1.27 O=C(CBr)OCc1ccccc1 Amb2720586 [0,0,0,0,1,0|3,0,0]=4 1170 B12R1.27 O=C(CCc1ccccc1)NO Amb6277186 [0,0,0,0,1,0|2,0,0]=3 1171 B12R1.27 O=C(CCl)CCc1ccccc1 Amb17139043 [0,0,0,0,1,0|2,0,0]=3 1172 B12R1.27 O=C(CCl)COc1ccccc1 Amb17139095 [0,0,0,0,1,0|3,0,0]=4 1173 B12R1.27 O=C(CCl)CSc1ccccc1 Amb32435047 [0,0,0,0,1,0|3,0,0]=4 1174 B12R1.27 O=C(CCl)NCc1ccccc1 Amb6324481 [0,0,0,0,1,0|3,0,0]=4 1175 B12R1.27 O=C(CCl)OCc1ccccc1 Amb844249 [0,0,0,0,1,0|3,0,0]=4 1176 B12R1.27 O=C(CF)NCc1ccccc1 Amb27237611 [0,0,0,0,1,0|3,0,0]=4 1177 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [0,0,0,0,1,0|3,0,0]=4 1178 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,0,0,0,1,0|3,0,0]=4 1179 B12R1.27 O=C(CO)CCc1ccccc1 Amb18563609 [0,0,0,0,1,0|2,0,0]=3 1180 B12R1.27 O=C(CO)CCc1ccccn1 Amb18563673 [0,0,0,0,1,0|3,0,0]=4 1181 B12R1.27 O=C(CO)CCc1cccnc1 Amb18563674 [0,0,0,0,1,0|3,0,0]=4 1182 B12R1.27 O=C(CO)CCc1ccncc1 Amb18563675 [0,0,0,0,1,0|3,0,0]=4 1183 B12R1.27 O=C(CO)COc1ccccc1 Amb18563713 [0,0,0,0,1,0|3,0,0]=4 1184 B12R1.27 O=C(CO)NCc1ccccc1 Amb1111331 [0,0,0,0,1,0|3,0,0]=4 1185 B12R1.27 O=C(CO)OCc1ccccc1 Amb3939223 [0,0,0,0,1,0|3,0,0]=4 1186 B12R1.27 O=C(COc1ccccc1)NO Amb6270455 [0,0,0,0,1,0|3,0,0]=4 1187 B12R1.27 O=C(CS)OCc1ccccc1 Amb9786411 [0,0,0,0,1,0|3,0,0]=4 1188 B12R1.27 O=C(CSc1ccccc1)NO Amb27590137 [0,0,0,0,1,0|3,0,0]=4 1189 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,0,0,0,1,0|3,0,0]=4 1190 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,0,0,0,1,0|3,0,0]=4 1191 B12R1.27 O=C(NO)OCc1ccccc1 Amb2445312 [0,0,0,0,1,0|3,0,0]=4 1192 B12R1.27 O=CC(=O)OCc1ccccc1 Amb18645967 [0,0,0,0,1,0|3,0,0]=4 1193 B12R1.27 O\N=C(/Cl)CCc1ccccc1 Amb32661748 [0,0,0,0,1,0|3,0,0]=4 1194 B12R1.27 [NH3+]CC(=O)OCc1ccccc1 Amb4037912 [0,0,0,0,1,0|3,0,0]=4 1195 B12R1.477 CCC(=O)CCCn1cccn1 Amb30623434 [0,0,0,0,1,0|3,0,0]=4 1196 B12R1.477 CNC(=O)CCNc1ccsc1 Amb27247205 [0,0,0,0,1,0|3,0,0]=4 1197 B12R1.477 CNC(=O)NCCc1ccoc1 Amb35627270 [0,0,0,0,1,0|3,0,0]=4 1198 B12R1.477 COC(=O)C#CCc1ccsc1 Amb27243859 [0,0,0,0,1,0|1,0,2]=4 1199 B12R1.477 COC(=O)CCCc1cccs1 Amb448996 [0,0,0,0,1,0|1,0,0]=2 1200 B12R1.477 COC(=O)CCCc1nccs1 Amb32652213 [0,0,0,0,1,0|2,0,0]=3 1201 B12R1.477 COC(=O)CCCn1cccc1 Amb22971177 [0,0,0,0,1,0|1,0,0]=2 1202 B12R1.477 COC(=O)CCNc1nccs1 Amb19075740 [0,0,0,0,1,0|3,0,0]=4 1203 B12R1.477 COC(=O)CNCc1ccco1 Amb6686981 [0,0,0,0,1,0|2,0,0]=3 1204 B12R1.477 COC(=O)COCc1ccco1 Amb9202943 [0,0,0,0,1,0|2,0,0]=3 1205 B12R1.477 COC(=O)CSCc1ccco1 Amb6357576 [0,0,0,0,1,0|2,0,0]=3 1206 B12R1.477 NNC(=O)CCCc1cccs1 Amb6242608 [0,0,0,0,1,0|3,0,0]=4 1207 B14R1.716 C#CC(=O)CCNCc1ccccc1 Amb33131464 [0,0,0,0,0,1|1,0,1]=3 1208 B14R1.716 C=CC(=O)CCNCc1ccccc1 Amb33131465 [0,0,0,0,0,1|1,0,1]=3 1209 B14R1.716 C=CC(=O)CCOCc1ccccc1 Amb27472400 [0,0,0,0,0,1|1,0,1]=3 1210 B14R1.716 CCC(=O)CCCSc1ccccc1 Amb32682990 [0,0,0,0,0,1|1,0,0]=2 1211 B14R1.716 CCC(=O)CCNCc1ccccc1 Amb25040589 [0,0,0,0,0,1|1,0,0]=2 1212 B14R1.716 CCC(=O)NCNCc1ccccc1 Amb28252142 [0,0,0,0,0,1|2,0,0]=3 1213 B14R1.716 CCC(=O)OCCOc1ccccc1 Amb4005896 [0,0,0,0,0,1|2,0,0]=3 1214 B14R1.716 CCC(=O)\C=C/NCc1ccccc1 Amb27965467 [0,0,0,0,0,1|1,0,2]=4 1215 B14R1.716 CCC(C)CCNCc1ccccc1 Amb27392700 [0,0,0,0,0,1|2,0,1]=4 1216 B14R1.716 CCC(C)COCCc1ccccc1 Amb24100310 [0,0,0,0,0,1|2,0,1]=4 1217 B14R1.716 CCC(C)NCCCc1ccccc1 Amb20673663 [0,0,0,0,0,1|2,0,1]=4 1218 B14R1.716 CCC(C)NCCCc1ccccc1 Amb9749932 [0,0,0,0,0,1|2,0,1]=4 1219 B14R1.716 CCC(Cl)CCNCc1ccccc1 Amb27406390 [0,0,0,0,0,1|2,0,1]=4 1220 B14R1.716 CCC(N)CCNCc1ccccc1 Amb27649623 [0,0,0,0,0,1|2,0,1]=4 1221 B14R1.716 CCC(N)CCOCc1ccccc1 Amb28423127 [0,0,0,0,0,1|2,0,1]=4 1222 B14R1.716 CCN(C)CCNCc1ccccc1 Amb19079144 [0,0,0,0,0,1|3,0,0]=4 1223 B14R1.716 CCS(=O)CCNCc1ccccc1 Amb28255222 [0,0,0,0,0,1|2,0,0]=3 1224 B14R1.716 CNC(=O)CCNCc1cccnc1 Amb19079385 [0,0,0,0,0,1|2,0,0]=3 1225 B14R1.716 CNC(=O)CCNCc1cccnc1 Amb19984984 [0,0,0,0,0,1|2,0,0]=3 1226 B14R1.716 CNC(=O)CCOCc1ccccc1 Amb26361930 [0,0,0,0,0,1|1,0,0]=2 1227 B14R1.716 CNC(=O)C\N=N\Nc1ccccc1 Amb28074019 [0,0,0,0,0,1|3,0,0]=4 1228 B14R1.716 CNC(=O)NCCNc1ccccc1 Amb27764648 [0,0,0,0,0,1|2,0,0]=3 1229 B14R1.716 CNC(=O)NCCNc1ccccn1 Amb28400407 [0,0,0,0,0,1|3,0,0]=4 1230 B14R1.716 CNC(=O)OCCOc1ccccc1 Amb24081214 [0,0,0,0,0,1|2,0,0]=3 1231 B14R1.716 COC(=N)CCOCc1ccccc1 Amb27444424 [0,0,0,0,0,1|1,0,0]=2 1232 B14R1.716 COC(=O)C#CCOc1ccccc1 Amb27755610 [0,0,0,0,0,1|0,0,2]=3 1233 B14R1.716 COC(=O)C#CCSc1ccccc1 Amb27795338 [0,0,0,0,0,1|0,0,2]=3 1234 B14R1.716 COC(=O)CCCCc1ccccc1 Amb8392132 [0,0,0,0,0,1|0,0,0]=1 1235 B14R1.716 COC(=O)CCCCc1ccccn1 Amb24113266 [0,0,0,0,0,1|1,0,0]=2 1236 B14R1.716 COC(=O)CCCNc1ccccn1 Amb18933129 [0,0,0,0,0,1|1,0,0]=2 1237 B14R1.716 COC(=O)CCCNc1ccncc1 Amb18933138 [0,0,0,0,0,1|1,0,0]=2 1238 B14R1.716 COC(=O)CCCNc1ncccn1 Amb2434810 [0,0,0,0,0,1|2,0,0]=3 1239 B14R1.716 COC(=O)CCCSc1ccccc1 Amb8950459 [0,0,0,0,0,1|0,0,0]=1 1240 B14R1.716 COC(=O)CCNCc1ccccc1 Amb288483 [0,0,0,0,0,1|0,0,0]=1 1241 B14R1.716 COC(=O)CCNCc1ccccc1 Amb996333 [0,0,0,0,0,1|0,0,0]=1 1242 B14R1.716 COC(=O)CCNCc1ccccn1 Amb8830818 [0,0,0,0,0,1|1,0,0]=2 1243 B14R1.716 COC(=O)CCNCc1cccnc1 Amb9203455 [0,0,0,0,0,1|1,0,0]=2 1244 B14R1.716 COC(=O)CCNCc1ccncc1 Amb8830819 [0,0,0,0,0,1|1,0,0]=2 1245 B14R1.716 COC(=O)CCOCc1ccccc1 Amb7773811 [0,0,0,0,0,1|0,0,0]=1 1246 B14R1.716 COC(=O)CNCCc1ccccc1 Amb6686977 [0,0,0,0,0,1|0,0,0]=1 1247 B14R1.716 COC(=O)NCC#Cc1ccccc1 Amb24374036 [0,0,0,0,0,1|0,0,2]=3 1248 B14R1.716 COC(=O)N\C=C\Sc1ccccc1 Amb28052640 [0,0,0,0,0,1|1,0,2]=4 1249 B14R1.716 COC(=O)\C=C\C#Cc1ccccc1 Amb20001567 [0,0,0,0,0,1|0,0,3]=4 1250 B14R1.716 COC(C)CCCNc1ccccc1 Amb33133292 [0,0,0,0,0,1|1,0,1]=3 1251 B14R1.716 CSC(C)CCNCc1ccccc1 Amb27666659 [0,0,0,0,0,1|1,1,1]=4 1252 B14R1.716 C\C(CCNCc1ccccc1)=N/O Amb27483946 [0,0,0,0,0,1|3,0,0]=4 1253 B14R1.716 NCC(=O)NCCCc1ccccc1 Amb5783138 [0,0,0,0,0,1|2,0,0]=3 1254 B14R1.716 NCC(=O)NCCOc1ccccc1 Amb17235931 [0,0,0,0,0,1|3,0,0]=4 1255 B14R1.716 NNC(=O)CCCOc1ccccc1 Amb8998039 [0,0,0,0,0,1|2,0,0]=3 1256 B14R1.716 NNC(=O)CCNCc1ccccc1 Amb28382954 [0,0,0,0,0,1|2,0,0]=3 1257 B14R1.716 NNC(=O)CCNCc1cccnc1 Amb20171994 [0,0,0,0,0,1|3,0,0]=4 1258 B14R1.716 NNC(=O)CCOCc1ccccc1 Amb26521710 [0,0,0,0,0,1|2,0,0]=3 1259 B14R1.716 N\C(CCNCc1ccccc1)=N/O Amb24109264 [0,0,0,0,0,1|3,0,0]=4 1260 B14R1.716 N\C(CCOCc1ccccc1)=N/O Amb6257061 [0,0,0,0,0,1|3,0,0]=4 1261 B14R1.716 O=C(CBr)NCCCc1ccccc1 Amb17323643 [0,0,0,0,0,1|2,0,0]=3 1262 B14R1.716 O=C(CBr)NCCOc1ccccc1 Amb17333035 [0,0,0,0,0,1|3,0,0]=4 1263 B14R1.716 O=C(CCl)NCCCc1ccccc1 Amb1103589 [0,0,0,0,0,1|2,0,0]=3 1264 B14R1.716 O=C(CCl)NCCCc1ccccn1 Amb31176172 [0,0,0,0,0,1|3,0,0]=4 1265 B14R1.716 O=C(CCl)NCCCc1cccnc1 Amb31176175 [0,0,0,0,0,1|3,0,0]=4 1266 B14R1.716 O=C(CCl)NCCCc1ccncc1 Amb31176177 [0,0,0,0,0,1|3,0,0]=4 1267 B14R1.716 O=C(CCl)NCCOc1ccccc1 Amb6336217 [0,0,0,0,0,1|3,0,0]=4 1268 B14R1.716 O=C(CCl)NCCSc1ccccc1 Amb1657260 [0,0,0,0,0,1|3,0,0]=4 1269 B14R1.716 O=C(CCl)OCCCc1ccccc1 Amb3372153 [0,0,0,0,0,1|2,0,0]=3 1270 B14R1.716 O=C(CO)CCOCc1ccccc1 Amb28139815 [0,0,0,0,0,1|2,0,0]=3 1271 B11R1.28 BrCCCCc1ccccc1 Amb2685395 [2,0,0,0,0,0|1,0,1]=4 1272 B11R1.28 Br[Mg]CCCc1ccccc1 Amb6300511 [2,0,0,0,0,0|2,0,0]=4 1273 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [2,0,0,0,0,0|0,0,2]=4 1274 B11R1.28 C=CCCNc1ccccc1 Amb27495374 [2,0,0,0,0,0|1,0,1]=4 1275 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [2,0,0,0,0,0|1,0,1]=4 1276 B11R1.28 C=CCCSc1ccccc1 Amb27270191 [2,0,0,0,0,0|1,0,1]=4 1277 B11R1.28 C=CCNCc1ccccc1 Amb6683954 [2,0,0,0,0,0|1,0,1]=4 1278 B11R1.28 C=CCNCc1ccccc1 Amb6864764 [2,0,0,0,0,0|1,0,1]=4 1279 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [2,0,0,0,0,0|1,0,1]=4 1280 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [2,0,0,0,0,0|1,0,1]=4 1281 B11R1.28 CCCCCc1ccccc1 Amb2722921 [2,0,0,0,0,0|0,0,1]=3 1282 B11R1.28 CCCCCc1ccccn1 Amb533507 [2,0,0,0,0,0|1,0,1]=4 1283 B11R1.28 CCCCCc1cccnc1 Amb17672949 [2,0,0,0,0,0|1,0,1]=4 1284 B11R1.28 CCCCCc1ccncc1 Amb17672950 [2,0,0,0,0,0|1,0,1]=4 1285 B11R1.28 CCCCNc1ccccc1 Amb3940154 [2,0,0,0,0,0|1,0,1]=4 1286 B11R1.28 CCCCOc1ccccc1 Amb2685665 [2,0,0,0,0,0|1,0,1]=4 1287 B11R1.28 CCCCSc1ccccc1 Amb3836105 [2,0,0,0,0,0|1,0,1]=4 1288 B11R1.28 CCCNCc1ccccc1 Amb1105937 [2,0,0,0,0,0|1,0,1]=4 1289 B11R1.28 CCCNCc1ccccc1 Amb6537999 [2,0,0,0,0,0|1,0,1]=4 1290 B11R1.28 CCCSCc1ccccc1 Amb27000631 [2,0,0,0,0,0|1,0,1]=4 1291 B11R1.28 CCNCCc1ccccc1 Amb33551205 [2,0,0,0,0,0|1,0,1]=4 1292 B11R1.28 CCNCCc1ccccc1 Amb6244873 [2,0,0,0,0,0|1,0,1]=4 1293 B11R1.28 CCOCCc1ccccc1 Amb4035236 [2,0,0,0,0,0|1,0,1]=4 1294 B11R1.28 CNCCCc1ccccc1 Amb21954280 [2,0,0,0,0,0|1,0,0]=3 1295 B11R1.28 CNCCCc1ccccc1 Amb2721795 [2,0,0,0,0,0|1,0,0]=3 1296 B11R1.28 CNCCCc1ccccn1 Amb18312462 [2,0,0,0,0,0|2,0,0]=4 1297 B11R1.28 CNCCNc1ccccc1 Amb6825621 [2,0,0,0,0,0|2,0,0]=4 1298 B11R1.28 CNCCOc1ccccc1 Amb1105525 [2,0,0,0,0,0|2,0,0]=4 1299 B11R1.28 CNCCOc1ccccc1 Amb2691365 [2,0,0,0,0,0|2,0,0]=4 1300 B11R1.28 CNCCSc1ccccc1 Amb10608735 [2,0,0,0,0,0|2,0,0]=4 1301 B11R1.28 CNCCSc1ccccc1 Amb17622507 [2,0,0,0,0,0|2,0,0]=4 1302 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [2,0,0,0,0,0|0,0,2]=4 1303 B11R1.28 COCCCc1ccncn1 Amb23453461 [2,0,0,0,0,0|2,0,0]=4 1304 B11R1.28 COCCNc1ccccc1 Amb596066 [2,0,0,0,0,0|1,0,0]=3 1305 B11R1.28 COCCNc1cccnc1 Amb18268638 [2,0,0,0,0,0|2,0,0]=4 1306 B11R1.28 COCCNc1ccncc1 Amb6632784 [2,0,0,0,0,0|2,0,0]=4 1307 B11R1.28 COCCOc1ccccc1 Amb4018811 [2,0,0,0,0,0|1,0,0]=3 1308 B11R1.28 COCCSc1ccccn1 Amb17760116 [2,0,0,0,0,0|2,0,0]=4 1309 B11R1.28 COCNCc1ccccc1 Amb25053350 [2,0,0,0,0,0|1,0,0]=3 1310 B11R1.28 CONCCc1cccnc1 Amb27987592 [2,0,0,0,0,0|2,0,0]=4 1311 B11R1.28 CONCCc1ccncc1 Amb27987581 [2,0,0,0,0,0|2,0,0]=4 1312 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [2,0,0,0,0,0|1,0,1]=4 1313 B11R1.28 CSCCCc1ccccc1 Amb25383748 [2,0,0,0,0,0|0,1,0]=3 1314 B11R1.28 CSCCNc1ccccc1 Amb17307504 [2,0,0,0,0,0|1,1,0]=4 1315 B11R1.28 CSCCOc1ccccc1 Amb4020915 [2,0,0,0,0,0|1,1,0]=4 1316 B11R1.28 CSCNCc1ccccc1 Amb26414504 [2,0,0,0,0,0|1,1,0]=4 1317 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [2,0,0,0,0,0|0,0,1]=3 1318 B11R1.28 C\C=C\CCc1ccncc1 Amb25830692 [2,0,0,0,0,0|1,0,1]=4 1319 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [2,0,0,0,0,0|1,0,1]=4 1320 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [2,0,0,0,0,0|1,0,1]=4 1321 B11R1.28 ClCCCCc1ccccc1 Amb3940707 [2,0,0,0,0,0|1,0,1]=4 1322 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [2,0,0,0,0,0|1,0,1]=4 1323 B11R1.28 ICCCCc1ccccc1 Amb25380384 [2,0,0,0,0,0|1,0,1]=4 1324 B11R1.28 N#CCCCc1ccccc1 Amb6251750 [2,0,0,0,0,0|1,0,1]=4 1325 B11R1.28 NCCCCc1ccccc1 Amb1227740 [2,0,0,0,0,0|1,0,1]=4 1326 B11R1.28 NNCCCc1ccccc1 Amb19373221 [2,0,0,0,0,0|2,0,0]=4 1327 B11R1.28 NNCCCc1ccccc1 Amb6252219 [2,0,0,0,0,0|2,0,0]=4 1328 B11R1.28 NOCCCc1ccccc1 Amb2610651 [2,0,0,0,0,0|1,0,0]=3 1329 B11R1.28 NOCCCc1ccccn1 Amb17089546 [2,0,0,0,0,0|2,0,0]=4 1330 B11R1.28 NOCCCc1cccnc1 Amb17089547 [2,0,0,0,0,0|2,0,0]=4 1331 B11R1.28 NOCCCc1ccncc1 Amb17089548 [2,0,0,0,0,0|2,0,0]=4 1332 B11R1.28 NOCCOc1ccccc1 Amb17088287 [2,0,0,0,0,0|2,0,0]=4 1333 B11R1.28 NOCCOc1ccccc1 Amb19894640 [2,0,0,0,0,0|2,0,0]=4 1334 B11R1.28 NOCOCc1ccccc1 Amb10606697 [2,0,0,0,0,0|2,0,0]=4 1335 B11R1.28 N\N=C\CCc1ccccc1 Amb27649733 [2,0,0,0,0,0|2,0,0]=4 1336 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [2,0,0,0,0,0|1,0,1]=4 1337 B11R1.28 O=CCC#Cc1ccccc1 Amb27390152 [2,0,0,0,0,0|0,0,2]=4 1338 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [2,0,0,0,0,0|0,0,0]=2 1339 B11R1.28 O=CCCCc1ccccn1 Amb22897023 [2,0,0,0,0,0|1,0,0]=3 1340 B11R1.28 O=CCCCc1cccnc1 Amb24099514 [2,0,0,0,0,0|1,0,0]=3 1341 B11R1.28 O=CCCCc1ccncc1 Amb24099515 [2,0,0,0,0,0|1,0,0]=3 1342 B11R1.28 O=CCCCc1ccncn1 Amb24099617 [2,0,0,0,0,0|2,0,0]=4 1343 B11R1.28 O=CCCCc1cnccn1 Amb26990640 [2,0,0,0,0,0|2,0,0]=4 1344 B11R1.28 O=CCCCc1cncnc1 Amb24063015 [2,0,0,0,0,0|2,0,0]=4 1345 B11R1.28 O=CCCCc1ncccn1 Amb24061342 [2,0,0,0,0,0|2,0,0]=4 1346 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [2,0,0,0,0,0|1,0,0]=3 1347 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [2,0,0,0,0,0|1,0,0]=3 1348 B11R1.28 O=CCCSc1ccncc1 Amb27671141 [2,0,0,0,0,0|2,0,0]=4 1349 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [2,0,0,0,0,0|1,0,0]=3 1350 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [2,0,0,0,0,0|1,0,0]=3 1351 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [2,0,0,0,0,0|1,0,0]=3 1352 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [2,0,0,0,0,0|2,0,0]=4 1353 B11R1.28 O=COCCc1ccccc1 Amb6357955 [2,0,0,0,0,0|1,0,0]=3 1354 B11R1.28 O=C\C=C/Cc1ccccc1 Amb27861231 [2,0,0,0,0,0|0,0,2]=4 1355 B11R1.28 O=C\C=C\Cc1ccccc1 Amb32954519 [2,0,0,0,0,0|0,0,2]=4 1356 B11R1.28 OCCCCc1ccccc1 Amb3939083 [2,0,0,0,0,0|0,0,1]=3 1357 B11R1.28 OCCCCc1ccccn1 Amb21520414 [2,0,0,0,0,0|1,0,1]=4 1358 B11R1.28 OCCCCc1cccnc1 Amb22732495 [2,0,0,0,0,0|1,0,1]=4 1359 B11R1.28 OCCCCc1ccncc1 Amb17740015 [2,0,0,0,0,0|1,0,1]=4 1360 B11R1.28 OCCCNc1ccccc1 Amb17307125 [2,0,0,0,0,0|1,0,1]=4 1361 B11R1.28 OCCCOc1ccccc1 Amb4476987 [2,0,0,0,0,0|1,0,1]=4 1362 B11R1.28 OCCCSc1ccccc1 Amb4018847 [2,0,0,0,0,0|1,0,1]=4 1363 B11R1.28 OCCC[SiH2]c1ccccc1 Amb27989504 [2,0,0,0,0,0|0,1,1]=4 1364 B11R1.28 OCCNCc1ccccc1 Amb1835287 [2,0,0,0,0,0|1,0,1]=4 1365 B11R1.28 OCCNCc1ccccc1 Amb6537902 [2,0,0,0,0,0|1,0,1]=4 1366 B11R1.28 OCCOCc1ccccc1 Amb3939139 [2,0,0,0,0,0|1,0,1]=4 1367 B11R1.28 OCCSCc1ccccc1 Amb2688740 [2,0,0,0,0,0|1,0,1]=4 1368 B11R1.28 ONCCCc1ccccc1 Amb26650950 [2,0,0,0,0,0|1,0,0]=3 1369 B11R1.28 ONCCOc1ccccc1 Amb17088413 [2,0,0,0,0,0|2,0,0]=4 1370 B11R1.28 SCCCCc1ccccc1 Amb17400224 [2,0,0,0,0,0|0,1,1]=4 1371 B11R1.28 [C-]#[N+]CCCc1ccccc1 Amb2690315 [2,0,0,0,0,0|1,0,1]=4 1372 B13R1.6 CCCCCCc1cccc(Br)c1 Amb10808077 [1,1,0,0,0,0|1,0,1]=4 1373 B13R1.6 CNCCCCc1cccc(Br)c1 Amb31157052 [1,1,0,0,0,0|1,0,1]=4 1374 B13R1.6 CNCCCCc1cccc(Br)c1 Amb33309544 [1,1,0,0,0,0|1,0,1]=4 1375 B13R1.6 COCCCNc1cccc(N)c1 Amb9213209 [1,1,0,0,0,0|1,0,1]=4 1376 B13R1.6 COCCCOc1cccc(N)c1 Amb9026892 [1,1,0,0,0,0|1,0,1]=4 1377 B13R1.6 COCCNCc1cccc(Br)c1 Amb1836612 [1,1,0,0,0,0|1,0,1]=4 1378 B13R1.6 COCCNCc1cccc(C)c1 Amb1836810 [1,1,0,0,0,0|1,0,1]=4 1379 B13R1.6 COCCNCc1cccc(Cl)c1 Amb4303629 [1,1,0,0,0,0|1,0,1]=4 1380 B13R1.6 COCCNCc1cccc(F)c1 Amb4552690 [1,1,0,0,0,0|1,0,1]=4 1381 B13R1.6 COCCNCc1cccc(O)c1 Amb1836877 [1,1,0,0,0,0|1,0,1]=4 1382 B13R1.6 COCCOCc1cccc(Br)c1 Amb22058978 [1,1,0,0,0,0|1,0,1]=4 1383 B13R1.6 COCCOCc1cccc(N)c1 Amb6252298 [1,1,0,0,0,0|1,0,1]=4 1384 B13R1.6 COCCSCc1cccc(N)c1 Amb9305167 [1,1,0,0,0,0|1,0,1]=4 1385 B13R1.6 COCOCCc1cccc(F)c1 Amb22641541 [1,1,0,0,0,0|1,0,1]=4 1386 B13R1.6 NOCCCCc1cccc(Br)c1 Amb33006651 [1,1,0,0,0,0|1,0,1]=4 1387 B13R1.9 CCCCCCc1ccc(Br)cc1 Amb2722820 [1,1,0,0,0,0|1,0,1]=4 1388 B13R1.9 CCCCCCc1ccc(I)cc1 Amb22043588 [1,1,0,0,0,0|1,0,1]=4 1389 B13R1.9 CCCCCCc1ccc(N)cc1 Amb2720502 [1,1,0,0,0,0|1,0,1]=4 1390 B13R1.9 CNCCCCc1ccc(Br)cc1 Amb17106027 [1,1,0,0,0,0|1,0,1]=4 1391 B13R1.9 CNCCCCc1ccc(Cl)cc1 Amb17106026 [1,1,0,0,0,0|1,0,1]=4 1392 B13R1.9 CNCCCCc1ccc(F)cc1 Amb17106025 [1,1,0,0,0,0|1,0,1]=4 1393 B13R1.9 COCCCNc1ccc(C)cc1 Amb17233578 [1,1,0,0,0,0|1,0,1]=4 1394 B13R1.9 COCCCNc1ccc(N)cc1 Amb8843656 [1,1,0,0,0,0|1,0,1]=4 1395 B13R1.9 COCCCOc1ccc(Br)cc1 Amb17257507 [1,1,0,0,0,0|1,0,1]=4 1396 B13R1.9 COCCCOc1ccc(N)cc1 Amb8868078 [1,1,0,0,0,0|1,0,1]=4 1397 B13R1.9 COCCCSc1ccc(N)cc1 Amb18321735 [1,1,0,0,0,0|1,0,1]=4 1398 B13R1.9 COCCNCc1ccc(Br)cc1 Amb1836428 [1,1,0,0,0,0|1,0,1]=4 1399 B13R1.9 COCCNCc1ccc(Br)cc1 Amb6865370 [1,1,0,0,0,0|1,0,1]=4 1400 B13R1.9 COCCNCc1ccc(C)cc1 Amb1836071 [1,1,0,0,0,0|1,0,1]=4 1401 B13R1.9 COCCNCc1ccc(C)cc1 Amb6865362 [1,1,0,0,0,0|1,0,1]=4 1402 B13R1.9 COCCNCc1ccc(Cl)cc1 Amb13949021 [1,1,0,0,0,0|1,0,1]=4 1403 B13R1.9 COCCNCc1ccc(Cl)cc1 Amb1836723 [1,1,0,0,0,0|1,0,1]=4 1404 B13R1.9 COCCNCc1ccc(F)cc1 Amb1835648 [1,1,0,0,0,0|1,0,1]=4 1405 B13R1.9 COCCNCc1ccc(F)cc1 Amb22586767 [1,1,0,0,0,0|1,0,1]=4 1406 B13R1.9 COCCOCc1ccc(Br)cc1 Amb19373739 [1,1,0,0,0,0|1,0,1]=4 1407 B13R1.9 COCCOCc1ccc(N)cc1 Amb6242207 [1,1,0,0,0,0|1,0,1]=4 1408 B13R1.9 COCOCCc1ccc(F)cc1 Amb22641545 [1,1,0,0,0,0|1,0,1]=4 1409 B13R1.9 C\C=C\CCNc1ccc(N)cc1 Amb27791637 [1,1,0,0,0,0|2,0,0]=4 1410 B13R1.9 NOCCCCc1ccc(Br)cc1 Amb18071619 [1,1,0,0,0,0|1,0,1]=4 1411 B13R1.9 NOCCCCc1ccc(F)cc1 Amb18066113 [1,1,0,0,0,0|1,0,1]=4 1412 B13R1.24 CC#CCCC(N)c1ccccc1 Amb27617693 [1,1,0,0,0,0|1,0,1]=4 1413 B13R1.24 CCCCCC(N)c1ccccc1 Amb7764725 [1,1,0,0,0,0|1,0,1]=4 1414 B13R1.24 CCCCCC(O)c1ccccc1 Amb9619574 [1,1,0,0,0,0|1,0,1]=4 1415 B13R1.24 CCCCCC(S)c1ccccc1 Amb32788166 [1,1,0,0,0,0|1,0,1]=4 1416 B13R1.24 COCCNC(C)c1ccccc1 Amb6685616 [1,1,0,0,0,0|1,0,1]=4 1417 B13R1.28 BrCCCCCCc1ccccc1 Amb2685411 [1,1,0,0,0,0|1,0,1]=4 1418 B13R1.28 CC#CCCNCc1ccccc1 Amb27955822 [1,1,0,0,0,0|1,0,1]=4 1419 B13R1.28 CCCCCCCc1ccccc1 Amb8513456 [1,1,0,0,0,0|1,0,1]=4 1420 B13R1.28 CCCCCCNc1ccccc1 Amb597405 [1,1,0,0,0,0|1,0,1]=4 1421 B13R1.28 CCCCCNCc1ccccc1 Amb838091 [1,1,0,0,0,0|1,0,1]=4 1422 B13R1.28 CCCCNCCc1ccccc1 Amb2172322 [1,1,0,0,0,0|1,0,1]=4 1423 B13R1.28 CCCCNCCc1ccccc1 Amb875620 [1,1,0,0,0,0|1,0,1]=4 1424 B13R1.28 CCCCOCCc1ccccc1 Amb24065444 [1,1,0,0,0,0|1,0,1]=4 1425 B13R1.28 CCCNCCCc1ccccc1 Amb20673529 [1,1,0,0,0,0|1,0,1]=4 1426 B13R1.28 CCCNCCCc1ccccc1 Amb6714447 [1,1,0,0,0,0|1,0,1]=4 1427 B13R1.28 CCCOCCCc1ccccc1 Amb24063573 [1,1,0,0,0,0|1,0,1]=4 1428 B13R1.28 CCNCCCCc1ccccc1 Amb8853688 [1,1,0,0,0,0|1,0,1]=4 1429 B13R1.28 CCNCCCOc1ccccc1 Amb7760967 [1,1,0,0,0,0|2,0,0]=4 1430 B13R1.28 CCOCCNCc1ccccc1 Amb9241003 [1,1,0,0,0,0|1,0,1]=4 1431 B13R1.28 CNCCCCOc1ccccc1 Amb17309029 [1,1,0,0,0,0|1,0,1]=4 1432 B13R1.28 CNCCCOCc1ccccc1 Amb18186412 [1,1,0,0,0,0|1,0,1]=4 1433 B13R1.28 COCCCNCc1ccccc1 Amb2172436 [1,1,0,0,0,0|0,0,1]=3 1434 B13R1.28 COCCCNCc1ccccc1 Amb838852 [1,1,0,0,0,0|0,0,1]=3 1435 B13R1.28 COCCCNCc1ccccn1 Amb534487 [1,1,0,0,0,0|1,0,1]=4 1436 B13R1.28 COCCCNCc1cccnc1 Amb875736 [1,1,0,0,0,0|1,0,1]=4 1437 B13R1.28 COCCCNCc1ccncc1 Amb875727 [1,1,0,0,0,0|1,0,1]=4 1438 B13R1.28 COCCC\N=C\c1ccccc1 Amb33280239 [1,1,0,0,0,0|0,0,2]=4 1439 B13R1.28 COCCNCCc1ccccc1 Amb6685596 [1,1,0,0,0,0|0,0,1]=3 1440 B13R1.28 COCCNCCc1ccncc1 Amb16191750 [1,1,0,0,0,0|1,0,1]=4 1441 B13R1.28 CONCCOCc1ccccc1 Amb27655349 [1,1,0,0,0,0|1,0,0]=3 1442 B13R1.28 CO\N=C\CNCc1ccccc1 Amb27954555 [1,1,0,0,0,0|1,0,0]=3 1443 B13R1.28 CSCCCNCc1ccccc1 Amb6719949 [1,1,0,0,0,0|0,1,1]=4 1444 B13R1.28 ClCOCCOCc1ccccc1 Amb27205014 [1,1,0,0,0,0|1,0,1]=4 1445 B13R1.28 ClC\C=C\CNCc1ccccc1 Amb28044386 [1,1,0,0,0,0|2,0,0]=4 1446 B13R1.28 NCC#CCCCc1ccccc1 Amb27415576 [1,1,0,0,0,0|1,0,1]=4 1447 B13R1.28 NCCCCCCc1ccccc1 Amb17233312 [1,1,0,0,0,0|1,0,1]=4 1448 B13R1.28 NCCNCCCc1ccccc1 Amb17091041 [1,1,0,0,0,0|2,0,0]=4 1449 B13R1.28 NC\C=C\CNCc1ccccc1 Amb27648518 [1,1,0,0,0,0|2,0,0]=4 1450 B13R1.28 NOCCCOCc1ccccc1 Amb25144104 [1,1,0,0,0,0|1,0,1]=4 1451 B13R1.28 OCCCCCCc1ccccc1 Amb8515378 [1,1,0,0,0,0|1,0,1]=4 1452 B13R1.28 OCCNCCCc1ccccc1 Amb7757048 [1,1,0,0,0,0|2,0,0]=4 1453 B13R1.28 OCCSCCCc1ccccc1 Amb9362854 [1,1,0,0,0,0|2,0,0]=4 1454 B13R1.28 OC\C=C/COCc1ccccc1 Amb9825931 [1,1,0,0,0,0|2,0,0]=4 1455 B13R1.28 OC\C=C\COCc1ccccc1 Amb27180534 [1,1,0,0,0,0|2,0,0]=4 1456 B13R1.28 SC\C=C\COCc1ccccc1 Amb27651552 [1,1,0,0,0,0|2,0,0]=4 1457 B13R1.42 CC#CC(O)CCc1ccccc1 Amb17619341 [1,1,0,0,0,0|1,0,1]=4 1458 B13R1.42 CCCC(N)CCc1ccccc1 Amb9031789 [1,1,0,0,0,0|1,0,1]=4 1459 B13R1.42 COCC(C)NCc1ccccc1 Amb6689699 [1,1,0,0,0,0|1,0,1]=4 1460 B13R1.42 COCC(O)CNc1ccccc1 Amb2721933 [1,1,0,0,0,0|1,0,1]=4 1461 B13R1.42 COC[C@@H](C)NCc1ccccc1 Amb28345204 [1,1,0,0,0,0|1,0,1]=4 1462 B13R1.42 C\C=C\[C@H](C)NCc1ccccc1 Amb27390054 [1,1,0,0,0,0|2,0,0]=4 1463 B13R1.44 CCCCC(O)Cc1ccccc1 Amb4034774 [1,1,0,0,0,0|1,0,1]=4 1464 B13R1.44 C\C=C\CN(C)Cc1ccccc1 Amb28453964 [1,1,0,0,0,0|2,0,0]=4 1465 B13R1.337 C=C(C)\C=C\CCc1ccccc1 Amb22546754 [1,1,0,0,0,0|1,0,1]=4 1466 B13R1.337 CC(=O)CCCCc1ccccc1 Amb8392140 [1,1,0,0,0,0|1,0,1]=4 1467 B13R1.337 CC(=O)\C=C\CCc1ccccc1 Amb33083001 [1,1,0,0,0,0|1,0,1]=4 1468 B13R1.337 CC(C)=CCCNc1ccccc1 Amb29869593 [1,1,0,0,0,0|2,0,0]=4 1469 B13R1.337 CC(C)NCCCc1ccccc1 Amb2097980 [1,1,0,0,0,0|2,0,0]=4 1470 B13R1.337 CC(C)NCCCc1ccccc1 Amb6242639 [1,1,0,0,0,0|2,0,0]=4 1471 B13R1.337 CC(N)\C=C\CCc1ccccc1 Amb33082113 [1,1,0,0,0,0|1,0,1]=4 1472 B13R1.337 C\C(Cl)=C/CNCc1ccccc1 Amb1811425 [1,1,0,0,0,0|2,0,0]=4 1473 B13R1.337 C\C(Cl)=C\CNCc1ccccc1 Amb4303980 [1,1,0,0,0,0|2,0,0]=4 1474 B13R1.555 COCCCCc1cccnc1N Amb28555947 [1,1,0,0,0,0|1,0,1]=4 1475 B13R1.555 COCCCNc1ccccc1N Amb8843666 [1,1,0,0,0,0|1,0,1]=4 1476 B13R1.555 COCCCOc1ccccc1Br Amb17257505 [1,1,0,0,0,0|1,0,1]=4 1477 B13R1.555 COCCCOc1ccccc1N Amb9026891 [1,1,0,0,0,0|1,0,1]=4 1478 B13R1.555 COCCNCc1ccccc1Br Amb6685749 [1,1,0,0,0,0|1,0,1]=4 1479 B13R1.555 COCCNCc1ccccc1C Amb17622504 [1,1,0,0,0,0|1,0,1]=4 1480 B13R1.555 COCCNCc1ccccc1C Amb6685573 [1,1,0,0,0,0|1,0,1]=4 1481 B13R1.555 COCCNCc1ccccc1Cl Amb13949020 [1,1,0,0,0,0|1,0,1]=4 1482 B13R1.555 COCCNCc1ccccc1Cl Amb4552724 [1,1,0,0,0,0|1,0,1]=4 1483 B13R1.555 COCCNCc1ccccc1F Amb1836065 [1,1,0,0,0,0|1,0,1]=4 1484 B13R1.555 COCCNCc1ccccc1F Amb6865358 [1,1,0,0,0,0|1,0,1]=4 1485 B13R1.555 COCCNCc1ccccc1O Amb1836923 [1,1,0,0,0,0|1,0,1]=4 1486 B13R1.555 COCOCCc1ccccc1F Amb22641546 [1,1,0,0,0,0|1,0,1]=4 1487 B13R1.45 C=C(C)CNC(C)c1ccccc1 Amb17308958 [1,1,0,0,0,0|2,0,0]=4 1488 B13R1.45 C=C(COC(C)=O)c1ccccc1 Amb17778927 [1,1,0,0,0,0|1,0,1]=4 1489 B13R1.45 CC(=O)CCC(=O)c1ccccc1 Amb6357807 [1,1,0,0,0,0|0,0,1]=3 1490 B13R1.45 CC(=O)CCC(=O)c1ccccn1 Amb6301488 [1,1,0,0,0,0|1,0,1]=4 1491 B13R1.45 CC(=O)CCC(=O)c1cccnc1 Amb9472228 [1,1,0,0,0,0|1,0,1]=4 1492 B13R1.45 CC(=O)CCC(=O)c1ccncc1 Amb9472251 [1,1,0,0,0,0|1,0,1]=4 1493 B13R1.45 CC(=O)CCC(C)c1ccccc1 Amb33082106 [1,1,0,0,0,0|0,0,0]=2 1494 B13R1.45 CC(=O)CCC(Cl)c1ccccc1 Amb17402167 [1,1,0,0,0,0|0,0,0]=2 1495 B13R1.45 CC(=O)CCC(Cl)c1ccccn1 Amb17402226 [1,1,0,0,0,0|1,0,0]=3 1496 B13R1.45 CC(=O)CCC(Cl)c1cccnc1 Amb17402227 [1,1,0,0,0,0|1,0,0]=3 1497 B13R1.45 CC(=O)CCC(Cl)c1ccncc1 Amb17402228 [1,1,0,0,0,0|1,0,0]=3 1498 B13R1.45 CC(=O)CCN(C)c1ccccc1 Amb8388281 [1,1,0,0,0,0|1,0,0]=3 1499 B13R1.45 CC(=O)CNC(=O)c1ccccc1 Amb9836069 [1,1,0,0,0,0|1,0,1]=4 1500 B13R1.45 CC(=O)COC(=O)c1ccccc1 Amb22497327 [1,1,0,0,0,0|1,0,1]=4 1501 B13R1.45 CC(=O)C\C=C(/C)c1ccccc1 Amb27169026 [1,1,0,0,0,0|0,0,2]=4 1502 B13R1.45 CC(=O)NCC(=O)c1ccccc1 Amb17335159 [1,1,0,0,0,0|1,0,1]=4 1503 B13R1.45 CC(=O)NCC(Br)c1ccccc1 Amb27809645 [1,1,0,0,0,0|1,0,0]=3 1504 B13R1.45 CC(=O)NCC(C)c1ccccc1 Amb8384388 [1,1,0,0,0,0|1,0,0]=3 1505 B13R1.45 CC(=O)NCC(C)c1ccccn1 Amb35694000 [1,1,0,0,0,0|2,0,0]=4 1506 B13R1.45 CC(=O)NCC(O)c1ccccc1 Amb9244841 [1,1,0,0,0,0|1,0,0]=3 1507 B13R1.45 CC(=O)NCC(O)c1ccccn1 Amb27268413 [1,1,0,0,0,0|2,0,0]=4 1508 B13R1.45 CC(=O)NCC(O)c1ccncc1 Amb27591120 [1,1,0,0,0,0|2,0,0]=4 1509 B13R1.45 CC(=O)NCN(C)c1ccccc1 Amb27946390 [1,1,0,0,0,0|2,0,0]=4 1510 B13R1.45 CC(=O)NC[C@H](O)c1ccccc1 Amb27427139 [1,1,0,0,0,0|1,0,0]=3 1511 B13R1.45 CC(=O)NC[PH](=O)c1ccccc1 Amb27174263 [1,1,0,0,0,0|2,0,0]=4 1512 B13R1.45 CC(=O)OCC(=O)c1ccccc1 Amb4017907 [1,1,0,0,0,0|1,0,1]=4 1513 B13R1.45 CC(=O)OCC(C)c1ccccc1 Amb4020115 [1,1,0,0,0,0|1,0,0]=3 1514 B13R1.45 CC(=O)\C=C/C(O)c1ccccc1 Amb27749808 [1,1,0,0,0,0|0,0,2]=4 1515 B13R1.45 CC(=O)\C=C\C(C)c1ccccc1 Amb24090253 [1,1,0,0,0,0|0,0,2]=4 1516 B13R1.45 CC(C)=CCC(O)c1ccccc1 Amb27945977 [1,1,0,0,0,0|1,0,1]=4 1517 B13R1.45 CC(C)=CC[C@H](O)c1ccccc1 Amb27757376 [1,1,0,0,0,0|1,0,1]=4 1518 B13R1.45 CC(C)CCC(N)c1ccccc1 Amb35745830 [1,1,0,0,0,0|1,0,1]=4 1519 B13R1.45 CC(C)CCC(N)c1ccccc1 Amb6744642 [1,1,0,0,0,0|1,0,1]=4 1520 B13R1.45 CC(CCC(=O)O)c1ccccc1 Amb857806 [1,1,0,0,0,0|0,0,0]=2 1521 B13R1.45 CC(CC[C@@H](C)N)c1ccccc1 Amb33081846 [1,1,0,0,0,0|1,0,1]=4 1522 B13R1.45 CC(CC[C@@H](C)O)c1ccccc1 Amb33081845 [1,1,0,0,0,0|0,0,2]=4 1523 B13R1.45 CC(CC[C@H](C)N)c1ccccc1 Amb33081850 [1,1,0,0,0,0|1,0,1]=4 1524 B13R1.45 CC(CC[C@H](C)O)c1ccccc1 Amb33081839 [1,1,0,0,0,0|0,0,2]=4 1525 B13R1.45 CC(CC[N+](=O)[O-])c1ccccc1 Amb33081885 [1,1,0,0,0,0|1,0,1]=4 1526 B13R1.45 CC(CNC(=O)Cl)c1ccccc1 Amb35609815 [1,1,0,0,0,0|2,0,0]=4 1527 B13R1.45 CC(CNC(N)=O)c1ccccc1 Amb25156032 [1,1,0,0,0,0|2,0,0]=4 1528 B13R1.45 CC(COC(=O)Cl)c1ccccc1 Amb33297204 [1,1,0,0,0,0|2,0,0]=4 1529 B13R1.45 CC(N)CCC(C)c1ccccc1 Amb32953212 [1,1,0,0,0,0|1,0,1]=4 1530 B13R1.45 CC(NCC(=O)O)c1ccccc1 Amb7766412 [1,1,0,0,0,0|1,0,0]=3 1531 B13R1.45 CC(NCC(=O)O)c1ccccn1 Amb8827555 [1,1,0,0,0,0|2,0,0]=4 1532 B13R1.45 CC(NCC(N)=O)c1ccccc1 Amb33541973 [1,1,0,0,0,0|2,0,0]=4 1533 B13R1.45 CC(O)CCC(C)c1ccccc1 Amb33081451 [1,1,0,0,0,0|0,0,2]=4 1534 B13R1.45 CC(OCC(=O)O)c1ccccc1 Amb6269624 [1,1,0,0,0,0|1,0,0]=3 1535 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb1108005 [1,1,0,0,0,0|2,0,0]=4 1536 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb22754498 [1,1,0,0,0,0|2,0,0]=4 1537 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb13949100 [1,1,0,0,0,0|2,0,0]=4 1538 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb30622860 [1,1,0,0,0,0|2,0,0]=4 1539 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb9751862 [1,1,0,0,0,0|2,0,0]=4 1540 B13R1.45 CN(C)CCC(O)c1ccccc1 Amb671497 [1,1,0,0,0,0|2,0,0]=4 1541 B13R1.45 CN(CCC(=O)Cl)c1ccccc1 Amb17143181 [1,1,0,0,0,0|2,0,0]=4 1542 B13R1.45 CN(CCC(=O)O)c1ccccc1 Amb33551397 [1,1,0,0,0,0|1,0,0]=3 1543 B13R1.45 CN(CCC(=O)O)c1ccccc1 Amb845407 [1,1,0,0,0,0|1,0,0]=3 1544 B13R1.45 CN(CCC(=O)O)c1ccccn1 Amb18669639 [1,1,0,0,0,0|2,0,0]=4 1545 B13R1.45 CN(CCC(=O)O)c1ccncc1 Amb33551372 [1,1,0,0,0,0|2,0,0]=4 1546 B13R1.45 CN(CCC(N)=O)c1ccccc1 Amb17142975 [1,1,0,0,0,0|2,0,0]=4 1547 B13R1.45 C[C@@H](NCC(=O)O)c1ccccc1 Amb17935709 [1,1,0,0,0,0|1,0,0]=3 1548 B13R1.45 C[C@@H](NCC(N)=O)c1ccccc1 Amb24271280 [1,1,0,0,0,0|2,0,0]=4 1549 B13R1.45 C[C@@H](OCC(=O)O)c1ccccc1 Amb32946281 [1,1,0,0,0,0|1,0,0]=3 1550 B13R1.45 C[C@@H](\N=C\C(=O)O)c1ccccc1 Amb28288291 [1,1,0,0,0,0|1,0,1]=4 1551 B13R1.45 C[C@H](NCC(=O)O)c1ccccc1 Amb17935708 [1,1,0,0,0,0|1,0,0]=3 1552 B13R1.45 C[C@H](OCC(=O)O)c1ccccc1 Amb32946283 [1,1,0,0,0,0|1,0,0]=3 1553 B13R1.45 C\C(=C/CC(=O)O)c1ccccc1 Amb25189805 [1,1,0,0,0,0|0,0,2]=4 1554 B13R1.45 N=C(NCC(=O)O)c1ccccc1 Amb3427923 [1,1,0,0,0,0|1,0,1]=4 1555 B13R1.45 NC(=O)CCC(=O)c1ccccc1 Amb17233256 [1,1,0,0,0,0|1,0,1]=4 1556 B13R1.45 NC(=O)CCC(O)c1ccccc1 Amb17335290 [1,1,0,0,0,0|1,0,0]=3 1557 B13R1.45 NC(=O)CCC(O)c1ccccn1 Amb17335401 [1,1,0,0,0,0|2,0,0]=4 1558 B13R1.45 NC(=O)CCC(O)c1cccnc1 Amb17335403 [1,1,0,0,0,0|2,0,0]=4 1559 B13R1.45 NC(=O)CCC(O)c1ccncc1 Amb17335405 [1,1,0,0,0,0|2,0,0]=4 1560 B13R1.45 NC(=O)NCC(O)c1ccccc1 Amb9248137 [1,1,0,0,0,0|2,0,0]=4 1561 B13R1.45 NC(=O)OCC(O)c1ccccc1 Amb17594650 [1,1,0,0,0,0|2,0,0]=4 1562 B13R1.45 NC(CCC(=O)O)c1ccccc1 Amb19514853 [1,1,0,0,0,0|0,0,0]=2 1563 B13R1.45 NC(CCC(=O)O)c1ccccc1 Amb9781823 [1,1,0,0,0,0|0,0,0]=2 1564 B13R1.45 NC(CCC(=O)O)c1ccccn1 Amb32953630 [1,1,0,0,0,0|1,0,0]=3 1565 B13R1.45 NC(CCC(=O)O)c1cccnc1 Amb2697486 [1,1,0,0,0,0|1,0,0]=3 1566 B13R1.45 NC(CCC(=O)O)c1ccncc1 Amb33079854 [1,1,0,0,0,0|1,0,0]=3 1567 B13R1.45 NC(CCC(=O)O)c1ccncn1 Amb33269322 [1,1,0,0,0,0|2,0,0]=4 1568 B13R1.45 NC(CCC(=O)O)c1cnccn1 Amb33380764 [1,1,0,0,0,0|2,0,0]=4 1569 B13R1.45 NC(CCC(=O)O)c1cncnc1 Amb33429948 [1,1,0,0,0,0|2,0,0]=4 1570 B13R1.45 NC(CCC(=O)O)c1ncccn1 Amb33225280 [1,1,0,0,0,0|2,0,0]=4 1571 B13R1.45 N[C@@H](CCC(=O)O)c1ccccc1 Amb22745911 [1,1,0,0,0,0|0,0,0]=2 1572 B13R1.45 N[C@H](CCC(=O)O)c1ccccc1 Amb33801866 [1,1,0,0,0,0|0,0,0]=2 1573 B13R1.45 O=C(O)CCC(=O)c1ccccc1 Amb1224638 [1,1,0,0,0,0|0,0,1]=3 1574 B13R1.45 O=C(O)CCC(=O)c1ccccn1 Amb2689987 [1,1,0,0,0,0|1,0,1]=4 1575 B13R1.45 O=C(O)CCC(=O)c1ccccn1 Amb33038255 [1,1,0,0,0,0|1,0,1]=4 1576 B13R1.45 O=C(O)CCC(=O)c1cccnc1 Amb1091971 [1,1,0,0,0,0|1,0,1]=4 1577 B13R1.45 O=C(O)CCC(=O)c1ccncc1 Amb33330476 [1,1,0,0,0,0|1,0,1]=4 1578 B13R1.45 O=C(O)CCC(=O)c1ccncc1 Amb6305252 [1,1,0,0,0,0|1,0,1]=4 1579 B13R1.45 O=C(O)CCC(O)c1ccccc1 Amb2721927 [1,1,0,0,0,0|0,0,0]=2 1580 B13R1.45 O=C(O)CCC(O)c1ccccn1 Amb18824244 [1,1,0,0,0,0|1,0,0]=3 1581 B13R1.45 O=C(O)CCC(O)c1cccnc1 Amb18805211 [1,1,0,0,0,0|1,0,0]=3 1582 B13R1.45 O=C(O)CCC(O)c1ccncc1 Amb18193342 [1,1,0,0,0,0|1,0,0]=3 1583 B13R1.45 O=C(O)CNC(=O)c1ccccc1 Amb1006961 [1,1,0,0,0,0|1,0,1]=4 1584 B13R1.45 O=C(O)CNC(=S)c1ccccc1 Amb24309476 [1,1,0,0,0,0|1,0,1]=4 1585 B13R1.45 O=C(O)COC(=O)c1ccccc1 Amb17594607 [1,1,0,0,0,0|1,0,1]=4 1586 B13R1.45 O=C(O)CSC(=S)c1ccccc1 Amb2762718 [1,1,0,0,0,0|1,0,1]=4 1587 B13R1.149 C=C(Br)CCCc1cccc(Cl)c1 Amb13890656 [1,1,0,0,0,0|1,0,1]=4 1588 B13R1.149 CC(=O)CCCc1cccc(Br)c1 Amb17255477 [1,1,0,0,0,0|0,0,0]=2 1589 B13R1.149 CC(=O)CCCc1cccc(C)c1 Amb17233199 [1,1,0,0,0,0|0,0,0]=2 1590 B13R1.149 CC(=O)CCCc1cccc(Cl)c1 Amb17236502 [1,1,0,0,0,0|0,0,0]=2 1591 B13R1.149 CC(=O)CCNc1cccc(C)c1 Amb27259362 [1,1,0,0,0,0|1,0,0]=3 1592 B13R1.149 CC(=O)CCOc1cccc(C)c1 Amb7777348 [1,1,0,0,0,0|1,0,0]=3 1593 B13R1.149 CC(=O)CCOc1cccc(Cl)c1 Amb17139724 [1,1,0,0,0,0|1,0,0]=3 1594 B13R1.149 CC(=O)CCOc1cccc(F)c1 Amb7777353 [1,1,0,0,0,0|1,0,0]=3 1595 B13R1.149 CC(=O)CCOc1cccc(N)c1 Amb4422083 [1,1,0,0,0,0|1,0,0]=3 1596 B13R1.149 CC(=O)CCSc1cccc(Br)c1 Amb32682896 [1,1,0,0,0,0|1,0,0]=3 1597 B13R1.149 CC(=O)CCSc1cccc(C)c1 Amb19042835 [1,1,0,0,0,0|1,0,0]=3 1598 B13R1.149 CC(=O)CCSc1cccc(Cl)c1 Amb32682921 [1,1,0,0,0,0|1,0,0]=3 1599 B13R1.149 CC(=O)CCSc1cccc(F)c1 Amb32682926 [1,1,0,0,0,0|1,0,0]=3 1600 B13R1.149 CC(=O)CSCc1cccc(C)c1 Amb19063166 [1,1,0,0,0,0|1,0,0]=3 1601 B13R1.149 CC(=O)C\C=C\c1cccc(Br)c1 Amb26905228 [1,1,0,0,0,0|0,0,2]=4 1602 B13R1.149 CC(=O)NCCc1cccc(Br)c1 Amb27985315 [1,1,0,0,0,0|1,0,0]=3 1603 B13R1.149 CC(=O)NCCc1cccc(N)c1 Amb28291587 [1,1,0,0,0,0|1,0,0]=3 1604 B13R1.149 CC(=O)NCCc1cccc(O)c1 Amb26946233 [1,1,0,0,0,0|1,0,0]=3 1605 B13R1.149 CC(=O)OCCc1cccc(N)c1 Amb28556007 [1,1,0,0,0,0|1,0,0]=3 1606 B13R1.149 CC(C)=CCCc1cccc(Br)c1 Amb35623558 [1,1,0,0,0,0|1,0,1]=4 1607 B13R1.149 CC(C)=CCCc1cccc(C)c1 Amb22227609 [1,1,0,0,0,0|1,0,1]=4 1608 B13R1.149 CC(C)=CCCc1cccc(Cl)c1 Amb35588027 [1,1,0,0,0,0|1,0,1]=4 1609 B13R1.149 CC(C)=CCCc1cccc(F)c1 Amb35588019 [1,1,0,0,0,0|1,0,1]=4 1610 B13R1.149 CC(N)CCCc1cccc(Br)c1 Amb17255966 [1,1,0,0,0,0|1,0,1]=4 1611 B13R1.149 CC(N)CCCc1cccc(Cl)c1 Amb17236682 [1,1,0,0,0,0|1,0,1]=4 1612 B13R1.149 CC(O)CCCc1cccc(Br)c1 Amb33242567 [1,1,0,0,0,0|0,0,2]=4 1613 B13R1.149 CN(C)CCCc1cccc(N)c1 Amb17050706 [1,1,0,0,0,0|2,0,0]=4 1614 B13R1.149 CN(O)CCCc1cccc(Br)c1 Amb33434160 [1,1,0,0,0,0|1,0,1]=4 1615 B13R1.149 CS(=O)CCNc1cccc(Br)c1 Amb28430219 [1,1,0,0,0,0|2,0,0]=4 1616 B13R1.149 CS(=O)CCNc1cccc(Cl)c1 Amb27786008 [1,1,0,0,0,0|2,0,0]=4 1617 B13R1.149 CS(=O)CCNc1cccc(F)c1 Amb27779998 [1,1,0,0,0,0|2,0,0]=4 1618 B13R1.149 C[C@@H](N)CCCc1cccc(Br)c1 Amb33433747 [1,1,0,0,0,0|1,0,1]=4 1619 B13R1.149 C[C@@H](O)CCCc1cccc(Br)c1 Amb33433759 [1,1,0,0,0,0|0,0,2]=4 1620 B13R1.149 C[C@H](N)CCCc1cccc(Br)c1 Amb33433749 [1,1,0,0,0,0|1,0,1]=4 1621 B13R1.149 C[C@H](O)CCCc1cccc(Br)c1 Amb33433757 [1,1,0,0,0,0|0,0,2]=4 1622 B13R1.149 Cc1cc(CCCC(=O)O)ccn1 Amb32733008 [1,1,0,0,0,0|1,0,0]=3 1623 B13R1.149 Cc1cc(CCCC(=O)O)ncn1 Amb18193940 [1,1,0,0,0,0|2,0,0]=4 1624 B13R1.149 Cc1cc(NCCC(=O)O)ccn1 Amb27432719 [1,1,0,0,0,0|2,0,0]=4 1625 B13R1.149 Cc1cccc(C#CCC(=O)O)c1 Amb24494657 [1,1,0,0,0,0|0,0,2]=4 1626 B13R1.149 Cc1cccc(CCCC(=O)O)c1 Amb3932920 [1,1,0,0,0,0|0,0,0]=2 1627 B13R1.149 Cc1cccc(CCCC(=O)O)n1 Amb32429836 [1,1,0,0,0,0|1,0,0]=3 1628 B13R1.149 Cc1cccc(CCCC(C)N)c1 Amb17233314 [1,1,0,0,0,0|1,0,1]=4 1629 B13R1.149 Cc1cccc(CCCC(N)=O)n1 Amb32429826 [1,1,0,0,0,0|2,0,0]=4 1630 B13R1.149 Cc1cccc(CCNC(=O)Cl)c1 Amb35625795 [1,1,0,0,0,0|2,0,0]=4 1631 B13R1.149 Cc1cccc(CNCC(=O)O)c1 Amb1110883 [1,1,0,0,0,0|1,0,0]=3 1632 B13R1.149 Cc1cccc(CNCC(=O)O)c1 Amb19341149 [1,1,0,0,0,0|1,0,0]=3 1633 B13R1.149 Cc1cccc(COCC(=O)O)c1 Amb17470624 [1,1,0,0,0,0|1,0,0]=3 1634 B13R1.149 Cc1cccc(COCC(=O)O)n1 Amb32946367 [1,1,0,0,0,0|2,0,0]=4 1635 B13R1.149 Cc1cccc(CSCC(=O)O)c1 Amb6718310 [1,1,0,0,0,0|1,0,0]=3 1636 B13R1.149 Cc1cccc(C\C=C\C(=O)O)c1 Amb27407070 [1,1,0,0,0,0|0,0,2]=4 1637 B13R1.149 Cc1cccc(NCCC(=O)O)c1 Amb2209157 [1,1,0,0,0,0|1,0,0]=3 1638 B13R1.149 Cc1cccc(NCCC(N)=O)c1 Amb8841800 [1,1,0,0,0,0|2,0,0]=4 1639 B13R1.149 Cc1cccc(NCCS(C)=O)c1 Amb27852279 [1,1,0,0,0,0|2,0,0]=4 1640 B13R1.149 Cc1cccc(OCCC(=O)Cl)c1 Amb6743374 [1,1,0,0,0,0|2,0,0]=4 1641 B13R1.149 Cc1cccc(OCCC(=O)O)c1 Amb1102786 [1,1,0,0,0,0|1,0,0]=3 1642 B13R1.149 Cc1cccc(OCCC(N)=O)c1 Amb8997688 [1,1,0,0,0,0|2,0,0]=4 1643 B13R1.149 Cc1cccc(SCCC(=O)Cl)c1 Amb17143636 [1,1,0,0,0,0|2,0,0]=4 1644 B13R1.149 Cc1cccc(SCCC(N)=O)c1 Amb17143163 [1,1,0,0,0,0|2,0,0]=4 1645 B13R1.149 Cc1cccc(\C=C\CC(=O)O)c1 Amb28119838 [1,1,0,0,0,0|0,0,2]=4 1646 B13R1.149 Cc1ccnc(CCCC(=O)O)c1 Amb32429824 [1,1,0,0,0,0|1,0,0]=3 1647 B13R1.149 Cc1ccnc(CCCC(=O)O)n1 Amb18862970 [1,1,0,0,0,0|2,0,0]=4 1648 B13R1.149 Cc1cncc(CCCC(=O)O)c1 Amb33317649 [1,1,0,0,0,0|1,0,0]=3 1649 B13R1.149 Cc1cncc(CCCC(=O)O)n1 Amb18824524 [1,1,0,0,0,0|2,0,0]=4 1650 B13R1.149 Cc1nccc(CCCC(=O)O)n1 Amb18193848 [1,1,0,0,0,0|2,0,0]=4 1651 B13R1.149 N=C(N)CCCc1cccc(Br)c1 Amb33433798 [1,1,0,0,0,0|2,0,0]=4 1652 B13R1.149 NC(=O)CCNc1cccc(Br)c1 Amb8841799 [1,1,0,0,0,0|2,0,0]=4 1653 B13R1.149 NC(=O)CCNc1cccc(Cl)c1 Amb8841803 [1,1,0,0,0,0|2,0,0]=4 1654 B13R1.149 NC(=O)CCNc1cccc(F)c1 Amb8841804 [1,1,0,0,0,0|2,0,0]=4 1655 B13R1.149 NC(=O)CCNc1cccc(I)c1 Amb9209196 [1,1,0,0,0,0|2,0,0]=4 1656 B13R1.149 NC(=O)CCNc1cccc(N)c1 Amb9415700 [1,1,0,0,0,0|2,0,0]=4 1657 B13R1.149 NC(=O)CCOc1cccc(F)c1 Amb8858809 [1,1,0,0,0,0|2,0,0]=4 1658 B13R1.149 NC(=O)CCOc1cccc(N)c1 Amb8842884 [1,1,0,0,0,0|2,0,0]=4 1659 B13R1.149 NC(=S)CCCc1cccc(Br)c1 Amb33433801 [1,1,0,0,0,0|1,1,0]=4 1660 B13R1.149 Nc1cccc(C#CCC(=O)O)c1 Amb25330991 [1,1,0,0,0,0|0,0,2]=4 1661 B13R1.149 Nc1cccc(CCCC(=O)O)c1 Amb10603728 [1,1,0,0,0,0|0,0,0]=2 1662 B13R1.149 Nc1cccc(CCCC(=O)O)c1 Amb17335328 [1,1,0,0,0,0|0,0,0]=2 1663 B13R1.149 Nc1cccc(SCCC(=O)O)c1 Amb19662090 [1,1,0,0,0,0|1,0,0]=3 1664 B13R1.149 O=C(Cl)NCCc1cccc(Br)c1 Amb35625619 [1,1,0,0,0,0|2,0,0]=4 1665 B13R1.149 O=C(Cl)NCCc1cccc(F)c1 Amb35625483 [1,1,0,0,0,0|2,0,0]=4 1666 B13R1.149 O=C(Cl)OCCc1cccc(Br)c1 Amb33297105 [1,1,0,0,0,0|2,0,0]=4 1667 B13R1.149 O=C(O)C#CCc1cccc(Br)c1 Amb27812566 [1,1,0,0,0,0|0,0,2]=4 1668 B13R1.149 O=C(O)C#CCc1cccc(Cl)c1 Amb27480229 [1,1,0,0,0,0|0,0,2]=4 1669 B13R1.149 O=C(O)CC#Cc1cccc(Br)c1 Amb26932151 [1,1,0,0,0,0|0,0,2]=4 1670 B13R1.149 O=C(O)CC#Cc1cccc(Cl)c1 Amb26978437 [1,1,0,0,0,0|0,0,2]=4 1671 B13R1.149 O=C(O)CC#Cc1cccc(F)c1 Amb26981997 [1,1,0,0,0,0|0,0,2]=4 1672 B13R1.149 O=C(O)CC#Cc1cccc(I)c1 Amb26507236 [1,1,0,0,0,0|0,0,2]=4 1673 B13R1.149 O=C(O)CC#Cc1cccc(O)c1 Amb27172177 [1,1,0,0,0,0|0,0,2]=4 1674 B13R1.149 O=C(O)CCCc1cc(Cl)ccn1 Amb33406498 [1,1,0,0,0,0|1,0,0]=3 1675 B13R1.149 O=C(O)CCCc1cc(F)ccn1 Amb33450179 [1,1,0,0,0,0|1,0,0]=3 1676 B13R1.149 O=C(O)CCCc1cc(O)ncn1 Amb18224737 [1,1,0,0,0,0|2,0,0]=4 1677 B13R1.149 O=C(O)CCCc1cccc(Br)c1 Amb3932918 [1,1,0,0,0,0|0,0,0]=2 1678 B13R1.149 O=C(O)CCCc1cccc(Br)n1 Amb33262823 [1,1,0,0,0,0|1,0,0]=3 1679 B13R1.149 O=C(O)CCCc1cccc(Cl)c1 Amb3932874 [1,1,0,0,0,0|0,0,0]=2 1680 B13R1.149 O=C(O)CCCc1cccc(Cl)n1 Amb33403801 [1,1,0,0,0,0|1,0,0]=3 1681 B13R1.149 O=C(O)CCCc1cccc(F)c1 Amb3932921 [1,1,0,0,0,0|0,0,0]=2 1682 B13R1.149 O=C(O)CCCc1cccc(O)c1 Amb22490497 [1,1,0,0,0,0|0,0,0]=2 1683 B13R1.149 O=C(O)CCCc1ccnc(Cl)c1 Amb33261615 [1,1,0,0,0,0|1,0,0]=3 1684 B13R1.149 O=C(O)CCCc1ccnc(O)n1 Amb18192777 [1,1,0,0,0,0|2,0,0]=4 1685 B13R1.149 O=C(O)CCCc1cncc(Br)c1 Amb33241658 [1,1,0,0,0,0|1,0,0]=3 1686 B13R1.149 O=C(O)CCCc1cncc(F)c1 Amb33172373 [1,1,0,0,0,0|1,0,0]=3 1687 B13R1.149 O=C(O)CCCc1nccc(O)n1 Amb18863008 [1,1,0,0,0,0|2,0,0]=4 1688 B13R1.149 O=C(O)CCNc1cccc(Br)c1 Amb7766525 [1,1,0,0,0,0|1,0,0]=3 1689 B13R1.149 O=C(O)CCNc1cccc(Cl)c1 Amb2209166 [1,1,0,0,0,0|1,0,0]=3 1690 B13R1.149 O=C(O)CCNc1cccc(Cl)n1 Amb18130766 [1,1,0,0,0,0|2,0,0]=4 1691 B13R1.149 O=C(O)CCNc1cccc(F)c1 Amb2209162 [1,1,0,0,0,0|1,0,0]=3 1692 B13R1.149 O=C(O)CCNc1cccc(I)c1 Amb7785453 [1,1,0,0,0,0|1,0,0]=3 1693 B13R1.149 O=C(O)CCNc1cccc(O)c1 Amb4422097 [1,1,0,0,0,0|1,0,0]=3 1694 B13R1.149 O=C(O)CCNc1ccnc(Cl)c1 Amb28139434 [1,1,0,0,0,0|2,0,0]=4 1695 B13R1.149 O=C(O)CCNc1cncc(Cl)c1 Amb29864723 [1,1,0,0,0,0|2,0,0]=4 1696 B13R1.149 O=C(O)CCOc1cccc(Br)c1 Amb15755 [1,1,0,0,0,0|1,0,0]=3 1697 B13R1.149 O=C(O)CCOc1cccc(Cl)c1 Amb1116710 [1,1,0,0,0,0|1,0,0]=3 1698 B13R1.149 O=C(O)CCOc1cccc(I)c1 Amb8838599 [1,1,0,0,0,0|1,0,0]=3 1699 B13R1.149 O=C(O)CCOc1cccc(O)c1 Amb18192782 [1,1,0,0,0,0|1,0,0]=3 1700 B13R1.149 O=C(O)CCSc1cccc(Cl)c1 Amb5775182 [1,1,0,0,0,0|1,0,0]=3 1701 B13R1.149 O=C(O)CNCc1cccc(Br)c1 Amb1111229 [1,1,0,0,0,0|1,0,0]=3 1702 B13R1.149 O=C(O)CNCc1cccc(Cl)c1 Amb17598410 [1,1,0,0,0,0|1,0,0]=3 1703 B13R1.149 O=C(O)CNCc1cccc(Cl)c1 Amb8827651 [1,1,0,0,0,0|1,0,0]=3 1704 B13R1.149 O=C(O)CNCc1cccc(F)c1 Amb10609867 [1,1,0,0,0,0|1,0,0]=3 1705 B13R1.149 O=C(O)CNCc1cccc(F)c1 Amb2372412 [1,1,0,0,0,0|1,0,0]=3 1706 B13R1.149 O=C(O)CNCc1ccnc(Br)c1 Amb21861857 [1,1,0,0,0,0|2,0,0]=4 1707 B13R1.149 O=C(O)COCC1=CC(=O)NC=C1 Amb32668873 [1,1,0,0,0,0|2,0,0]=4 1708 B13R1.149 O=C(O)COCc1cc(Cl)ccn1 Amb32946171 [1,1,0,0,0,0|2,0,0]=4 1709 B13R1.149 O=C(O)COCc1cccc(Br)c1 Amb17472946 [1,1,0,0,0,0|1,0,0]=3 1710 B13R1.149 O=C(O)COCc1cccc(Cl)c1 Amb17470999 [1,1,0,0,0,0|1,0,0]=3 1711 B13R1.149 O=C(O)COCc1cccc(F)c1 Amb32409782 [1,1,0,0,0,0|1,0,0]=3 1712 B13R1.149 O=C(O)COCc1cccc(I)c1 Amb32661302 [1,1,0,0,0,0|1,0,0]=3 1713 B13R1.149 O=C(O)COCc1ccnc(Br)c1 Amb32946268 [1,1,0,0,0,0|2,0,0]=4 1714 B13R1.149 O=C(O)CSCc1cccc(Br)c1 Amb6372198 [1,1,0,0,0,0|1,0,0]=3 1715 B13R1.149 O=C(O)CSCc1cccc(Cl)c1 Amb1546534 [1,1,0,0,0,0|1,0,0]=3 1716 B13R1.149 O=C(O)CSCc1cccc(F)c1 Amb1137816 [1,1,0,0,0,0|1,0,0]=3 1717 B13R1.149 O=C(O)C\C=C\c1cccc(Br)c1 Amb23441782 [1,1,0,0,0,0|0,0,2]=4 1718 B13R1.149 O=C(O)C\C=C\c1cccc(F)c1 Amb23441778 [1,1,0,0,0,0|0,0,2]=4 1719 B13R1.149 O=C(O)C\N=C\c1cccc(O)c1 Amb27877242 [1,1,0,0,0,0|1,0,1]=4 1720 B13R1.149 O=C(O)\C=C\Cc1cccc(Cl)c1 Amb27232777 [1,1,0,0,0,0|0,0,2]=4 1721 B13R1.149 O=C(O)\C=C\Cc1cccc(F)c1 Amb27955207 [1,1,0,0,0,0|0,0,2]=4 1722 B13R1.149 O=[N+]([O-])CCCc1cccc(Br)c1 Amb33433438 [1,1,0,0,0,0|1,0,1]=4 1723 B13R1.158 C=C(Br)CCCc1ccccc1C Amb13890664 [1,1,0,0,0,0|1,0,1]=4 1724 B13R1.158 C=C(C)CCNc1ccccc1C Amb27174738 [1,1,0,0,0,0|2,0,0]=4 1725 B13R1.158 C=C(C)CCNc1ccccc1N Amb27790840 [1,1,0,0,0,0|2,0,0]=4 1726 B13R1.158 C=C(C)CNCc1ccccc1Cl Amb17317898 [1,1,0,0,0,0|2,0,0]=4 1727 B13R1.158 C=C(C)CNCc1ccccc1F Amb17309099 [1,1,0,0,0,0|2,0,0]=4 1728 B13R1.158 C=C(C)CNCc1ccccc1O Amb33098597 [1,1,0,0,0,0|2,0,0]=4 1729 B13R1.158 CC(=O)CCCc1ccccc1C Amb17233198 [1,1,0,0,0,0|0,0,0]=2 1730 B13R1.158 CC(=O)CCCc1ccccc1Cl Amb17236501 [1,1,0,0,0,0|0,0,0]=2 1731 B13R1.158 CC(=O)CCCc1ccccc1F Amb17233676 [1,1,0,0,0,0|0,0,0]=2 1732 B13R1.158 CC(=O)CCNc1ccccc1O Amb28388299 [1,1,0,0,0,0|1,0,0]=3 1733 B13R1.158 CC(=O)CCOc1ccccc1C Amb7777349 [1,1,0,0,0,0|1,0,0]=3 1734 B13R1.158 CC(=O)CCOc1ccccc1Cl Amb17139723 [1,1,0,0,0,0|1,0,0]=3 1735 B13R1.158 CC(=O)CCOc1ccccc1F Amb7777344 [1,1,0,0,0,0|1,0,0]=3 1736 B13R1.158 CC(=O)CCSc1ccccc1Br Amb9229575 [1,1,0,0,0,0|1,0,0]=3 1737 B13R1.158 CC(=O)CCSc1ccccc1C Amb19051952 [1,1,0,0,0,0|1,0,0]=3 1738 B13R1.158 CC(=O)CCSc1ccccc1Cl Amb9224162 [1,1,0,0,0,0|1,0,0]=3 1739 B13R1.158 CC(=O)CCSc1ccccc1F Amb9224177 [1,1,0,0,0,0|1,0,0]=3 1740 B13R1.158 CC(=O)CSCc1ccccc1C Amb18330489 [1,1,0,0,0,0|1,0,0]=3 1741 B13R1.158 CC(=O)CSCc1ccccc1Cl Amb32683019 [1,1,0,0,0,0|1,0,0]=3 1742 B13R1.158 CC(=O)C\C=C\c1ccccc1F Amb25693688 [1,1,0,0,0,0|0,0,2]=4 1743 B13R1.158 CC(=O)C\C=C\c1ccccc1O Amb25058690 [1,1,0,0,0,0|0,0,2]=4 1744 B13R1.158 CC(=O)NCCc1ccccc1Br Amb13133608 [1,1,0,0,0,0|1,0,0]=3 1745 B13R1.158 CC(=O)NCCc1ccccc1Cl Amb25324158 [1,1,0,0,0,0|1,0,0]=3 1746 B13R1.158 CC(=O)NCCc1ccccc1N Amb27180309 [1,1,0,0,0,0|1,0,0]=3 1747 B13R1.158 CC(=O)NCCc1ccccc1O Amb16982301 [1,1,0,0,0,0|1,0,0]=3 1748 B13R1.158 CC(=O)NCCc1cccnc1Br Amb28319510 [1,1,0,0,0,0|2,0,0]=4 1749 B13R1.158 CC(=O)NCCc1ncccc1C Amb35579988 [1,1,0,0,0,0|2,0,0]=4 1750 B13R1.158 CC(=O)NOCc1ccccc1Br Amb28283840 [1,1,0,0,0,0|2,0,0]=4 1751 B13R1.158 CC(=O)\C=C\Cc1ccccc1N Amb27832813 [1,1,0,0,0,0|0,0,2]=4 1752 B13R1.158 CC(C)=CCCc1ccccc1C Amb35582933 [1,1,0,0,0,0|1,0,1]=4 1753 B13R1.158 CC(C)=CCCc1ccccc1Cl Amb35588028 [1,1,0,0,0,0|1,0,1]=4 1754 B13R1.158 CC(C)=CCCc1ccccc1F Amb35588017 [1,1,0,0,0,0|1,0,1]=4 1755 B13R1.158 CC(N)CCCc1ccccc1Cl Amb17236681 [1,1,0,0,0,0|1,0,1]=4 1756 B13R1.158 CC(N)CCCc1ccccc1F Amb17233820 [1,1,0,0,0,0|1,0,1]=4 1757 B13R1.158 CN(C)CCCc1ccccc1N Amb17050681 [1,1,0,0,0,0|2,0,0]=4 1758 B13R1.158 CS(=O)CCNc1ccccc1I Amb27855612 [1,1,0,0,0,0|2,0,0]=4 1759 B13R1.158 Cc1ccccc1C#CCC(=O)O Amb24659626 [1,1,0,0,0,0|0,0,2]=4 1760 B13R1.158 Cc1ccccc1CCCC(=O)O Amb3932873 [1,1,0,0,0,0|0,0,0]=2 1761 B13R1.158 Cc1ccccc1CCCC(C)N Amb17233313 [1,1,0,0,0,0|1,0,1]=4 1762 B13R1.158 Cc1ccccc1CNCC(=O)O Amb10609879 [1,1,0,0,0,0|1,0,0]=3 1763 B13R1.158 Cc1ccccc1CNCC(=O)O Amb2372498 [1,1,0,0,0,0|1,0,0]=3 1764 B13R1.158 Cc1ccccc1COCC(=O)O Amb17470623 [1,1,0,0,0,0|1,0,0]=3 1765 B13R1.158 Cc1ccccc1CSCC(=O)O Amb1125979 [1,1,0,0,0,0|1,0,0]=3 1766 B13R1.158 Cc1ccccc1NCCC(=O)O Amb382805 [1,1,0,0,0,0|1,0,0]=3 1767 B13R1.158 Cc1ccccc1NCCC(N)=O Amb8841174 [1,1,0,0,0,0|2,0,0]=4 1768 B13R1.158 Cc1ccccc1NCCS(C)=O Amb27620836 [1,1,0,0,0,0|2,0,0]=4 1769 B13R1.158 Cc1ccccc1OCCC(=O)O Amb1102807 [1,1,0,0,0,0|1,0,0]=3 1770 B13R1.158 Cc1ccccc1\C=C\CC(=O)O Amb25362135 [1,1,0,0,0,0|0,0,2]=4 1771 B13R1.158 Cc1cccnc1CCCC(=O)O Amb33359672 [1,1,0,0,0,0|1,0,0]=3 1772 B13R1.158 Cc1ccncc1CCCC(=O)O Amb32954447 [1,1,0,0,0,0|1,0,0]=3 1773 B13R1.158 Cc1cnccc1CCCC(=O)O Amb33372287 [1,1,0,0,0,0|1,0,0]=3 1774 B13R1.158 Cc1ncccc1CCCC(=O)O Amb32878341 [1,1,0,0,0,0|1,0,0]=3 1775 B13R1.158 Cc1nccnc1CCCC(=O)O Amb33141636 [1,1,0,0,0,0|2,0,0]=4 1776 B13R1.158 Cc1ncncc1CCCC(=O)O Amb33149430 [1,1,0,0,0,0|2,0,0]=4 1777 B13R1.158 NC(=O)CCCc1ccccc1Cl Amb22552422 [1,1,0,0,0,0|1,0,0]=3 1778 B13R1.158 NC(=O)CCNc1ccccc1Br Amb8842938 [1,1,0,0,0,0|2,0,0]=4 1779 B13R1.158 NC(=O)CCNc1ccccc1Cl Amb453182 [1,1,0,0,0,0|2,0,0]=4 1780 B13R1.158 NC(=O)CCNc1ccccc1F Amb8841827 [1,1,0,0,0,0|2,0,0]=4 1781 B13R1.158 NC(=O)CCNc1ccccc1N Amb19514743 [1,1,0,0,0,0|2,0,0]=4 1782 B13R1.158 NC(=O)CCNc1ccccc1N Amb2226251 [1,1,0,0,0,0|2,0,0]=4 1783 B13R1.158 NC(=O)CCNc1ccccc1O Amb27230062 [1,1,0,0,0,0|2,0,0]=4 1784 B13R1.158 NC(=O)CCOc1ccccc1Cl Amb8998805 [1,1,0,0,0,0|2,0,0]=4 1785 B13R1.158 NC(=O)CCOc1ccccc1F Amb8997723 [1,1,0,0,0,0|2,0,0]=4 1786 B13R1.158 NC(=O)CCOc1ccccc1N Amb8842883 [1,1,0,0,0,0|2,0,0]=4 1787 B13R1.158 NC(=O)CCSc1ccccc1Cl Amb8997756 [1,1,0,0,0,0|2,0,0]=4 1788 B13R1.158 NC(=O)CCSc1ccccc1F Amb8998280 [1,1,0,0,0,0|2,0,0]=4 1789 B13R1.158 NC(=O)CCSc1ccccc1N Amb8842981 [1,1,0,0,0,0|2,0,0]=4 1790 B13R1.158 NC(=O)NCCc1ccccc1Cl Amb24627934 [1,1,0,0,0,0|2,0,0]=4 1791 B13R1.158 NC(=O)NCCc1ccccc1O Amb28048054 [1,1,0,0,0,0|2,0,0]=4 1792 B13R1.158 Nc1ccccc1C#CCC(=O)O Amb28253025 [1,1,0,0,0,0|0,0,2]=4 1793 B13R1.158 Nc1ccccc1CCCC(=O)O Amb2697307 [1,1,0,0,0,0|0,0,0]=2 1794 B13R1.158 Nc1ccccc1CCCC(=O)O Amb32789702 [1,1,0,0,0,0|0,0,0]=2 1795 B13R1.158 Nc1ccccc1OCCC(=O)O Amb22728037 [1,1,0,0,0,0|1,0,0]=3 1796 B13R1.158 Nc1cccnc1SCCC(=O)O Amb19014211 [1,1,0,0,0,0|2,0,0]=4 1797 B13R1.158 Nc1ncccc1OCCC(=O)O Amb17206788 [1,1,0,0,0,0|2,0,0]=4 1798 B13R1.158 O=C(Cl)CCOc1ccccc1Cl Amb17143748 [1,1,0,0,0,0|2,0,0]=4 1799 B13R1.158 O=C(Cl)CCSc1ccccc1Cl Amb17144559 [1,1,0,0,0,0|2,0,0]=4 1800 B13R1.158 O=C(Cl)NCCc1ccccc1F Amb35625505 [1,1,0,0,0,0|2,0,0]=4 1801 B13R1.158 O=C(Cl)OCCc1ccccc1Br Amb33297174 [1,1,0,0,0,0|2,0,0]=4 1802 B13R1.158 O=C(O)C#CCc1ccccc1Br Amb29860818 [1,1,0,0,0,0|0,0,2]=4 1803 B13R1.158 O=C(O)C#CCc1ccccc1F Amb27799632 [1,1,0,0,0,0|0,0,2]=4 1804 B13R1.158 O=C(O)CC#Cc1ccccc1Br Amb25775933 [1,1,0,0,0,0|0,0,2]=4 1805 B13R1.158 O=C(O)CC#Cc1ccccc1Cl Amb24686712 [1,1,0,0,0,0|0,0,2]=4 1806 B13R1.158 O=C(O)CC#Cc1ccccc1F Amb25953926 [1,1,0,0,0,0|0,0,2]=4 1807 B13R1.158 O=C(O)CC#Cc1ccccc1O Amb25352437 [1,1,0,0,0,0|0,0,2]=4 1808 B13R1.158 O=C(O)CCCN1C=CC=CC1=O Amb18028573 [1,1,0,0,0,0|1,0,0]=3 1809 B13R1.158 O=C(O)CCCN1N=CC=CC1=O Amb19036170 [1,1,0,0,0,0|2,0,0]=4 1810 B13R1.158 O=C(O)CCCc1ccccc1Br Amb33545182 [1,1,0,0,0,0|0,0,0]=2 1811 B13R1.158 O=C(O)CCCc1ccccc1Cl Amb3932916 [1,1,0,0,0,0|0,0,0]=2 1812 B13R1.158 O=C(O)CCCc1ccccc1F Amb3932910 [1,1,0,0,0,0|0,0,0]=2 1813 B13R1.158 O=C(O)CCCc1ccccc1O Amb4009785 [1,1,0,0,0,0|0,0,0]=2 1814 B13R1.158 O=C(O)CCCc1cccnc1Br Amb33388113 [1,1,0,0,0,0|1,0,0]=3 1815 B13R1.158 O=C(O)CCCc1cccnc1Cl Amb33257386 [1,1,0,0,0,0|1,0,0]=3 1816 B13R1.158 O=C(O)CCCc1cccnc1F Amb33377146 [1,1,0,0,0,0|1,0,0]=3 1817 B13R1.158 O=C(O)CCCc1ccncc1Br Amb33478366 [1,1,0,0,0,0|1,0,0]=3 1818 B13R1.158 O=C(O)CCCc1ccncc1Cl Amb33406975 [1,1,0,0,0,0|1,0,0]=3 1819 B13R1.158 O=C(O)CCCc1ccncc1F Amb33316822 [1,1,0,0,0,0|1,0,0]=3 1820 B13R1.158 O=C(O)CCCc1ncccc1Br Amb33243031 [1,1,0,0,0,0|1,0,0]=3 1821 B13R1.158 O=C(O)CCCc1ncccc1F Amb33418426 [1,1,0,0,0,0|1,0,0]=3 1822 B13R1.158 O=C(O)CCNc1ccccc1Br Amb7766524 [1,1,0,0,0,0|1,0,0]=3 1823 B13R1.158 O=C(O)CCNc1ccccc1Cl Amb2209165 [1,1,0,0,0,0|1,0,0]=3 1824 B13R1.158 O=C(O)CCNc1ccccc1F Amb2209161 [1,1,0,0,0,0|1,0,0]=3 1825 B13R1.158 O=C(O)CCNc1cccnc1Cl Amb18093072 [1,1,0,0,0,0|2,0,0]=4 1826 B13R1.158 O=C(O)CCNc1ccncc1F Amb30036427 [1,1,0,0,0,0|2,0,0]=4 1827 B13R1.158 O=C(O)CCOC1=CC=CNC1=O Amb18537464 [1,1,0,0,0,0|2,0,0]=4 1828 B13R1.158 O=C(O)CCOc1ccccc1Br Amb1117859 [1,1,0,0,0,0|1,0,0]=3 1829 B13R1.158 O=C(O)CCOc1ccccc1Cl Amb1112357 [1,1,0,0,0,0|1,0,0]=3 1830 B13R1.158 O=C(O)CCOc1ccccc1F Amb1102819 [1,1,0,0,0,0|1,0,0]=3 1831 B13R1.158 O=C(O)CCOc1ccccc1I Amb9339536 [1,1,0,0,0,0|1,0,0]=3 1832 B13R1.158 O=C(O)CCSc1ccccc1Br Amb1113939 [1,1,0,0,0,0|1,0,0]=3 1833 B13R1.158 O=C(O)CCSc1ccccc1Cl Amb1102789 [1,1,0,0,0,0|1,0,0]=3 1834 B13R1.158 O=C(O)CCSc1ccccc1F Amb56946 [1,1,0,0,0,0|1,0,0]=3 1835 B13R1.158 O=C(O)CNCc1ccccc1Br Amb1111282 [1,1,0,0,0,0|1,0,0]=3 1836 B13R1.158 O=C(O)CNCc1ccccc1Cl Amb7766478 [1,1,0,0,0,0|1,0,0]=3 1837 B13R1.158 O=C(O)CNCc1ccccc1F Amb7761999 [1,1,0,0,0,0|1,0,0]=3 1838 B13R1.158 O=C(O)CNCc1ccccc1I Amb21861671 [1,1,0,0,0,0|1,0,0]=3 1839 B13R1.158 O=C(O)COCc1ccccc1Br Amb32669719 [1,1,0,0,0,0|1,0,0]=3 1840 B13R1.158 O=C(O)COCc1ccccc1Cl Amb6266832 [1,1,0,0,0,0|1,0,0]=3 1841 B13R1.158 O=C(O)COCc1ccccc1F Amb17470662 [1,1,0,0,0,0|1,0,0]=3 1842 B13R1.158 O=C(O)COCc1ccccc1I Amb32669720 [1,1,0,0,0,0|1,0,0]=3 1843 B13R1.158 O=C(O)CSCc1ccccc1Br Amb2372136 [1,1,0,0,0,0|1,0,0]=3 1844 B13R1.158 O=C(O)CSCc1ccccc1Cl Amb1551137 [1,1,0,0,0,0|1,0,0]=3 1845 B13R1.158 O=C(O)CSCc1ccccc1F Amb844941 [1,1,0,0,0,0|1,0,0]=3 1846 B13R1.158 O=C(O)CSCc1ccccc1I Amb24089653 [1,1,0,0,0,0|1,0,0]=3 1847 B13R1.158 O=C(O)C\C=C\c1ccccc1F Amb20622523 [1,1,0,0,0,0|0,0,2]=4 1848 B13R1.158 O=C(O)C\N=C\c1ccccc1O Amb26481398 [1,1,0,0,0,0|1,0,1]=4 1849 B13R1.158 O=C([O-])CCSc1ccccc1F Amb34916627 [1,1,0,0,0,0|1,0,1]=4 1850 B13R1.348 CC(=N)NC(C)Cc1ccccc1 Amb27460929 [1,1,0,0,0,0|2,0,0]=4 1851 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 Amb15692856 [1,1,0,0,0,0|0,0,1]=3 1852 B13R1.348 CC(=O)CC(=O)Nc1ccccc1 Amb1210069 [1,1,0,0,0,0|1,0,1]=4 1853 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [1,1,0,0,0,0|1,0,1]=4 1854 B13R1.348 CC(=O)CC(=S)Nc1ccccc1 Amb25190045 [1,1,0,0,0,0|1,0,1]=4 1855 B13R1.348 CC(=O)CC(C)Sc1ccccc1 Amb32683051 [1,1,0,0,0,0|1,0,0]=3 1856 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [1,1,0,0,0,0|1,0,0]=3 1857 B13R1.348 CC(=O)C\C(C)=C\c1ccccc1 Amb17778970 [1,1,0,0,0,0|0,0,2]=4 1858 B13R1.348 CC(=O)C\C(C)=N/c1ccccc1 Amb2610547 [1,1,0,0,0,0|1,0,1]=4 1859 B13R1.348 CC(=O)NC(C)Cc1ccccc1 Amb8503527 [1,1,0,0,0,0|1,0,0]=3 1860 B13R1.348 CC(=O)NC(C)Cc1ccccn1 Amb35596262 [1,1,0,0,0,0|2,0,0]=4 1861 B13R1.348 CC(=O)NC(O)Cc1ccccc1 Amb28132759 [1,1,0,0,0,0|1,0,0]=3 1862 B13R1.348 CC(=O)\C=C(/C)Cc1ccccc1 Amb17778969 [1,1,0,0,0,0|0,0,2]=4 1863 B13R1.348 CC(C)=CC(O)Cc1ccccc1 Amb27262321 [1,1,0,0,0,0|1,0,1]=4 1864 B13R1.348 CC(C)CC(Br)Cc1ccccc1 Amb18049557 [1,1,0,0,0,0|1,0,1]=4 1865 B13R1.348 CC(C)CC(N)Cc1ccccc1 Amb2237290 [1,1,0,0,0,0|1,0,1]=4 1866 B13R1.348 CC(C)CC(N)Cc1ccccc1 Amb2592669 [1,1,0,0,0,0|1,0,1]=4 1867 B13R1.348 CC(CC(=O)O)Cc1ccccc1 Amb17233403 [1,1,0,0,0,0|0,0,0]=2 1868 B13R1.348 CC(CC(=O)O)Cc1ccccn1 Amb17335285 [1,1,0,0,0,0|1,0,0]=3 1869 B13R1.348 CC(CC(=O)O)Cc1cccnc1 Amb17335287 [1,1,0,0,0,0|1,0,0]=3 1870 B13R1.348 CC(CC(=O)O)Cc1ccncc1 Amb17335288 [1,1,0,0,0,0|1,0,0]=3 1871 B13R1.348 CC(CC(=O)O)Nc1ccccc1 Amb9398389 [1,1,0,0,0,0|1,0,0]=3 1872 B13R1.348 CC(CC(=O)O)Oc1ccccc1 Amb9397751 [1,1,0,0,0,0|1,0,0]=3 1873 B13R1.348 CC(CC(=O)O)Sc1ccccn1 Amb9398091 [1,1,0,0,0,0|2,0,0]=4 1874 B13R1.348 CC(CC(N)=O)Nc1ccccc1 Amb17233441 [1,1,0,0,0,0|2,0,0]=4 1875 B13R1.348 CC(CC(N)=O)Oc1ccccc1 Amb17233539 [1,1,0,0,0,0|2,0,0]=4 1876 B13R1.348 CC(Cc1ccccc1)NC(=O)Cl Amb35625792 [1,1,0,0,0,0|2,0,0]=4 1877 B13R1.348 CC(Cc1ccccc1)OC(=O)Cl Amb33297088 [1,1,0,0,0,0|2,0,0]=4 1878 B13R1.348 CN(C)CC(N)Cc1ccccc1 Amb34913780 [1,1,0,0,0,0|2,0,0]=4 1879 B13R1.348 CN(C)CC(N)Cc1ccccc1 Amb5493964 [1,1,0,0,0,0|2,0,0]=4 1880 B13R1.348 CN(C)C[C@@H](N)Cc1ccccc1 Amb34198855 [1,1,0,0,0,0|2,0,0]=4 1881 B13R1.348 CN(C)C[C@H](N)Cc1ccccc1 Amb34198854 [1,1,0,0,0,0|2,0,0]=4 1882 B13R1.348 CN(CC(=O)O)Cc1ccccc1 Amb33551957 [1,1,0,0,0,0|1,0,0]=3 1883 B13R1.348 CN(CC(=O)O)Cc1ccccc1 Amb5768759 [1,1,0,0,0,0|1,0,0]=3 1884 B13R1.348 CN(CC(=O)O)Cc1ccccn1 Amb22586726 [1,1,0,0,0,0|2,0,0]=4 1885 B13R1.348 CN(CC(=O)O)Cc1ccccn1 Amb2721931 [1,1,0,0,0,0|2,0,0]=4 1886 B13R1.348 CN(CC(=O)O)Cc1cccnc1 Amb21955498 [1,1,0,0,0,0|2,0,0]=4 1887 B13R1.348 CN(CC(=O)O)Cc1cccnc1 Amb2721930 [1,1,0,0,0,0|2,0,0]=4 1888 B13R1.348 CN(CC(=O)O)Cc1ccncc1 Amb22586727 [1,1,0,0,0,0|2,0,0]=4 1889 B13R1.348 CN(CC(=O)O)Cc1ccncc1 Amb9301019 [1,1,0,0,0,0|2,0,0]=4 1890 B13R1.348 C[C@@H](CC(=O)O)Nc1ccccc1 Amb26519867 [1,1,0,0,0,0|1,0,0]=3 1891 B13R1.348 C[C@H](CC(=O)O)Nc1ccccc1 Amb8397199 [1,1,0,0,0,0|1,0,0]=3 1892 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [1,1,0,0,0,0|2,0,0]=4 1893 B13R1.348 C\C(=C/C(=O)O)Cc1ccccc1 Amb17233183 [1,1,0,0,0,0|0,0,2]=4 1894 B13R1.348 C\C(=C/c1ccccc1)CC(=O)O Amb17594482 [1,1,0,0,0,0|0,0,2]=4 1895 B13R1.348 NC(=O)CC(N)Cc1ccccc1 Amb32787647 [1,1,0,0,0,0|1,0,0]=3 1896 B13R1.348 NC(=O)CN(N)Cc1ccccc1 Amb27268266 [1,1,0,0,0,0|2,0,0]=4 1897 B13R1.348 NC(CC(=O)O)Cc1ccccc1 Amb20623358 [1,1,0,0,0,0|0,0,0]=2 1898 B13R1.348 NC(CC(=O)O)Cc1ccccc1 Amb8631754 [1,1,0,0,0,0|0,0,0]=2 1899 B13R1.348 NC(CC(=O)O)Cc1ccccn1 Amb17470627 [1,1,0,0,0,0|1,0,0]=3 1900 B13R1.348 NC(CC(=O)O)Cc1cccnc1 Amb17470630 [1,1,0,0,0,0|1,0,0]=3 1901 B13R1.348 NC(CC(=O)O)Cc1ccncc1 Amb17470634 [1,1,0,0,0,0|1,0,0]=3 1902 B13R1.348 N[C@@H](CC(=O)O)Cc1ccccc1 Amb16184010 [1,1,0,0,0,0|0,0,0]=2 1903 B13R1.348 N[C@@H](CC(=O)O)Cc1ccccc1 Amb2697591 [1,1,0,0,0,0|0,0,0]=2 1904 B13R1.348 N[C@@H](CC(=O)O)Cc1cccnc1 Amb33933974 [1,1,0,0,0,0|1,0,0]=3 1905 B13R1.348 N[C@@H](CC(=O)O)Cc1ccncc1 Amb33726055 [1,1,0,0,0,0|1,0,0]=3 1906 B13R1.348 N[C@H](CC(=O)O)Cc1ccccc1 Amb2699235 [1,1,0,0,0,0|0,0,0]=2 1907 B13R1.348 N[C@H](CC(=O)O)Cc1ccccc1 Amb8629294 [1,1,0,0,0,0|0,0,0]=2 1908 B13R1.348 N[C@H](CC(=O)O)Cc1cccnc1 Amb22746342 [1,1,0,0,0,0|1,0,0]=3 1909 B13R1.348 N[C@H](CC(=O)O)Cc1ccncc1 Amb22746344 [1,1,0,0,0,0|1,0,0]=3 1910 B13R1.348 O=C(O)CC(=O)Nc1ccccc1 Amb2436726 [1,1,0,0,0,0|1,0,1]=4 1911 B13R1.348 O=C(O)CC(Br)Cc1ccccc1 Amb18111137 [1,1,0,0,0,0|0,0,0]=2 1912 B13R1.348 O=C(O)CC(Cl)Cc1ccccc1 Amb18111136 [1,1,0,0,0,0|0,0,0]=2 1913 B13R1.348 O=C(O)CC(O)Cc1ccccc1 Amb17233662 [1,1,0,0,0,0|0,0,0]=2 1914 B13R1.348 O=C(O)C[C@@H](O)Cc1ccccc1 Amb32951764 [1,1,0,0,0,0|0,0,0]=2 1915 B13R1.348 O=C(O)C[C@H](O)Cc1ccccc1 Amb33082324 [1,1,0,0,0,0|0,0,0]=2 1916 B13R1.348 [2H]C(C=C(C)C)Cc1ccccc1 Amb22546630 [1,1,0,0,0,0|1,0,1]=4 1917 B13R1.351 C=C(C)C(O)CNc1ccccc1 Amb29875610 [1,1,0,0,0,0|2,0,0]=4 1918 B13R1.351 C=C(CCc1ccccc1)C(=O)O Amb18127719 [1,1,0,0,0,0|0,0,1]=3 1919 B13R1.351 CC(=O)C(=O)NCc1ccccc1 Amb17400597 [1,1,0,0,0,0|1,0,1]=4 1920 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [1,1,0,0,0,0|1,0,1]=4 1921 B13R1.351 CC(=O)C(C)OCc1ccccc1 Amb16231123 [1,1,0,0,0,0|1,0,0]=3 1922 B13R1.351 CC(=O)C(C)SCc1ccccc1 Amb9216163 [1,1,0,0,0,0|1,0,0]=3 1923 B13R1.351 CC(=O)C(O)\C=C\c1ccccc1 Amb27861376 [1,1,0,0,0,0|0,0,2]=4 1924 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 Amb24492590 [1,1,0,0,0,0|1,0,0]=3 1925 B13R1.351 CC(=O)\C(C)=N\Cc1ccccc1 Amb25130600 [1,1,0,0,0,0|1,0,1]=4 1926 B13R1.351 CC(C)C(N)CCc1ccccc1 Amb8869744 [1,1,0,0,0,0|1,0,1]=4 1927 B13R1.351 CC(C)C(O)CCc1ccccc1 Amb18034016 [1,1,0,0,0,0|1,0,1]=4 1928 B13R1.351 CC(CCc1ccccc1)C(=O)O Amb4011190 [1,1,0,0,0,0|0,0,0]=2 1929 B13R1.351 CC(CCc1ccccn1)C(=O)O Amb17335286 [1,1,0,0,0,0|1,0,0]=3 1930 B13R1.351 CC(CCc1cccnc1)C(=O)O Amb17233532 [1,1,0,0,0,0|1,0,0]=3 1931 B13R1.351 CC(CCc1ccncc1)C(=O)O Amb17335289 [1,1,0,0,0,0|1,0,0]=3 1932 B13R1.351 CC(CCc1ccncn1)C(=O)O Amb33267952 [1,1,0,0,0,0|2,0,0]=4 1933 B13R1.351 CC(CCc1cnccn1)C(=O)O Amb33429871 [1,1,0,0,0,0|2,0,0]=4 1934 B13R1.351 CC(CCc1cncnc1)C(=O)O Amb32876140 [1,1,0,0,0,0|2,0,0]=4 1935 B13R1.351 CC(CCc1ncccn1)C(=O)O Amb33269918 [1,1,0,0,0,0|2,0,0]=4 1936 B13R1.351 CC(CNc1ccccc1)C(=O)O Amb9400301 [1,1,0,0,0,0|1,0,0]=3 1937 B13R1.351 CC(CNc1ccccc1)C(N)=O Amb8944556 [1,1,0,0,0,0|2,0,0]=4 1938 B13R1.351 CC(CNc1ccncc1)C(=O)O Amb19027731 [1,1,0,0,0,0|2,0,0]=4 1939 B13R1.351 CC(COc1ccccc1)C(=O)O Amb9394526 [1,1,0,0,0,0|1,0,0]=3 1940 B13R1.351 CC(COc1ccccc1)C(N)=O Amb17233540 [1,1,0,0,0,0|2,0,0]=4 1941 B13R1.351 CC(CSc1ccccc1)C(=O)O Amb9400034 [1,1,0,0,0,0|1,0,0]=3 1942 B13R1.351 CC(CSc1ccccn1)C(=O)O Amb9400043 [1,1,0,0,0,0|2,0,0]=4 1943 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb10199880 [1,1,0,0,0,0|1,0,0]=3 1944 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb9704488 [1,1,0,0,0,0|1,0,0]=3 1945 B13R1.351 CC(NCc1ccccn1)C(=O)O Amb10609128 [1,1,0,0,0,0|2,0,0]=4 1946 B13R1.351 CC(NCc1ccccn1)C(=O)O Amb1110995 [1,1,0,0,0,0|2,0,0]=4 1947 B13R1.351 CC(NCc1cccnc1)C(=O)O Amb10199875 [1,1,0,0,0,0|2,0,0]=4 1948 B13R1.351 CC(NCc1cccnc1)C(=O)O Amb1110808 [1,1,0,0,0,0|2,0,0]=4 1949 B13R1.351 CC(NCc1ccncc1)C(=O)O Amb9326995 [1,1,0,0,0,0|2,0,0]=4 1950 B13R1.351 CC(O)C(C)CCc1ccccc1 Amb32944830 [1,1,0,0,0,0|0,0,2]=4 1951 B13R1.351 CC(OCc1ccccc1)C(=O)O Amb6280663 [1,1,0,0,0,0|1,0,0]=3 1952 B13R1.351 CC(OCc1ccccc1)C(N)=O Amb9004024 [1,1,0,0,0,0|2,0,0]=4 1953 B13R1.351 CC(OCc1ccccn1)C(=O)O Amb32662745 [1,1,0,0,0,0|2,0,0]=4 1954 B13R1.351 CC(OCc1ccccn1)C(=O)O Amb32663141 [1,1,0,0,0,0|2,0,0]=4 1955 B13R1.351 CC(OCc1cccnc1)C(=O)O Amb32662717 [1,1,0,0,0,0|2,0,0]=4 1956 B13R1.351 CC(OCc1cccnc1)C(=O)O Amb32662837 [1,1,0,0,0,0|2,0,0]=4 1957 B13R1.351 CC(OCc1ccncc1)C(=O)O Amb28556093 [1,1,0,0,0,0|2,0,0]=4 1958 B13R1.351 CC(OCc1ccncc1)C(=O)O Amb32662726 [1,1,0,0,0,0|2,0,0]=4 1959 B13R1.351 CC(SCc1ccccc1)C(=O)O Amb9710523 [1,1,0,0,0,0|1,0,0]=3 1960 B13R1.351 CC(\C=C\c1ccccc1)C(=O)O Amb18127714 [1,1,0,0,0,0|0,0,2]=4 1961 B13R1.351 CN(CCc1ccccc1)C(=O)Cl Amb33620302 [1,1,0,0,0,0|2,0,0]=4 1962 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)O Amb16185448 [1,1,0,0,0,0|1,0,0]=3 1963 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)O Amb6357814 [1,1,0,0,0,0|1,0,0]=3 1964 B13R1.351 C[C@@H](\C=C\c1ccccc1)C(=O)O Amb27592192 [1,1,0,0,0,0|0,0,2]=4 1965 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O Amb26326642 [1,1,0,0,0,0|1,0,0]=3 1966 B13R1.351 C[C@H](OCc1ccccc1)C(=O)O Amb25072743 [1,1,0,0,0,0|1,0,0]=3 1967 B13R1.351 C[C@H](OCc1ccccc1)C(N)=O Amb27411933 [1,1,0,0,0,0|2,0,0]=4 1968 B13R1.351 C[C@H](\C=C\c1ccccc1)C(=O)O Amb27179112 [1,1,0,0,0,0|0,0,2]=4 1969 B13R1.351 NC(=O)C(N)CCc1ccccc1 Amb19035976 [1,1,0,0,0,0|1,0,0]=3 1970 B13R1.351 NC(=O)C(N)CCc1ccccn1 Amb33036746 [1,1,0,0,0,0|2,0,0]=4 1971 B13R1.351 NC(=O)C(N)CCc1cccnc1 Amb32796900 [1,1,0,0,0,0|2,0,0]=4 1972 B13R1.351 NC(=O)C(N)CCc1ccncc1 Amb33309222 [1,1,0,0,0,0|2,0,0]=4 1973 B13R1.351 NC(=O)C(N)CNc1ccccc1 Amb28324229 [1,1,0,0,0,0|2,0,0]=4 1974 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb33309501 [1,1,0,0,0,0|0,0,0]=2 1975 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb4134816 [1,1,0,0,0,0|0,0,0]=2 1976 B13R1.351 NC(CCc1ccccn1)C(=O)O Amb1101108 [1,1,0,0,0,0|1,0,0]=3 1977 B13R1.351 NC(CCc1ccccn1)C(=O)O Amb24117831 [1,1,0,0,0,0|1,0,0]=3 1978 B13R1.351 NC(CCc1cccnc1)C(=O)O Amb8385705 [1,1,0,0,0,0|1,0,0]=3 1979 B13R1.351 NC(CCc1cccnn1)C(=O)O Amb33036496 [1,1,0,0,0,0|2,0,0]=4 1980 B13R1.351 NC(CCc1ccncc1)C(=O)O Amb17470633 [1,1,0,0,0,0|1,0,0]=3 1981 B13R1.351 NC(CCc1ccncc1)C(=O)O Amb32795038 [1,1,0,0,0,0|1,0,0]=3 1982 B13R1.351 NC(CCc1cnccn1)C(=O)O Amb33065886 [1,1,0,0,0,0|2,0,0]=4 1983 B13R1.351 NC(CSc1ccccc1)C(=O)O Amb18325246 [1,1,0,0,0,0|1,0,0]=3 1984 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb6295860 [1,1,0,0,0,0|0,0,0]=2 1985 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb8393714 [1,1,0,0,0,0|0,0,0]=2 1986 B13R1.351 N[C@@H](CCc1ccccn1)C(=O)O Amb33065409 [1,1,0,0,0,0|1,0,0]=3 1987 B13R1.351 N[C@@H](CCc1cccnc1)C(=O)O Amb33066201 [1,1,0,0,0,0|1,0,0]=3 1988 B13R1.351 N[C@@H](CCc1cccnn1)C(=O)O Amb33033603 [1,1,0,0,0,0|2,0,0]=4 1989 B13R1.351 N[C@@H](CCc1ccncc1)C(=O)O Amb33036545 [1,1,0,0,0,0|1,0,0]=3 1990 B13R1.351 N[C@@H](CCc1cnccn1)C(=O)O Amb33066161 [1,1,0,0,0,0|2,0,0]=4 1991 B13R1.351 N[C@@H](CNc1ccccc1)C(=O)O Amb26880836 [1,1,0,0,0,0|1,0,0]=3 1992 B13R1.351 N[C@@H](CSc1ccccc1)C(=O)O Amb6357272 [1,1,0,0,0,0|1,0,0]=3 1993 B13R1.351 N[C@@H](\C=C\c1ccccc1)C(=O)O Amb2694855 [1,1,0,0,0,0|0,0,2]=4 1994 B13R1.351 N[C@H](CCc1ccccc1)C(=O)O Amb6357139 [1,1,0,0,0,0|0,0,0]=2 1995 B13R1.351 N[C@H](CCc1ccccn1)C(=O)O Amb33036457 [1,1,0,0,0,0|1,0,0]=3 1996 B13R1.351 N[C@H](CCc1cccnc1)C(=O)O Amb33308822 [1,1,0,0,0,0|1,0,0]=3 1997 B13R1.351 N[C@H](CCc1cccnn1)C(=O)O Amb33066114 [1,1,0,0,0,0|2,0,0]=4 1998 B13R1.351 N[C@H](CCc1ccncc1)C(=O)O Amb32941145 [1,1,0,0,0,0|1,0,0]=3 1999 B13R1.351 N[C@H](CCc1cnccn1)C(=O)O Amb33308904 [1,1,0,0,0,0|2,0,0]=4 2000 B13R1.351 O=C(O)C(=O)CCc1ccccc1 Amb8391159 [1,1,0,0,0,0|0,0,1]=3 2001 B13R1.351 O=C(O)C(=O)NCc1ccccc1 Amb838961 [1,1,0,0,0,0|1,0,1]=4 2002 B13R1.351 O=C(O)C(=O)OCc1ccccc1 Amb18128558 [1,1,0,0,0,0|1,0,1]=4 2003 B13R1.351 O=C(O)C(=S)NCc1ccccc1 Amb27645460 [1,1,0,0,0,0|1,0,1]=4 2004 B13R1.351 O=C(O)C(Br)CCc1ccccc1 Amb18662872 [1,1,0,0,0,0|0,0,0]=2 2005 B13R1.351 O=C(O)C(O)CCc1ccccc1 Amb2718777 [1,1,0,0,0,0|0,0,0]=2 2006 B13R1.351 O=C(O)C(O)CNc1ccccc1 Amb27179092 [1,1,0,0,0,0|1,0,0]=3 2007 B13R1.351 O=C(O)C(O)\C=C\c1ccccc1 Amb17594531 [1,1,0,0,0,0|0,0,2]=4 2008 B13R1.351 O=C(O)[C@@H](O)CCc1ccccc1 Amb10603260 [1,1,0,0,0,0|0,0,0]=2 2009 B13R1.351 O=C(O)[C@H](O)CCc1ccccc1 Amb8628145 [1,1,0,0,0,0|0,0,0]=2 2010 B13R1.351 O=C(O)[C@H](O)\C=C\c1ccccc1 Amb26621099 [1,1,0,0,0,0|0,0,2]=4 2011 B13R1.351 O=C([O-])C(=O)CCc1ccccc1 Amb32662535 [1,1,0,0,0,0|0,0,2]=4 2012 B13R1.513 C=C(C)CCCc1ccc(C)cc1 Amb13890673 [1,1,0,0,0,0|1,0,0]=3 2013 B13R1.513 C=C(C)CCNc1ccc(N)cc1 Amb27211534 [1,1,0,0,0,0|2,0,0]=4 2014 B13R1.513 C=C(C)CNCc1ccc(C)cc1 Amb17308891 [1,1,0,0,0,0|2,0,0]=4 2015 B13R1.513 C=C(C)CNCc1ccc(Cl)cc1 Amb17309084 [1,1,0,0,0,0|2,0,0]=4 2016 B13R1.513 C=C(C)CNCc1ccc(F)cc1 Amb17308876 [1,1,0,0,0,0|2,0,0]=4 2017 B13R1.513 C=C(C)CSCc1ccc(N)cc1 Amb17498611 [1,1,0,0,0,0|2,0,0]=4 2018 B13R1.513 C=C(Cl)CCCc1ccc(F)cc1 Amb13890683 [1,1,0,0,0,0|1,0,1]=4 2019 B13R1.513 CC(=N)NCCc1ccc(Br)cc1 Amb27826811 [1,1,0,0,0,0|2,0,0]=4 2020 B13R1.513 CC(=O)CCCc1ccc(Br)cc1 Amb17255478 [1,1,0,0,0,0|0,0,0]=2 2021 B13R1.513 CC(=O)CCCc1ccc(C)cc1 Amb17233200 [1,1,0,0,0,0|0,0,0]=2 2022 B13R1.513 CC(=O)CCCc1ccc(Cl)cc1 Amb17236503 [1,1,0,0,0,0|0,0,0]=2 2023 B13R1.513 CC(=O)CCCc1ccc(F)cc1 Amb17233677 [1,1,0,0,0,0|0,0,0]=2 2024 B13R1.513 CC(=O)CCNc1ccc(Cl)cc1 Amb27415740 [1,1,0,0,0,0|1,0,0]=3 2025 B13R1.513 CC(=O)CCOc1ccc(C)cc1 Amb7777317 [1,1,0,0,0,0|1,0,0]=3 2026 B13R1.513 CC(=O)CCOc1ccc(Cl)cc1 Amb17139725 [1,1,0,0,0,0|1,0,0]=3 2027 B13R1.513 CC(=O)CCOc1ccc(F)cc1 Amb7777350 [1,1,0,0,0,0|1,0,0]=3 2028 B13R1.513 CC(=O)CCSc1ccc(Br)cc1 Amb9224166 [1,1,0,0,0,0|1,0,0]=3 2029 B13R1.513 CC(=O)CCSc1ccc(C)cc1 Amb9224163 [1,1,0,0,0,0|1,0,0]=3 2030 B13R1.513 CC(=O)CCSc1ccc(Cl)cc1 Amb9224160 [1,1,0,0,0,0|1,0,0]=3 2031 B13R1.513 CC(=O)CCSc1ccc(F)cc1 Amb9224174 [1,1,0,0,0,0|1,0,0]=3 2032 B13R1.513 CC(=O)CSCc1ccc(Cl)cc1 Amb24064340 [1,1,0,0,0,0|1,0,0]=3 2033 B13R1.513 CC(=O)C\C=C\c1ccc(F)cc1 Amb33448623 [1,1,0,0,0,0|0,0,2]=4 2034 B13R1.513 CC(=O)C\C=C\c1ccc(O)cc1 Amb24747691 [1,1,0,0,0,0|0,0,2]=4 2035 B13R1.513 CC(=O)C\C=N\c1ccc(C)cc1 Amb26840629 [1,1,0,0,0,0|1,0,1]=4 2036 B13R1.513 CC(=O)NCCc1ccc(Br)cc1 Amb24451176 [1,1,0,0,0,0|1,0,0]=3 2037 B13R1.513 CC(=O)NCCc1ccc(Br)cn1 Amb24436674 [1,1,0,0,0,0|2,0,0]=4 2038 B13R1.513 CC(=O)NCCc1ccc(C)cn1 Amb29857589 [1,1,0,0,0,0|2,0,0]=4 2039 B13R1.513 CC(=O)NCCc1ccc(Cl)cc1 Amb22227659 [1,1,0,0,0,0|1,0,0]=3 2040 B13R1.513 CC(=O)NCCc1ccc(F)cn1 Amb27753652 [1,1,0,0,0,0|2,0,0]=4 2041 B13R1.513 CC(=O)NCCc1ccc(N)cc1 Amb17138877 [1,1,0,0,0,0|1,0,0]=3 2042 B13R1.513 CC(=O)NCCc1ccc(O)cc1 Amb5797418 [1,1,0,0,0,0|1,0,0]=3 2043 B13R1.513 CC(=O)NOCc1ccc(C)cc1 Amb27802096 [1,1,0,0,0,0|2,0,0]=4 2044 B13R1.513 CC(=O)OCCc1ccc(C)cc1 Amb24100708 [1,1,0,0,0,0|1,0,0]=3 2045 B13R1.513 CC(Br)CCCc1ccc(F)cc1 Amb33240208 [1,1,0,0,0,0|1,0,1]=4 2046 B13R1.513 CC(C)=CCCc1ccc(Br)cc1 Amb35623557 [1,1,0,0,0,0|1,0,1]=4 2047 B13R1.513 CC(C)=CCCc1ccc(C)cc1 Amb35582932 [1,1,0,0,0,0|1,0,1]=4 2048 B13R1.513 CC(C)=CCCc1ccc(Cl)cc1 Amb35588026 [1,1,0,0,0,0|1,0,1]=4 2049 B13R1.513 CC(C)=CCCc1ccc(F)cc1 Amb35588016 [1,1,0,0,0,0|1,0,1]=4 2050 B13R1.513 CC(C)=CCCc1ccc(O)cc1 Amb28202351 [1,1,0,0,0,0|1,0,1]=4 2051 B13R1.513 CC(N)CCCc1ccc(Br)cc1 Amb17255967 [1,1,0,0,0,0|1,0,1]=4 2052 B13R1.513 CC(N)CCCc1ccc(Cl)cc1 Amb17236683 [1,1,0,0,0,0|1,0,1]=4 2053 B13R1.513 CC(N)CCCc1ccc(F)cc1 Amb17233821 [1,1,0,0,0,0|1,0,1]=4 2054 B13R1.513 CC(O)CCCc1ccc(Br)cc1 Amb33482108 [1,1,0,0,0,0|0,0,2]=4 2055 B13R1.513 CC(O)CCCc1ccc(F)cc1 Amb33172158 [1,1,0,0,0,0|0,0,2]=4 2056 B13R1.513 CN(C)CCCc1ccc(N)cc1 Amb2691374 [1,1,0,0,0,0|2,0,0]=4 2057 B13R1.513 CN(O)CCCc1ccc(Br)cc1 Amb33332172 [1,1,0,0,0,0|1,0,1]=4 2058 B13R1.513 CN(O)CCCc1ccc(F)cc1 Amb33320033 [1,1,0,0,0,0|1,0,1]=4 2059 B13R1.513 CS(=O)CCNc1ccc(N)cc1 Amb27414824 [1,1,0,0,0,0|2,0,0]=4 2060 B13R1.513 C[C@@H](N)CCCc1ccc(Br)cc1 Amb33332205 [1,1,0,0,0,0|1,0,1]=4 2061 B13R1.513 C[C@@H](N)CCCc1ccc(F)cc1 Amb33319658 [1,1,0,0,0,0|1,0,1]=4 2062 B13R1.513 C[C@@H](O)CCCc1ccc(Br)cc1 Amb33482146 [1,1,0,0,0,0|0,0,2]=4 2063 B13R1.513 C[C@@H](O)CCCc1ccc(F)cc1 Amb33319655 [1,1,0,0,0,0|0,0,2]=4 2064 B13R1.513 C[C@H](N)CCCc1ccc(Br)cc1 Amb33332206 [1,1,0,0,0,0|1,0,1]=4 2065 B13R1.513 C[C@H](N)CCCc1ccc(F)cc1 Amb33319657 [1,1,0,0,0,0|1,0,1]=4 2066 B13R1.513 C[C@H](O)CCCc1ccc(Br)cc1 Amb33332208 [1,1,0,0,0,0|0,0,2]=4 2067 B13R1.513 C[C@H](O)CCCc1ccc(F)cc1 Amb33319656 [1,1,0,0,0,0|0,0,2]=4 2068 B13R1.513 Cc1ccc(C#CCC(=O)O)cc1 Amb26652085 [1,1,0,0,0,0|0,0,2]=4 2069 B13R1.513 Cc1ccc(CCCC(=O)Cl)cc1 Amb5739916 [1,1,0,0,0,0|1,0,0]=3 2070 B13R1.513 Cc1ccc(CCCC(=O)O)cc1 Amb2568475 [1,1,0,0,0,0|0,0,0]=2 2071 B13R1.513 Cc1ccc(CCCC(=O)O)cn1 Amb33449519 [1,1,0,0,0,0|1,0,0]=3 2072 B13R1.513 Cc1ccc(CCCC(=O)O)nc1 Amb33429861 [1,1,0,0,0,0|1,0,0]=3 2073 B13R1.513 Cc1ccc(CCCC(=O)O)nn1 Amb18193835 [1,1,0,0,0,0|2,0,0]=4 2074 B13R1.513 Cc1ccc(CCCC(C)N)cc1 Amb17233315 [1,1,0,0,0,0|1,0,1]=4 2075 B13R1.513 Cc1ccc(CCCC(N)=O)cc1 Amb17233276 [1,1,0,0,0,0|1,0,0]=3 2076 B13R1.513 Cc1ccc(CCCC(N)=S)cc1 Amb18626184 [1,1,0,0,0,0|1,1,0]=4 2077 B13R1.513 Cc1ccc(CCC[C@@H](C)N)cc1 Amb33729218 [1,1,0,0,0,0|1,0,1]=4 2078 B13R1.513 Cc1ccc(CCC[C@H](C)N)cc1 Amb33727897 [1,1,0,0,0,0|1,0,1]=4 2079 B13R1.513 Cc1ccc(CNCC(=O)O)cc1 Amb7766541 [1,1,0,0,0,0|1,0,0]=3 2080 B13R1.513 Cc1ccc(CNCC(N)=O)cc1 Amb1112534 [1,1,0,0,0,0|2,0,0]=4 2081 B13R1.513 Cc1ccc(COCC(=O)O)cc1 Amb17470625 [1,1,0,0,0,0|1,0,0]=3 2082 B13R1.513 Cc1ccc(COCC(=O)O)cn1 Amb32946164 [1,1,0,0,0,0|2,0,0]=4 2083 B13R1.513 Cc1ccc(CSCC(=O)O)cc1 Amb1211907 [1,1,0,0,0,0|1,0,0]=3 2084 B13R1.513 Cc1ccc(NCCC(=O)O)cc1 Amb2209164 [1,1,0,0,0,0|1,0,0]=3 2085 B13R1.513 Cc1ccc(NCCC(=O)O)nc1 Amb6265146 [1,1,0,0,0,0|2,0,0]=4 2086 B13R1.513 Cc1ccc(NCCC(=O)[O-])cc1 Amb2332620 [1,1,0,0,0,0|1,0,1]=4 2087 B13R1.513 Cc1ccc(NCCC(N)=O)cc1 Amb8841172 [1,1,0,0,0,0|2,0,0]=4 2088 B13R1.513 Cc1ccc(NCCS(C)=O)cc1 Amb27785320 [1,1,0,0,0,0|2,0,0]=4 2089 B13R1.513 Cc1ccc(OCCC(=O)Cl)cc1 Amb17143210 [1,1,0,0,0,0|2,0,0]=4 2090 B13R1.513 Cc1ccc(OCCC(=O)O)cc1 Amb6332253 [1,1,0,0,0,0|1,0,0]=3 2091 B13R1.513 Cc1ccc(OCCC(N)=O)cc1 Amb8858351 [1,1,0,0,0,0|2,0,0]=4 2092 B13R1.513 Cc1ccc(SCCC(=O)O)cc1 Amb1102788 [1,1,0,0,0,0|1,0,0]=3 2093 B13R1.513 Cc1ccc(\C=C\CC(=O)O)cc1 Amb6740311 [1,1,0,0,0,0|0,0,2]=4 2094 B13R1.513 Cc1cnc(CCCC(=O)O)cn1 Amb33376975 [1,1,0,0,0,0|2,0,0]=4 2095 B13R1.513 N=C(N)CCCc1ccc(Br)cc1 Amb33334095 [1,1,0,0,0,0|2,0,0]=4 2096 B13R1.513 N=C(N)CCCc1ccc(F)cc1 Amb33319179 [1,1,0,0,0,0|2,0,0]=4 2097 B13R1.513 NC(=O)CCCc1ccc(Br)cc1 Amb4005054 [1,1,0,0,0,0|1,0,0]=3 2098 B13R1.513 NC(=O)CCCc1ccc(Cl)cc1 Amb17236667 [1,1,0,0,0,0|1,0,0]=3 2099 B13R1.513 NC(=O)CCCc1ccc(F)cc1 Amb17233787 [1,1,0,0,0,0|1,0,0]=3 2100 B13R1.513 NC(=O)CCNc1ccc(Br)cc1 Amb8841798 [1,1,0,0,0,0|2,0,0]=4 2101 B13R1.513 NC(=O)CCNc1ccc(Cl)cc1 Amb8841806 [1,1,0,0,0,0|2,0,0]=4 2102 B13R1.513 NC(=O)CCNc1ccc(F)cc1 Amb1670561 [1,1,0,0,0,0|2,0,0]=4 2103 B13R1.513 NC(=O)CCNc1ccc(N)cc1 Amb19373175 [1,1,0,0,0,0|2,0,0]=4 2104 B13R1.513 NC(=O)CCNc1ccc(N)cc1 Amb9415702 [1,1,0,0,0,0|2,0,0]=4 2105 B13R1.513 NC(=O)CCOc1ccc(F)cc1 Amb8999025 [1,1,0,0,0,0|2,0,0]=4 2106 B13R1.513 NC(=O)CCOc1ccc(N)cc1 Amb8842882 [1,1,0,0,0,0|2,0,0]=4 2107 B13R1.513 NC(=O)CCSc1ccc(Cl)cc1 Amb1539927 [1,1,0,0,0,0|2,0,0]=4 2108 B13R1.513 NC(=O)CCSc1ccc(F)cc1 Amb8997701 [1,1,0,0,0,0|2,0,0]=4 2109 B13R1.513 NC(=O)CNCc1ccc(Br)cc1 Amb1120953 [1,1,0,0,0,0|2,0,0]=4 2110 B13R1.513 NC(=O)CNCc1ccc(F)cc1 Amb1118480 [1,1,0,0,0,0|2,0,0]=4 2111 B13R1.513 NC(=O)CSCc1ccc(N)cc1 Amb17497163 [1,1,0,0,0,0|2,0,0]=4 2112 B13R1.513 NC(=O)NCCc1ccc(Br)cc1 Amb28242686 [1,1,0,0,0,0|2,0,0]=4 2113 B13R1.513 NC(=O)NCCc1ccc(Cl)cc1 Amb12806713 [1,1,0,0,0,0|2,0,0]=4 2114 B13R1.513 NC(=S)CCCc1ccc(Br)cc1 Amb33334089 [1,1,0,0,0,0|1,1,0]=4 2115 B13R1.513 NC(=S)CCCc1ccc(Cl)cc1 Amb18107322 [1,1,0,0,0,0|1,1,0]=4 2116 B13R1.513 NC(=S)CCCc1ccc(F)cc1 Amb33319178 [1,1,0,0,0,0|1,1,0]=4 2117 B13R1.513 Nc1ccc(C#CCC(=O)O)cc1 Amb25341249 [1,1,0,0,0,0|0,0,2]=4 2118 B13R1.513 Nc1ccc(CCCC(=O)O)cc1 Amb3940777 [1,1,0,0,0,0|0,0,0]=2 2119 B13R1.513 Nc1ccc(CCCC(=O)O)nn1 Amb18193191 [1,1,0,0,0,0|2,0,0]=4 2120 B13R1.513 Nc1ccc(COCC(=O)O)cc1 Amb6739977 [1,1,0,0,0,0|1,0,0]=3 2121 B13R1.513 Nc1ccc(CSCC(=O)O)cc1 Amb17497517 [1,1,0,0,0,0|1,0,0]=3 2122 B13R1.513 Nc1ccc(NCCC(=O)O)cc1 Amb25060675 [1,1,0,0,0,0|1,0,0]=3 2123 B13R1.513 Nc1ccc(OCCC(=O)O)cc1 Amb19348346 [1,1,0,0,0,0|1,0,0]=3 2124 B13R1.513 Nc1ccc(OCCC(=O)O)cc1 Amb33536339 [1,1,0,0,0,0|1,0,0]=3 2125 B13R1.513 Nc1ccc(SCCC(=O)O)cc1 Amb19014210 [1,1,0,0,0,0|1,0,0]=3 2126 B13R1.513 O=C(Cl)CCCc1ccc(F)cc1 Amb5739923 [1,1,0,0,0,0|1,0,0]=3 2127 B13R1.513 O=C(Cl)CCOc1ccc(Cl)cc1 Amb17143749 [1,1,0,0,0,0|2,0,0]=4 2128 B13R1.513 O=C(Cl)CCSc1ccc(Cl)cc1 Amb17144561 [1,1,0,0,0,0|2,0,0]=4 2129 B13R1.513 O=C(Cl)CCSc1ccc(F)cc1 Amb22642142 [1,1,0,0,0,0|2,0,0]=4 2130 B13R1.513 O=C(Cl)NCCc1ccc(Br)cc1 Amb35625646 [1,1,0,0,0,0|2,0,0]=4 2131 B13R1.513 O=C(Cl)NCCc1ccc(Cl)cc1 Amb35637085 [1,1,0,0,0,0|2,0,0]=4 2132 B13R1.513 O=C(Cl)NCCc1ccc(F)cc1 Amb35637103 [1,1,0,0,0,0|2,0,0]=4 2133 B13R1.513 O=C(Cl)OCCc1ccc(Cl)cc1 Amb33297197 [1,1,0,0,0,0|2,0,0]=4 2134 B13R1.513 O=C(O)CC#Cc1ccc(Br)cc1 Amb26604725 [1,1,0,0,0,0|0,0,2]=4 2135 B13R1.513 O=C(O)CC#Cc1ccc(Cl)cc1 Amb27179199 [1,1,0,0,0,0|0,0,2]=4 2136 B13R1.513 O=C(O)CC#Cc1ccc(F)cc1 Amb25896286 [1,1,0,0,0,0|0,0,2]=4 2137 B13R1.513 O=C(O)CC#Cc1ccc(I)cc1 Amb25783158 [1,1,0,0,0,0|0,0,2]=4 2138 B13R1.513 O=C(O)CC#Cc1ccc(O)cc1 Amb24683847 [1,1,0,0,0,0|0,0,2]=4 2139 B13R1.513 O=C(O)CCCc1ccc(Br)cc1 Amb2724902 [1,1,0,0,0,0|0,0,0]=2 2140 B13R1.513 O=C(O)CCCc1ccc(Br)cn1 Amb33430085 [1,1,0,0,0,0|1,0,0]=3 2141 B13R1.513 O=C(O)CCCc1ccc(Br)nc1 Amb33388873 [1,1,0,0,0,0|1,0,0]=3 2142 B13R1.513 O=C(O)CCCc1ccc(Br)nn1 Amb18155629 [1,1,0,0,0,0|2,0,0]=4 2143 B13R1.513 O=C(O)CCCc1ccc(Cl)cc1 Amb3932917 [1,1,0,0,0,0|0,0,0]=2 2144 B13R1.513 O=C(O)CCCc1ccc(Cl)cn1 Amb33390742 [1,1,0,0,0,0|1,0,0]=3 2145 B13R1.513 O=C(O)CCCc1ccc(Cl)nc1 Amb33261752 [1,1,0,0,0,0|1,0,0]=3 2146 B13R1.513 O=C(O)CCCc1ccc(Cl)nn1 Amb18187269 [1,1,0,0,0,0|2,0,0]=4 2147 B13R1.513 O=C(O)CCCc1ccc(F)cc1 Amb2719687 [1,1,0,0,0,0|0,0,0]=2 2148 B13R1.513 O=C(O)CCCc1ccc(F)cn1 Amb33449321 [1,1,0,0,0,0|1,0,0]=3 2149 B13R1.513 O=C(O)CCCc1ccc(F)nc1 Amb33425483 [1,1,0,0,0,0|1,0,0]=3 2150 B13R1.513 O=C(O)CCCc1ccc(I)cc1 Amb6740420 [1,1,0,0,0,0|0,0,0]=2 2151 B13R1.513 O=C(O)CCCc1ccc(O)cc1 Amb10602364 [1,1,0,0,0,0|0,0,0]=2 2152 B13R1.513 O=C(O)CCCc1ncc(Br)cn1 Amb33335098 [1,1,0,0,0,0|2,0,0]=4 2153 B13R1.513 O=C(O)CCNc1ccc(Br)cc1 Amb2209168 [1,1,0,0,0,0|1,0,0]=3 2154 B13R1.513 O=C(O)CCNc1ccc(Cl)cc1 Amb2209167 [1,1,0,0,0,0|1,0,0]=3 2155 B13R1.513 O=C(O)CCNc1ccc(F)cc1 Amb2209163 [1,1,0,0,0,0|1,0,0]=3 2156 B13R1.513 O=C(O)CCOc1ccc(Br)cc1 Amb1118334 [1,1,0,0,0,0|1,0,0]=3 2157 B13R1.513 O=C(O)CCOc1ccc(Cl)cc1 Amb1115231 [1,1,0,0,0,0|1,0,0]=3 2158 B13R1.513 O=C(O)CCOc1ccc(F)cc1 Amb1119259 [1,1,0,0,0,0|1,0,0]=3 2159 B13R1.513 O=C(O)CCSc1ccc(Br)cc1 Amb1118833 [1,1,0,0,0,0|1,0,0]=3 2160 B13R1.513 O=C(O)CCSc1ccc(Cl)cc1 Amb1102804 [1,1,0,0,0,0|1,0,0]=3 2161 B13R1.513 O=C(O)CCSc1ccc(F)cc1 Amb1215312 [1,1,0,0,0,0|1,0,0]=3 2162 B13R1.513 O=C(O)CNCc1ccc(Br)cc1 Amb9204138 [1,1,0,0,0,0|1,0,0]=3 2163 B13R1.513 O=C(O)CNCc1ccc(Br)nc1 Amb21861851 [1,1,0,0,0,0|2,0,0]=4 2164 B13R1.513 O=C(O)CNCc1ccc(Cl)cc1 Amb1111327 [1,1,0,0,0,0|1,0,0]=3 2165 B13R1.513 O=C(O)CNCc1ccc(Cl)cc1 Amb15740982 [1,1,0,0,0,0|1,0,0]=3 2166 B13R1.513 O=C(O)CNCc1ccc(Cl)nc1 Amb10597607 [1,1,0,0,0,0|2,0,0]=4 2167 B13R1.513 O=C(O)CNCc1ccc(F)cc1 Amb10610178 [1,1,0,0,0,0|1,0,0]=3 2168 B13R1.513 O=C(O)CNCc1ccc(F)cc1 Amb2372201 [1,1,0,0,0,0|1,0,0]=3 2169 B13R1.513 O=C(O)CNCc1ccc(O)cc1 Amb33802292 [1,1,0,0,0,0|1,0,0]=3 2170 B13R1.513 O=C(O)COCc1ccc(Br)cc1 Amb2745250 [1,1,0,0,0,0|1,0,0]=3 2171 B13R1.513 O=C(O)COCc1ccc(Cl)cc1 Amb17471000 [1,1,0,0,0,0|1,0,0]=3 2172 B13R1.513 O=C(O)COCc1ccc(Cl)nc1 Amb32946269 [1,1,0,0,0,0|2,0,0]=4 2173 B13R1.513 O=C(O)COCc1ccc(F)cc1 Amb17470663 [1,1,0,0,0,0|1,0,0]=3 2174 B13R1.513 O=C(O)COCc1ccc(I)cc1 Amb32669721 [1,1,0,0,0,0|1,0,0]=3 2175 B13R1.513 O=C(O)CSCc1ccc(Br)cc1 Amb6337639 [1,1,0,0,0,0|1,0,0]=3 2176 B13R1.513 O=C(O)CSCc1ccc(Cl)cc1 Amb6457724 [1,1,0,0,0,0|1,0,0]=3 2177 B13R1.513 O=C(O)CSCc1ccc(Cl)nc1 Amb8862909 [1,1,0,0,0,0|2,0,0]=4 2178 B13R1.513 O=C(O)CSCc1ccc(F)cc1 Amb1210139 [1,1,0,0,0,0|1,0,0]=3 2179 B13R1.513 O=C(O)C\C=C\c1ccc(Br)cc1 Amb32644833 [1,1,0,0,0,0|0,0,2]=4 2180 B13R1.513 O=C(O)C\C=C\c1ccc(Cl)cc1 Amb18066407 [1,1,0,0,0,0|0,0,2]=4 2181 B13R1.513 O=C(O)C\C=C\c1ccc(F)cc1 Amb18065898 [1,1,0,0,0,0|0,0,2]=4 2182 B13R1.513 O=C(O)C\C=C\c1ccc(O)cc1 Amb18128099 [1,1,0,0,0,0|0,0,2]=4 2183 B13R1.513 O=C1C=CC(=NOCC(=O)O)C=C1 Amb24496821 [1,1,0,0,0,0|2,0,0]=4 2184 B13R1.513 O=C1C=CN(CCCC(=O)O)C=C1 Amb18029469 [1,1,0,0,0,0|1,0,0]=3 2185 B13R1.513 O=[N+]([O-])CCCc1ccc(Br)cc1 Amb33332477 [1,1,0,0,0,0|1,0,1]=4 2186 B13R1.513 O=[N+]([O-])CCCc1ccc(F)cc1 Amb33319639 [1,1,0,0,0,0|1,0,1]=4 2187 B13R1.3523 CC(C)(N)CCCc1ccccc1 Amb17400637 [1,1,0,0,0,0|1,0,1]=4 2188 B13R1.3523 CC(C)(O)CCCc1ccccc1 Amb17400670 [1,1,0,0,0,0|0,0,2]=4 2189 B13R1.3523 CS(=O)(=O)NCCc1ccccc1 Amb6404938 [1,1,0,0,0,0|2,0,0]=4 2190 B13R1.3523 CS(=O)(=O)OCCc1ccccc1 Amb22493888 [1,1,0,0,0,0|2,0,0]=4 2191 B13R1.3523 NS(=O)(=O)CCCc1ccccc1 Amb18322199 [1,1,0,0,0,0|1,0,1]=4 2192 B13R1.3523 O=S(=O)(Cl)CCCc1ccccc1 Amb5723610 [1,1,0,0,0,0|1,0,1]=4 2193 B13R1.3523 O=S(=O)(F)CCCc1ccccc1 Amb32719213 [1,1,0,0,0,0|1,0,1]=4 2194 B13R1.3523 O=S(=O)(O)CCNc1ccccc1 Amb4006878 [1,1,0,0,0,0|2,0,0]=4 2195 B13R1.3523 O=S(=O)(O)CNCc1ccccc1 Amb22464481 [1,1,0,0,0,0|2,0,0]=4 2196 B13R1.3523 O=S(=O)(O)NCCc1ccccc1 Amb22051654 [1,1,0,0,0,0|2,0,0]=4 2197 B13R1.11 C#CC(=O)CC(N)c1ccccc1 Amb28057634 [0,1,0,0,1,0|1,0,1]=4 2198 B13R1.11 C#CC(=O)CC(O)c1ccccc1 Amb28322020 [0,1,0,0,1,0|1,0,1]=4 2199 B13R1.11 CC(CC(=O)NN)c1ccccc1 Amb27481474 [0,1,0,0,1,0|2,0,0]=4 2200 B13R1.11 CCC(=O)CC(=O)c1ccccc1 Amb7766301 [0,1,0,0,1,0|1,0,1]=4 2201 B13R1.11 CCC(=O)CC(C)c1ccccc1 Amb17594493 [0,1,0,0,1,0|1,0,0]=3 2202 B13R1.11 CCC(=O)N[C@@H](C)c1ccccc1 Amb23091317 [0,1,0,0,1,0|2,0,0]=4 2203 B13R1.11 CCC(=O)OC(C)c1ccccc1 Amb6357162 [0,1,0,0,1,0|2,0,0]=4 2204 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,1,0,0,1,0|1,0,1]=4 2205 B13R1.11 CNC(=O)CC(C)c1ccccc1 Amb6846870 [0,1,0,0,1,0|1,0,0]=3 2206 B13R1.11 CNC(=O)CC(N)c1ccccc1 Amb6274807 [0,1,0,0,1,0|1,0,0]=3 2207 B13R1.11 CNC(=O)CC(N)c1cccnc1 Amb17233543 [0,1,0,0,1,0|2,0,0]=4 2208 B13R1.11 CNC(=O)C[C@@H](C)c1ccccc1 Amb27624580 [0,1,0,0,1,0|1,0,0]=3 2209 B13R1.11 CNC(=O)SC(C)c1ccccc1 Amb27442996 [0,1,0,0,1,0|2,0,0]=4 2210 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,1,0,0,1,0|0,0,1]=3 2211 B13R1.11 COC(=O)CC(=O)c1ccccn1 Amb21857821 [0,1,0,0,1,0|1,0,1]=4 2212 B13R1.11 COC(=O)CC(=O)c1cccnc1 Amb2691246 [0,1,0,0,1,0|1,0,1]=4 2213 B13R1.11 COC(=O)CC(=O)c1ccncc1 Amb33527282 [0,1,0,0,1,0|1,0,1]=4 2214 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [0,1,0,0,1,0|0,0,0]=2 2215 B13R1.11 COC(=O)CC(N)c1ccccc1 Amb1221582 [0,1,0,0,1,0|0,0,0]=2 2216 B13R1.11 COC(=O)CC(N)c1ccccc1 Amb2371447 [0,1,0,0,1,0|0,0,0]=2 2217 B13R1.11 COC(=O)CC(N)c1ccccn1 Amb2694058 [0,1,0,0,1,0|1,0,0]=3 2218 B13R1.11 COC(=O)CC(N)c1ccccn1 Amb7800547 [0,1,0,0,1,0|1,0,0]=3 2219 B13R1.11 COC(=O)CC(N)c1cccnc1 Amb7800505 [0,1,0,0,1,0|1,0,0]=3 2220 B13R1.11 COC(=O)CC(N)c1ccncc1 Amb2694056 [0,1,0,0,1,0|1,0,0]=3 2221 B13R1.11 COC(=O)CC(N)c1ccncc1 Amb31059602 [0,1,0,0,1,0|1,0,0]=3 2222 B13R1.11 COC(=O)CC(N)c1ccncc1 Amb7800512 [0,1,0,0,1,0|1,0,0]=3 2223 B13R1.11 COC(=O)CC(N)c1ccncn1 Amb33255045 [0,1,0,0,1,0|2,0,0]=4 2224 B13R1.11 COC(=O)CC(N)c1cnccn1 Amb33255877 [0,1,0,0,1,0|2,0,0]=4 2225 B13R1.11 COC(=O)CC(N)c1cncnc1 Amb33308348 [0,1,0,0,1,0|2,0,0]=4 2226 B13R1.11 COC(=O)CC(N)c1ncccn1 Amb32716243 [0,1,0,0,1,0|2,0,0]=4 2227 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,1,0,0,1,0|0,0,0]=2 2228 B13R1.11 COC(=O)CC(O)c1ccccn1 Amb33172097 [0,1,0,0,1,0|1,0,0]=3 2229 B13R1.11 COC(=O)CC(O)c1cccnc1 Amb33450003 [0,1,0,0,1,0|1,0,0]=3 2230 B13R1.11 COC(=O)CC(O)c1ccncc1 Amb32953953 [0,1,0,0,1,0|1,0,0]=3 2231 B13R1.11 COC(=O)CC(O)c1ccncn1 Amb33268577 [0,1,0,0,1,0|2,0,0]=4 2232 B13R1.11 COC(=O)CC(O)c1cnccn1 Amb22296209 [0,1,0,0,1,0|2,0,0]=4 2233 B13R1.11 COC(=O)CC(O)c1cncnc1 Amb33224382 [0,1,0,0,1,0|2,0,0]=4 2234 B13R1.11 COC(=O)CC(O)c1ncccn1 Amb33270053 [0,1,0,0,1,0|2,0,0]=4 2235 B13R1.11 COC(=O)CN(C)c1ccccn1 Amb18186549 [0,1,0,0,1,0|2,0,0]=4 2236 B13R1.11 COC(=O)CS(=O)c1ccccc1 Amb2774190 [0,1,0,0,1,0|1,0,0]=3 2237 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [0,1,0,0,1,0|0,0,0]=2 2238 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [0,1,0,0,1,0|0,0,0]=2 2239 B13R1.11 COC(=O)C[C@@H](N)c1ccccn1 Amb18181074 [0,1,0,0,1,0|1,0,0]=3 2240 B13R1.11 COC(=O)C[C@@H](N)c1cccnc1 Amb18181076 [0,1,0,0,1,0|1,0,0]=3 2241 B13R1.11 COC(=O)C[C@@H](N)c1ccncc1 Amb18181075 [0,1,0,0,1,0|1,0,0]=3 2242 B13R1.11 COC(=O)C[C@@H](N)c1ccncn1 Amb33255299 [0,1,0,0,1,0|2,0,0]=4 2243 B13R1.11 COC(=O)C[C@@H](N)c1cnccn1 Amb33255375 [0,1,0,0,1,0|2,0,0]=4 2244 B13R1.11 COC(=O)C[C@@H](N)c1cncnc1 Amb33255707 [0,1,0,0,1,0|2,0,0]=4 2245 B13R1.11 COC(=O)C[C@@H](N)c1ncccn1 Amb32716297 [0,1,0,0,1,0|2,0,0]=4 2246 B13R1.11 COC(=O)C[C@@H](O)c1ccccc1 Amb6357238 [0,1,0,0,1,0|0,0,0]=2 2247 B13R1.11 COC(=O)C[C@@H](O)c1ccccn1 Amb33360491 [0,1,0,0,1,0|1,0,0]=3 2248 B13R1.11 COC(=O)C[C@@H](O)c1cccnc1 Amb33360052 [0,1,0,0,1,0|1,0,0]=3 2249 B13R1.11 COC(=O)C[C@@H](O)c1ccncc1 Amb33449714 [0,1,0,0,1,0|1,0,0]=3 2250 B13R1.11 COC(=O)C[C@@H](O)c1ccncn1 Amb33268579 [0,1,0,0,1,0|2,0,0]=4 2251 B13R1.11 COC(=O)C[C@@H](O)c1cnccn1 Amb33429674 [0,1,0,0,1,0|2,0,0]=4 2252 B13R1.11 COC(=O)C[C@@H](O)c1cncnc1 Amb32876476 [0,1,0,0,1,0|2,0,0]=4 2253 B13R1.11 COC(=O)C[C@@H](O)c1ncccn1 Amb33270055 [0,1,0,0,1,0|2,0,0]=4 2254 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb17617178 [0,1,0,0,1,0|0,0,0]=2 2255 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [0,1,0,0,1,0|0,0,0]=2 2256 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb33801673 [0,1,0,0,1,0|0,0,0]=2 2257 B13R1.11 COC(=O)C[C@H](N)c1ccccn1 Amb32793676 [0,1,0,0,1,0|1,0,0]=3 2258 B13R1.11 COC(=O)C[C@H](N)c1cccnc1 Amb32793678 [0,1,0,0,1,0|1,0,0]=3 2259 B13R1.11 COC(=O)C[C@H](N)c1ccncc1 Amb32793680 [0,1,0,0,1,0|1,0,0]=3 2260 B13R1.11 COC(=O)C[C@H](N)c1ccncn1 Amb32787811 [0,1,0,0,1,0|2,0,0]=4 2261 B13R1.11 COC(=O)C[C@H](N)c1cnccn1 Amb33255635 [0,1,0,0,1,0|2,0,0]=4 2262 B13R1.11 COC(=O)C[C@H](N)c1cncnc1 Amb33255831 [0,1,0,0,1,0|2,0,0]=4 2263 B13R1.11 COC(=O)C[C@H](O)c1ccccc1 Amb8516703 [0,1,0,0,1,0|0,0,0]=2 2264 B13R1.11 COC(=O)C[C@H](O)c1ccccn1 Amb33360489 [0,1,0,0,1,0|1,0,0]=3 2265 B13R1.11 COC(=O)C[C@H](O)c1cccnc1 Amb33360051 [0,1,0,0,1,0|1,0,0]=3 2266 B13R1.11 COC(=O)C[C@H](O)c1ccncc1 Amb33079643 [0,1,0,0,1,0|1,0,0]=3 2267 B13R1.11 COC(=O)C[C@H](O)c1ccncn1 Amb33268578 [0,1,0,0,1,0|2,0,0]=4 2268 B13R1.11 COC(=O)C[C@H](O)c1cnccn1 Amb33429673 [0,1,0,0,1,0|2,0,0]=4 2269 B13R1.11 COC(=O)C[C@H](O)c1cncnc1 Amb32876475 [0,1,0,0,1,0|2,0,0]=4 2270 B13R1.11 COC(=O)C[C@H](O)c1ncccn1 Amb33270054 [0,1,0,0,1,0|2,0,0]=4 2271 B13R1.11 COC(=O)NC(=N)c1ccccc1 Amb25254191 [0,1,0,0,1,0|1,0,1]=4 2272 B13R1.11 COC(=O)NC(C)c1ccncc1 Amb27973719 [0,1,0,0,1,0|2,0,0]=4 2273 B13R1.11 COC(=O)NC(O)c1ccccc1 Amb27413659 [0,1,0,0,1,0|1,0,0]=3 2274 B13R1.11 COC(=O)N[C@@H](C)c1cccnc1 Amb27810284 [0,1,0,0,1,0|2,0,0]=4 2275 B13R1.11 COC(=O)\C=C(/N)c1ccccc1 Amb26953655 [0,1,0,0,1,0|0,0,2]=4 2276 B13R1.11 COC(=O)\C=C(\C)c1ccccc1 Amb4035457 [0,1,0,0,1,0|0,0,2]=4 2277 B13R1.11 C[C@@H](CC(=O)NN)c1ccccc1 Amb22357025 [0,1,0,0,1,0|2,0,0]=4 2278 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,1,0,0,1,0|2,0,0]=4 2279 B13R1.11 NNC(=O)C[C@H](O)c1ccccc1 Amb27980624 [0,1,0,0,1,0|2,0,0]=4 2280 B13R1.11 O=C(CC(Cl)c1ccccc1)NO Amb28121077 [0,1,0,0,1,0|2,0,0]=4 2281 B13R1.11 O=C(CC(O)c1ccccc1)NO Amb27213884 [0,1,0,0,1,0|2,0,0]=4 2282 B13R1.14 C#CC(=O)CCc1ccc(C)cc1 Amb27223328 [0,1,0,0,1,0|1,0,1]=4 2283 B13R1.14 C=CC(=O)CCc1ccc(Br)cc1 Amb33332196 [0,1,0,0,1,0|1,0,1]=4 2284 B13R1.14 C=CC(=O)CCc1ccc(F)cc1 Amb33321246 [0,1,0,0,1,0|1,0,1]=4 2285 B13R1.14 CCC(=O)CCc1ccc(Br)cc1 Amb9031662 [0,1,0,0,1,0|1,0,0]=3 2286 B13R1.14 CCC(=O)CCc1ccc(C)cc1 Amb9031666 [0,1,0,0,1,0|1,0,0]=3 2287 B13R1.14 CCC(=O)CCc1ccc(Cl)cc1 Amb9031684 [0,1,0,0,1,0|1,0,0]=3 2288 B13R1.14 CCC(=O)CCc1ccc(F)cc1 Amb8869667 [0,1,0,0,1,0|1,0,0]=3 2289 B13R1.14 CCC(=O)CCc1ccc(O)cc1 Amb22547635 [0,1,0,0,1,0|1,0,0]=3 2290 B13R1.14 CCC(=O)CNc1ccc(C)cc1 Amb28048870 [0,1,0,0,1,0|2,0,0]=4 2291 B13R1.14 CCC(=O)CSc1ccc(Br)cc1 Amb32682959 [0,1,0,0,1,0|2,0,0]=4 2292 B13R1.14 CCC(=O)CSc1ccc(C)cc1 Amb18330490 [0,1,0,0,1,0|2,0,0]=4 2293 B13R1.14 CCC(=O)CSc1ccc(Cl)cc1 Amb19415865 [0,1,0,0,1,0|2,0,0]=4 2294 B13R1.14 CCC(=O)CSc1ccc(F)cc1 Amb19083508 [0,1,0,0,1,0|2,0,0]=4 2295 B13R1.14 CCC(=O)NCc1ccc(Br)cc1 Amb27414548 [0,1,0,0,1,0|2,0,0]=4 2296 B13R1.14 CCC(=O)NCc1ccc(C)cc1 Amb2660843 [0,1,0,0,1,0|2,0,0]=4 2297 B13R1.14 CCC(=O)NCc1ccc(Cl)cc1 Amb3094823 [0,1,0,0,1,0|2,0,0]=4 2298 B13R1.14 CCC(=O)NCc1ccc(F)cc1 Amb17790296 [0,1,0,0,1,0|2,0,0]=4 2299 B13R1.14 CCC(=O)NCc1ccc(N)cc1 Amb17138876 [0,1,0,0,1,0|2,0,0]=4 2300 B13R1.14 CNC(=O)CCN1C=CC(=O)C=C1 Amb27468473 [0,1,0,0,1,0|2,0,0]=4 2301 B13R1.14 CNC(=O)CC[n+]1ccc(C)cc1 Amb28129899 [0,1,0,0,1,0|2,0,0]=4 2302 B13R1.14 CNC(=O)CCc1ccc(Br)cc1 Amb22900135 [0,1,0,0,1,0|1,0,0]=3 2303 B13R1.14 CNC(=O)CCc1ccc(Cl)cc1 Amb23223308 [0,1,0,0,1,0|1,0,0]=3 2304 B13R1.14 CNC(=O)CCc1ccc(Cl)nc1 Amb28454956 [0,1,0,0,1,0|2,0,0]=4 2305 B13R1.14 CNC(=O)CCc1ccc(F)cc1 Amb8333634 [0,1,0,0,1,0|1,0,0]=3 2306 B13R1.14 CNC(=O)CCc1ccc(N)cc1 Amb8941579 [0,1,0,0,1,0|1,0,0]=3 2307 B13R1.14 CNC(=O)COc1ccc(Br)cc1 Amb6574047 [0,1,0,0,1,0|2,0,0]=4 2308 B13R1.14 CNC(=O)COc1ccc(Cl)cc1 Amb3887039 [0,1,0,0,1,0|2,0,0]=4 2309 B13R1.14 CNC(=O)COc1ccc(F)cc1 Amb8050301 [0,1,0,0,1,0|2,0,0]=4 2310 B13R1.14 CNC(=O)COc1ccc(I)cc1 Amb15778875 [0,1,0,0,1,0|2,0,0]=4 2311 B13R1.14 CNC(=O)COc1ccc(N)cc1 Amb6252154 [0,1,0,0,1,0|2,0,0]=4 2312 B13R1.14 CNC(=O)COc1ccc(O)cc1 Amb8837272 [0,1,0,0,1,0|2,0,0]=4 2313 B13R1.14 CNC(=O)CSc1ccc(C)cc1 Amb3886966 [0,1,0,0,1,0|2,0,0]=4 2314 B13R1.14 CNC(=O)CSc1ccc(Cl)cc1 Amb2716346 [0,1,0,0,1,0|2,0,0]=4 2315 B13R1.14 CNC(=O)CSc1ccc(F)cc1 Amb8338167 [0,1,0,0,1,0|2,0,0]=4 2316 B13R1.14 CNC(=O)NCc1ccc(Br)cc1 Amb28454960 [0,1,0,0,1,0|2,0,0]=4 2317 B13R1.14 CNC(=O)NCc1ccc(C)cc1 Amb27982853 [0,1,0,0,1,0|2,0,0]=4 2318 B13R1.14 CNC(=O)NCc1ccc(Cl)cc1 Amb2132765 [0,1,0,0,1,0|2,0,0]=4 2319 B13R1.14 CNC(=O)NCc1ccc(F)cc1 Amb2132767 [0,1,0,0,1,0|2,0,0]=4 2320 B13R1.14 CNC(=O)OCc1ccc(Cl)cc1 Amb22469905 [0,1,0,0,1,0|2,0,0]=4 2321 B13R1.14 COC(=N)CCc1ccc(Br)cc1 Amb18071193 [0,1,0,0,1,0|1,0,0]=3 2322 B13R1.14 COC(=N)CCc1ccc(C)cc1 Amb18065699 [0,1,0,0,1,0|1,0,0]=3 2323 B13R1.14 COC(=N)CCc1ccc(Cl)cc1 Amb18066448 [0,1,0,0,1,0|1,0,0]=3 2324 B13R1.14 COC(=N)CCc1ccc(F)cc1 Amb18066004 [0,1,0,0,1,0|1,0,0]=3 2325 B13R1.14 COC(=N)COc1ccc(Br)cc1 Amb18071477 [0,1,0,0,1,0|2,0,0]=4 2326 B13R1.14 COC(=N)COc1ccc(C)cc1 Amb18065839 [0,1,0,0,1,0|2,0,0]=4 2327 B13R1.14 COC(=N)COc1ccc(Cl)cc1 Amb18066509 [0,1,0,0,1,0|2,0,0]=4 2328 B13R1.14 COC(=N)COc1ccc(F)cc1 Amb18066094 [0,1,0,0,1,0|2,0,0]=4 2329 B13R1.14 COC(=O)C#Cc1ccc(Br)cc1 Amb2610346 [0,1,0,0,1,0|0,0,2]=4 2330 B13R1.14 COC(=O)C#Cc1ccc(C)cc1 Amb25897551 [0,1,0,0,1,0|0,0,2]=4 2331 B13R1.14 COC(=O)C#Cc1ccc(Cl)cc1 Amb2616309 [0,1,0,0,1,0|0,0,2]=4 2332 B13R1.14 COC(=O)C#Cc1ccc(F)cc1 Amb25726510 [0,1,0,0,1,0|0,0,2]=4 2333 B13R1.14 COC(=O)C#Cc1ccc(N)cc1 Amb25257395 [0,1,0,0,1,0|0,0,2]=4 2334 B13R1.14 COC(=O)C#Cc1ccc(O)cc1 Amb25262685 [0,1,0,0,1,0|0,0,2]=4 2335 B13R1.14 COC(=O)CCc1ccc(Br)cc1 Amb15692693 [0,1,0,0,1,0|0,0,0]=2 2336 B13R1.14 COC(=O)CCc1ccc(C)cc1 Amb17400662 [0,1,0,0,1,0|0,0,0]=2 2337 B13R1.14 COC(=O)CCc1ccc(Cl)cc1 Amb1093990 [0,1,0,0,1,0|0,0,0]=2 2338 B13R1.14 COC(=O)CCc1ccc(Cl)nc1 Amb32757643 [0,1,0,0,1,0|1,0,0]=3 2339 B13R1.14 COC(=O)CCc1ccc(F)cc1 Amb17400909 [0,1,0,0,1,0|0,0,0]=2 2340 B13R1.14 COC(=O)CCc1ccc(I)cc1 Amb30640065 [0,1,0,0,1,0|0,0,0]=2 2341 B13R1.14 COC(=O)CCc1ccc(N)cc1 Amb33801551 [0,1,0,0,1,0|0,0,0]=2 2342 B13R1.14 COC(=O)CCc1ccc(N)cc1 Amb4317820 [0,1,0,0,1,0|0,0,0]=2 2343 B13R1.14 COC(=O)CCc1ccc(N)cn1 Amb33727750 [0,1,0,0,1,0|1,0,0]=3 2344 B13R1.14 COC(=O)CCc1ccc(N)nc1 Amb24183802 [0,1,0,0,1,0|1,0,0]=3 2345 B13R1.14 COC(=O)CCc1ccc(O)cc1 Amb3939191 [0,1,0,0,1,0|0,0,0]=2 2346 B13R1.14 COC(=O)CNc1ccc(Br)cc1 Amb1921801 [0,1,0,0,1,0|1,0,0]=3 2347 B13R1.14 COC(=O)CNc1ccc(Br)cn1 Amb6644273 [0,1,0,0,1,0|2,0,0]=4 2348 B13R1.14 COC(=O)CNc1ccc(C)cc1 Amb6714107 [0,1,0,0,1,0|1,0,0]=3 2349 B13R1.14 COC(=O)CNc1ccc(Cl)cc1 Amb6711990 [0,1,0,0,1,0|1,0,0]=3 2350 B13R1.14 COC(=O)CNc1ccc(F)cc1 Amb6712342 [0,1,0,0,1,0|1,0,0]=3 2351 B13R1.14 COC(=O)CNc1ccc(F)cn1 Amb19045363 [0,1,0,0,1,0|2,0,0]=4 2352 B13R1.14 COC(=O)CNc1ccc(N)cc1 Amb7767916 [0,1,0,0,1,0|1,0,0]=3 2353 B13R1.14 COC(=O)CNc1ccc(N)cn1 Amb1120232 [0,1,0,0,1,0|2,0,0]=4 2354 B13R1.14 COC(=O)CNc1ccc(N)nc1 Amb7767908 [0,1,0,0,1,0|2,0,0]=4 2355 B13R1.14 COC(=O)CNc1ccc(O)cc1 Amb10604010 [0,1,0,0,1,0|1,0,0]=3 2356 B13R1.14 COC(=O)CNc1ccc(O)cc1 Amb10604138 [0,1,0,0,1,0|1,0,0]=3 2357 B13R1.14 COC(=O)COc1ccc(Br)cc1 Amb6361342 [0,1,0,0,1,0|1,0,0]=3 2358 B13R1.14 COC(=O)COc1ccc(C)cc1 Amb844177 [0,1,0,0,1,0|1,0,0]=3 2359 B13R1.14 COC(=O)COc1ccc(Cl)cc1 Amb7102572 [0,1,0,0,1,0|1,0,0]=3 2360 B13R1.14 COC(=O)COc1ccc(F)cc1 Amb7752952 [0,1,0,0,1,0|1,0,0]=3 2361 B13R1.14 COC(=O)COc1ccc(I)cc1 Amb1929651 [0,1,0,0,1,0|1,0,0]=3 2362 B13R1.14 COC(=O)COc1ccc(N)cc1 Amb23385314 [0,1,0,0,1,0|1,0,0]=3 2363 B13R1.14 COC(=O)COc1ccc(N)cc1 Amb6372983 [0,1,0,0,1,0|1,0,0]=3 2364 B13R1.14 COC(=O)COc1ccc(O)cc1 Amb10975204 [0,1,0,0,1,0|1,0,0]=3 2365 B13R1.14 COC(=O)COc1ccc(O)cn1 Amb24095899 [0,1,0,0,1,0|2,0,0]=4 2366 B13R1.14 COC(=O)CSc1ccc(Cl)cc1 Amb6383264 [0,1,0,0,1,0|1,0,0]=3 2367 B13R1.14 COC(=O)CSc1ccc(N)cc1 Amb8930379 [0,1,0,0,1,0|1,0,0]=3 2368 B13R1.14 COC(=O)CSc1ccc(N)cn1 Amb5786813 [0,1,0,0,1,0|2,0,0]=4 2369 B13R1.14 COC(=O)CSc1ccc(O)cc1 Amb18321905 [0,1,0,0,1,0|1,0,0]=3 2370 B13R1.14 COC(=O)NCc1ccc(Br)cc1 Amb25101223 [0,1,0,0,1,0|1,0,0]=3 2371 B13R1.14 COC(=O)NCc1ccc(C)cc1 Amb17869525 [0,1,0,0,1,0|1,0,0]=3 2372 B13R1.14 COC(=O)NCc1ccc(C)cn1 Amb27222951 [0,1,0,0,1,0|2,0,0]=4 2373 B13R1.14 COC(=O)NCc1ccc(Cl)cc1 Amb6498503 [0,1,0,0,1,0|1,0,0]=3 2374 B13R1.14 COC(=O)NCc1ccc(Cl)nc1 Amb28078811 [0,1,0,0,1,0|2,0,0]=4 2375 B13R1.14 COC(=O)NCc1ccc(F)cc1 Amb17860018 [0,1,0,0,1,0|1,0,0]=3 2376 B13R1.14 COC(=O)NCc1ccc(N)cc1 Amb8390013 [0,1,0,0,1,0|1,0,0]=3 2377 B13R1.14 COC(=O)NCc1ccc(N)nc1 Amb27758135 [0,1,0,0,1,0|2,0,0]=4 2378 B13R1.14 COC(=O)NNc1ccc(Br)cc1 Amb28047452 [0,1,0,0,1,0|2,0,0]=4 2379 B13R1.14 COC(=O)NNc1ccc(Cl)cc1 Amb27603308 [0,1,0,0,1,0|2,0,0]=4 2380 B13R1.14 COC(=O)NSc1ccc(N)cc1 Amb27209585 [0,1,0,0,1,0|2,0,0]=4 2381 B13R1.14 COC(=O)\C=C/c1ccc(Cl)cc1 Amb26857585 [0,1,0,0,1,0|0,0,2]=4 2382 B13R1.14 COC(=O)\C=C\c1ccc(Br)cc1 Amb13883656 [0,1,0,0,1,0|0,0,2]=4 2383 B13R1.14 COC(=O)\C=C\c1ccc(C)cc1 Amb17844465 [0,1,0,0,1,0|0,0,2]=4 2384 B13R1.14 COC(=O)\C=C\c1ccc(Cl)cc1 Amb33513295 [0,1,0,0,1,0|0,0,2]=4 2385 B13R1.14 COC(=O)\C=C\c1ccc(F)cc1 Amb33997710 [0,1,0,0,1,0|0,0,2]=4 2386 B13R1.14 COC(=O)\C=C\c1ccc(N)cc1 Amb2697308 [0,1,0,0,1,0|0,0,2]=4 2387 B13R1.14 COC(=O)\C=C\c1ccc(O)cc1 Amb845412 [0,1,0,0,1,0|0,0,2]=4 2388 B13R1.14 COC(=O)\C=C\c1ccc(S)cc1 Amb17616841 [0,1,0,0,1,0|0,0,2]=4 2389 B13R1.14 COC(=O)\N=C\c1ccc(F)cc1 Amb27843428 [0,1,0,0,1,0|1,0,1]=4 2390 B13R1.14 Cc1ccc(CCC(=O)CCl)cc1 Amb17139634 [0,1,0,0,1,0|2,0,0]=4 2391 B13R1.14 Cc1ccc(CCC(=O)CN)cc1 Amb18065723 [0,1,0,0,1,0|2,0,0]=4 2392 B13R1.14 Cc1ccc(CCC(=O)CO)cc1 Amb18065754 [0,1,0,0,1,0|2,0,0]=4 2393 B13R1.14 NCC(=O)CCc1ccc(Br)cc1 Amb18156196 [0,1,0,0,1,0|2,0,0]=4 2394 B13R1.14 NCC(=O)CCc1ccc(Cl)cc1 Amb18565992 [0,1,0,0,1,0|2,0,0]=4 2395 B13R1.14 NCC(=O)CCc1ccc(F)cc1 Amb18066019 [0,1,0,0,1,0|2,0,0]=4 2396 B13R1.14 NNC(=O)CCc1ccc(Br)cc1 Amb27653748 [0,1,0,0,1,0|2,0,0]=4 2397 B13R1.14 NNC(=O)CCc1ccc(O)cc1 Amb2722569 [0,1,0,0,1,0|2,0,0]=4 2398 B13R1.14 NNC(=O)CCc1ccc(S)cc1 Amb28386011 [0,1,0,0,1,0|2,0,0]=4 2399 B13R1.14 Nc1ccc(CCC(=O)NO)cc1 Amb24494088 [0,1,0,0,1,0|2,0,0]=4 2400 B13R1.14 Nc1ccc(CCC(=O)NO)cc1 Amb33422023 [0,1,0,0,1,0|2,0,0]=4 2401 B13R1.14 O=C(CCc1ccc(Br)cc1)NO Amb27946083 [0,1,0,0,1,0|2,0,0]=4 2402 B13R1.14 O=C(CCc1ccc(Cl)cc1)NO Amb28078489 [0,1,0,0,1,0|2,0,0]=4 2403 B13R1.14 O=C(CCc1ccc(O)cc1)NO Amb27599352 [0,1,0,0,1,0|2,0,0]=4 2404 B13R1.14 O=C(CCl)CCc1ccc(Br)cc1 Amb17163906 [0,1,0,0,1,0|2,0,0]=4 2405 B13R1.14 O=C(CCl)CCc1ccc(Cl)cc1 Amb17141006 [0,1,0,0,1,0|2,0,0]=4 2406 B13R1.14 O=C(CCl)CCc1ccc(F)cc1 Amb17139827 [0,1,0,0,1,0|2,0,0]=4 2407 B13R1.14 O=C(CO)CCc1ccc(Br)cc1 Amb18071391 [0,1,0,0,1,0|2,0,0]=4 2408 B13R1.14 O=C(CO)CCc1ccc(Cl)cc1 Amb18566076 [0,1,0,0,1,0|2,0,0]=4 2409 B13R1.14 O=C(CO)CCc1ccc(F)cc1 Amb18066060 [0,1,0,0,1,0|2,0,0]=4 2410 B13R1.15 C#CC(=O)CCc1cccc(C)c1 Amb28044527 [0,1,0,0,1,0|1,0,1]=4 2411 B13R1.15 C=CC(=O)CCc1cccc(Br)c1 Amb33435396 [0,1,0,0,1,0|1,0,1]=4 2412 B13R1.15 CCC(=O)CCc1cccc(Br)c1 Amb8869666 [0,1,0,0,1,0|1,0,0]=3 2413 B13R1.15 CCC(=O)CCc1cccc(C)c1 Amb9031665 [0,1,0,0,1,0|1,0,0]=3 2414 B13R1.15 CCC(=O)CCc1cccc(Cl)c1 Amb9031683 [0,1,0,0,1,0|1,0,0]=3 2415 B13R1.15 CCC(=O)CSc1cccc(Br)c1 Amb32682988 [0,1,0,0,1,0|2,0,0]=4 2416 B13R1.15 CCC(=O)CSc1cccc(C)c1 Amb18330491 [0,1,0,0,1,0|2,0,0]=4 2417 B13R1.15 CCC(=O)CSc1cccc(Cl)c1 Amb32682967 [0,1,0,0,1,0|2,0,0]=4 2418 B13R1.15 CCC(=O)CSc1cccc(F)c1 Amb32682972 [0,1,0,0,1,0|2,0,0]=4 2419 B13R1.15 CCC(=O)NCc1cccc(Br)c1 Amb2085744 [0,1,0,0,1,0|2,0,0]=4 2420 B13R1.15 CCC(=O)NCc1cccc(Cl)c1 Amb2023613 [0,1,0,0,1,0|2,0,0]=4 2421 B13R1.15 CCC(=O)NCc1cccc(F)c1 Amb26369355 [0,1,0,0,1,0|2,0,0]=4 2422 B13R1.15 CNC(=O)CCc1cc(Br)ccn1 Amb27163325 [0,1,0,0,1,0|2,0,0]=4 2423 B13R1.15 CNC(=O)CCc1cccc(Br)c1 Amb28383985 [0,1,0,0,1,0|1,0,0]=3 2424 B13R1.15 CNC(=O)CCc1cccc(Cl)c1 Amb27873385 [0,1,0,0,1,0|1,0,0]=3 2425 B13R1.15 CNC(=O)CCc1cccc(F)c1 Amb27254994 [0,1,0,0,1,0|1,0,0]=3 2426 B13R1.15 CNC(=O)CCc1cccc(N)c1 Amb17622196 [0,1,0,0,1,0|1,0,0]=3 2427 B13R1.15 CNC(=O)CCc1cccc(N)c1 Amb19959906 [0,1,0,0,1,0|1,0,0]=3 2428 B13R1.15 CNC(=O)CCc1cccc(N)c1 Amb8941578 [0,1,0,0,1,0|1,0,0]=3 2429 B13R1.15 CNC(=O)CCc1cncc(C)c1 Amb28127349 [0,1,0,0,1,0|2,0,0]=4 2430 B13R1.15 CNC(=O)CCc1cncc(F)c1 Amb27969980 [0,1,0,0,1,0|2,0,0]=4 2431 B13R1.15 CNC(=O)CNc1cccc(F)c1 Amb6711905 [0,1,0,0,1,0|2,0,0]=4 2432 B13R1.15 CNC(=O)COc1cccc(Br)c1 Amb6268275 [0,1,0,0,1,0|2,0,0]=4 2433 B13R1.15 CNC(=O)COc1cccc(Cl)c1 Amb3099987 [0,1,0,0,1,0|2,0,0]=4 2434 B13R1.15 CNC(=O)COc1cccc(I)c1 Amb8249668 [0,1,0,0,1,0|2,0,0]=4 2435 B13R1.15 CNC(=O)COc1cccc(N)c1 Amb6245541 [0,1,0,0,1,0|2,0,0]=4 2436 B13R1.15 CNC(=O)COc1cccc(O)c1 Amb8837479 [0,1,0,0,1,0|2,0,0]=4 2437 B13R1.15 CNC(=O)CSc1cccc(Cl)c1 Amb28078695 [0,1,0,0,1,0|2,0,0]=4 2438 B13R1.15 CNC(=O)NCc1cccc(Br)c1 Amb15366176 [0,1,0,0,1,0|2,0,0]=4 2439 B13R1.15 CNC(=O)NCc1cccc(Cl)c1 Amb22584233 [0,1,0,0,1,0|2,0,0]=4 2440 B13R1.15 CNC(=O)NCc1cccc(F)c1 Amb27973718 [0,1,0,0,1,0|2,0,0]=4 2441 B13R1.15 COC(=N)CCc1cccc(Br)c1 Amb18071178 [0,1,0,0,1,0|1,0,0]=3 2442 B13R1.15 COC(=N)CCc1cccc(C)c1 Amb18065695 [0,1,0,0,1,0|1,0,0]=3 2443 B13R1.15 COC(=N)CCc1cccc(Cl)c1 Amb18066444 [0,1,0,0,1,0|1,0,0]=3 2444 B13R1.15 COC(=N)CCc1cccc(F)c1 Amb18564164 [0,1,0,0,1,0|1,0,0]=3 2445 B13R1.15 COC(=N)COc1cccc(Br)c1 Amb18577246 [0,1,0,0,1,0|2,0,0]=4 2446 B13R1.15 COC(=N)COc1cccc(C)c1 Amb18065838 [0,1,0,0,1,0|2,0,0]=4 2447 B13R1.15 COC(=N)COc1cccc(Cl)c1 Amb18066508 [0,1,0,0,1,0|2,0,0]=4 2448 B13R1.15 COC(=N)COc1cccc(F)c1 Amb18066093 [0,1,0,0,1,0|2,0,0]=4 2449 B13R1.15 COC(=O)C#Cc1cccc(Br)c1 Amb26367370 [0,1,0,0,1,0|0,0,2]=4 2450 B13R1.15 COC(=O)C#Cc1cccc(C)c1 Amb27169780 [0,1,0,0,1,0|0,0,2]=4 2451 B13R1.15 COC(=O)C#Cc1cccc(F)c1 Amb25726243 [0,1,0,0,1,0|0,0,2]=4 2452 B13R1.15 COC(=O)C#Cc1cccc(N)c1 Amb32989932 [0,1,0,0,1,0|0,0,2]=4 2453 B13R1.15 COC(=O)C#Cc1cccc(O)c1 Amb32989938 [0,1,0,0,1,0|0,0,2]=4 2454 B13R1.15 COC(=O)CCc1cccc(Br)c1 Amb17410710 [0,1,0,0,1,0|0,0,0]=2 2455 B13R1.15 COC(=O)CCc1cccc(C)c1 Amb17400661 [0,1,0,0,1,0|0,0,0]=2 2456 B13R1.15 COC(=O)CCc1cccc(Cl)c1 Amb17402276 [0,1,0,0,1,0|0,0,0]=2 2457 B13R1.15 COC(=O)CCc1cccc(F)c1 Amb30868064 [0,1,0,0,1,0|0,0,0]=2 2458 B13R1.15 COC(=O)CCc1cccc(N)c1 Amb18648245 [0,1,0,0,1,0|0,0,0]=2 2459 B13R1.15 COC(=O)CCc1cccc(N)c1 Amb33533668 [0,1,0,0,1,0|0,0,0]=2 2460 B13R1.15 COC(=O)CCc1cccc(O)c1 Amb2695338 [0,1,0,0,1,0|0,0,0]=2 2461 B13R1.15 COC(=O)CCc1cncc(N)c1 Amb28556110 [0,1,0,0,1,0|1,0,0]=3 2462 B13R1.15 COC(=O)CCc1cncc(N)c1 Amb33307156 [0,1,0,0,1,0|1,0,0]=3 2463 B13R1.15 COC(=O)CNc1cc(N)ccn1 Amb18184983 [0,1,0,0,1,0|2,0,0]=4 2464 B13R1.15 COC(=O)CNc1cccc(Br)c1 Amb6712280 [0,1,0,0,1,0|1,0,0]=3 2465 B13R1.15 COC(=O)CNc1cccc(Br)n1 Amb28194646 [0,1,0,0,1,0|2,0,0]=4 2466 B13R1.15 COC(=O)CNc1cccc(C)c1 Amb6706758 [0,1,0,0,1,0|1,0,0]=3 2467 B13R1.15 COC(=O)CNc1cccc(C)n1 Amb18796228 [0,1,0,0,1,0|2,0,0]=4 2468 B13R1.15 COC(=O)CNc1cccc(Cl)c1 Amb6711877 [0,1,0,0,1,0|1,0,0]=3 2469 B13R1.15 COC(=O)CNc1cccc(Cl)n1 Amb25187972 [0,1,0,0,1,0|2,0,0]=4 2470 B13R1.15 COC(=O)CNc1cccc(F)c1 Amb6711935 [0,1,0,0,1,0|1,0,0]=3 2471 B13R1.15 COC(=O)CNc1cccc(F)n1 Amb19011125 [0,1,0,0,1,0|2,0,0]=4 2472 B13R1.15 COC(=O)CNc1cccc(N)c1 Amb8825462 [0,1,0,0,1,0|1,0,0]=3 2473 B13R1.15 COC(=O)CNc1cccc(N)n1 Amb27799681 [0,1,0,0,1,0|2,0,0]=4 2474 B13R1.15 COC(=O)CNc1cccc(O)c1 Amb27202255 [0,1,0,0,1,0|1,0,0]=3 2475 B13R1.15 COC(=O)CNc1cncc(Cl)c1 Amb29864722 [0,1,0,0,1,0|2,0,0]=4 2476 B13R1.15 COC(=O)COc1cc(Cl)ccn1 Amb22301619 [0,1,0,0,1,0|2,0,0]=4 2477 B13R1.15 COC(=O)COc1cccc(Br)c1 Amb7752993 [0,1,0,0,1,0|1,0,0]=3 2478 B13R1.15 COC(=O)COc1cccc(I)c1 Amb8830748 [0,1,0,0,1,0|1,0,0]=3 2479 B13R1.15 COC(=O)COc1cccc(N)c1 Amb1117898 [0,1,0,0,1,0|1,0,0]=3 2480 B13R1.15 COC(=O)COc1cccc(N)c1 Amb6893075 [0,1,0,0,1,0|1,0,0]=3 2481 B13R1.15 COC(=O)CSc1cc(Cl)ccn1 Amb22304246 [0,1,0,0,1,0|2,0,0]=4 2482 B13R1.15 COC(=O)CSc1cccc(Br)c1 Amb30588444 [0,1,0,0,1,0|1,0,0]=3 2483 B13R1.15 COC(=O)CSc1cccc(N)c1 Amb19005104 [0,1,0,0,1,0|1,0,0]=3 2484 B13R1.15 COC(=O)NCc1cccc(Br)c1 Amb2135033 [0,1,0,0,1,0|1,0,0]=3 2485 B13R1.15 COC(=O)NCc1cccc(C)c1 Amb25133958 [0,1,0,0,1,0|1,0,0]=3 2486 B13R1.15 COC(=O)NCc1cccc(Cl)c1 Amb2023614 [0,1,0,0,1,0|1,0,0]=3 2487 B13R1.15 COC(=O)NCc1cccc(O)c1 Amb18181287 [0,1,0,0,1,0|1,0,0]=3 2488 B13R1.15 COC(=O)NCc1ccnc(C)c1 Amb28193974 [0,1,0,0,1,0|2,0,0]=4 2489 B13R1.15 COC(=O)NNc1cccc(C)c1 Amb26991502 [0,1,0,0,1,0|2,0,0]=4 2490 B13R1.15 COC(=O)\C=C\c1cccc(Br)c1 Amb2407728 [0,1,0,0,1,0|0,0,2]=4 2491 B13R1.15 COC(=O)\C=C\c1cccc(C)c1 Amb27474091 [0,1,0,0,1,0|0,0,2]=4 2492 B13R1.15 COC(=O)\C=C\c1cccc(Cl)c1 Amb34003410 [0,1,0,0,1,0|0,0,2]=4 2493 B13R1.15 COC(=O)\C=C\c1cccc(F)c1 Amb10839543 [0,1,0,0,1,0|0,0,2]=4 2494 B13R1.15 COC(=O)\C=C\c1cccc(N)c1 Amb34006706 [0,1,0,0,1,0|0,0,2]=4 2495 B13R1.15 COC(=O)\C=C\c1cccc(O)c1 Amb18128083 [0,1,0,0,1,0|0,0,2]=4 2496 B13R1.15 Cc1cccc(CCC(=O)CCl)c1 Amb17139633 [0,1,0,0,1,0|2,0,0]=4 2497 B13R1.15 Cc1cccc(CCC(=O)CN)c1 Amb18065722 [0,1,0,0,1,0|2,0,0]=4 2498 B13R1.15 Cc1cccc(CCC(=O)CO)c1 Amb18065753 [0,1,0,0,1,0|2,0,0]=4 2499 B13R1.15 Cc1cccc(CCC(=O)NO)c1 Amb18186322 [0,1,0,0,1,0|2,0,0]=4 2500 B13R1.15 NCC(=O)CCc1cccc(Br)c1 Amb18727294 [0,1,0,0,1,0|2,0,0]=4 2501 B13R1.15 NCC(=O)CCc1cccc(Cl)c1 Amb18066460 [0,1,0,0,1,0|2,0,0]=4 2502 B13R1.15 NCC(=O)CCc1cccc(F)c1 Amb18066017 [0,1,0,0,1,0|2,0,0]=4 2503 B13R1.15 NNC(=O)CCc1cccc(Cl)c1 Amb27809221 [0,1,0,0,1,0|2,0,0]=4 2504 B13R1.15 NNC(=O)CCc1cccc(F)c1 Amb24730788 [0,1,0,0,1,0|2,0,0]=4 2505 B13R1.15 O=C(CCc1cccc(Cl)c1)NO Amb28293601 [0,1,0,0,1,0|2,0,0]=4 2506 B13R1.15 O=C(CCc1cccc(F)c1)NO Amb27218431 [0,1,0,0,1,0|2,0,0]=4 2507 B13R1.15 O=C(CCl)CCc1cccc(Br)c1 Amb17163905 [0,1,0,0,1,0|2,0,0]=4 2508 B13R1.15 O=C(CCl)CCc1cccc(Cl)c1 Amb17141005 [0,1,0,0,1,0|2,0,0]=4 2509 B13R1.15 O=C(CO)CCc1cccc(Br)c1 Amb18072015 [0,1,0,0,1,0|2,0,0]=4 2510 B13R1.15 O=C(CO)CCc1cccc(Cl)c1 Amb18066486 [0,1,0,0,1,0|2,0,0]=4 2511 B13R1.15 O=C(CO)CCc1cccc(F)c1 Amb18066059 [0,1,0,0,1,0|2,0,0]=4 2512 B13R1.135 C#CC(=O)C(N)Cc1ccccc1 Amb28313542 [0,1,0,0,1,0|1,0,1]=4 2513 B13R1.135 C#CC(=O)[C@@H](N)Cc1ccccc1 Amb30024205 [0,1,0,0,1,0|1,0,1]=4 2514 B13R1.135 C#CC(=O)[C@H](N)Cc1ccccc1 Amb35588700 [0,1,0,0,1,0|1,0,1]=4 2515 B13R1.135 C=C(Cc1ccccc1)C(=O)OC Amb8390348 [0,1,0,0,1,0|0,0,1]=3 2516 B13R1.135 CCC(=O)C(C)Cc1ccccc1 Amb17233202 [0,1,0,0,1,0|1,0,0]=3 2517 B13R1.135 CCC(=O)C(C)Sc1ccccc1 Amb32683032 [0,1,0,0,1,0|2,0,0]=4 2518 B13R1.135 CCC(=O)N(C)Cc1ccccc1 Amb3886753 [0,1,0,0,1,0|2,0,0]=4 2519 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,1,0|1,0,1]=4 2520 B13R1.135 CNC(=O)C(Br)Cc1ccccc1 Amb27610156 [0,1,0,0,1,0|1,0,0]=3 2521 B13R1.135 CNC(=O)C(C)Oc1ccccc1 Amb3886772 [0,1,0,0,1,0|2,0,0]=4 2522 B13R1.135 CNC(=O)C(C)Sc1ccccc1 Amb8328078 [0,1,0,0,1,0|2,0,0]=4 2523 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,1,0|1,0,0]=3 2524 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb6279885 [0,1,0,0,1,0|1,0,0]=3 2525 B13R1.135 CNC(=O)C(N)Cc1ccccn1 Amb27179833 [0,1,0,0,1,0|2,0,0]=4 2526 B13R1.135 CNC(=O)C(N)Cc1cccnc1 Amb27220814 [0,1,0,0,1,0|2,0,0]=4 2527 B13R1.135 CNC(=O)C(N)Cc1ccncc1 Amb27252186 [0,1,0,0,1,0|2,0,0]=4 2528 B13R1.135 CNC(=O)C(O)Cc1ccccc1 Amb27789590 [0,1,0,0,1,0|1,0,0]=3 2529 B13R1.135 CNC(=O)C(S)Cc1ccccc1 Amb27207974 [0,1,0,0,1,0|1,0,0]=3 2530 B13R1.135 CNC(=O)N(C)Cc1ccccc1 Amb27168216 [0,1,0,0,1,0|2,0,0]=4 2531 B13R1.135 CNC(=O)N(O)Cc1ccccc1 Amb28255708 [0,1,0,0,1,0|2,0,0]=4 2532 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb10878601 [0,1,0,0,1,0|1,0,0]=3 2533 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb15740701 [0,1,0,0,1,0|1,0,0]=3 2534 B13R1.135 CNC(=O)[C@@H](N)Cc1ccncc1 Amb28075255 [0,1,0,0,1,0|2,0,0]=4 2535 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb10608885 [0,1,0,0,1,0|1,0,0]=3 2536 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb33801562 [0,1,0,0,1,0|1,0,0]=3 2537 B13R1.135 CNC(=O)[C@H](N)Cc1cccnc1 Amb27804012 [0,1,0,0,1,0|2,0,0]=4 2538 B13R1.135 CNC(=O)[C@H](N)Cc1ccncc1 Amb28055852 [0,1,0,0,1,0|2,0,0]=4 2539 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,1,0|0,0,1]=3 2540 B13R1.135 COC(=O)C(=O)Cc1ccccn1 Amb17138896 [0,1,0,0,1,0|1,0,1]=4 2541 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [0,1,0,0,1,0|1,0,1]=4 2542 B13R1.135 COC(=O)C(=O)Cc1ccncc1 Amb17138898 [0,1,0,0,1,0|1,0,1]=4 2543 B13R1.135 COC(=O)C(Br)Cc1ccccc1 Amb9758191 [0,1,0,0,1,0|0,0,0]=2 2544 B13R1.135 COC(=O)C(C)Cc1ccccc1 Amb32412695 [0,1,0,0,1,0|0,0,0]=2 2545 B13R1.135 COC(=O)C(C)Nc1ccccc1 Amb4137936 [0,1,0,0,1,0|1,0,0]=3 2546 B13R1.135 COC(=O)C(C)Nc1cccnc1 Amb18270387 [0,1,0,0,1,0|2,0,0]=4 2547 B13R1.135 COC(=O)C(C)Oc1ccccc1 Amb2780660 [0,1,0,0,1,0|1,0,0]=3 2548 B13R1.135 COC(=O)C(Cl)Cc1ccccc1 Amb17204377 [0,1,0,0,1,0|0,0,0]=2 2549 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb1779248 [0,1,0,0,1,0|0,0,0]=2 2550 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [0,1,0,0,1,0|0,0,0]=2 2551 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb6335185 [0,1,0,0,1,0|0,0,0]=2 2552 B13R1.135 COC(=O)C(N)Cc1ccccn1 Amb30867720 [0,1,0,0,1,0|1,0,0]=3 2553 B13R1.135 COC(=O)C(N)Cc1ccccn1 Amb32645721 [0,1,0,0,1,0|1,0,0]=3 2554 B13R1.135 COC(=O)C(N)Cc1cccnc1 Amb33042860 [0,1,0,0,1,0|1,0,0]=3 2555 B13R1.135 COC(=O)C(N)Cc1cccnn1 Amb32937012 [0,1,0,0,1,0|2,0,0]=4 2556 B13R1.135 COC(=O)C(N)Cc1ccncc1 Amb28555952 [0,1,0,0,1,0|1,0,0]=3 2557 B13R1.135 COC(=O)C(N)Cc1ccncc1 Amb33506229 [0,1,0,0,1,0|1,0,0]=3 2558 B13R1.135 COC(=O)C(N)Cc1ccncn1 Amb32661109 [0,1,0,0,1,0|2,0,0]=4 2559 B13R1.135 COC(=O)C(N)Cc1ccnnc1 Amb33230885 [0,1,0,0,1,0|2,0,0]=4 2560 B13R1.135 COC(=O)C(N)Cc1cnccn1 Amb33127563 [0,1,0,0,1,0|2,0,0]=4 2561 B13R1.135 COC(=O)C(N)Cc1cncnc1 Amb32413242 [0,1,0,0,1,0|2,0,0]=4 2562 B13R1.135 COC(=O)C(N)Cc1ncccn1 Amb32645693 [0,1,0,0,1,0|2,0,0]=4 2563 B13R1.135 COC(=O)C(O)Cc1ccccc1 Amb17138951 [0,1,0,0,1,0|0,0,0]=2 2564 B13R1.135 COC(=O)C(O)Cc1ccccn1 Amb17138998 [0,1,0,0,1,0|1,0,0]=3 2565 B13R1.135 COC(=O)C(O)Cc1cccnc1 Amb17138999 [0,1,0,0,1,0|1,0,0]=3 2566 B13R1.135 COC(=O)C(O)Cc1ccncc1 Amb17139000 [0,1,0,0,1,0|1,0,0]=3 2567 B13R1.135 COC(=O)C(O)Cc1ccncc1 Amb32663204 [0,1,0,0,1,0|1,0,0]=3 2568 B13R1.135 COC(=O)C(O)Cc1ccncn1 Amb33268573 [0,1,0,0,1,0|2,0,0]=4 2569 B13R1.135 COC(=O)C(O)Cc1cnccn1 Amb33429670 [0,1,0,0,1,0|2,0,0]=4 2570 B13R1.135 COC(=O)C(O)Cc1cncnc1 Amb32876396 [0,1,0,0,1,0|2,0,0]=4 2571 B13R1.135 COC(=O)C(O)Cc1ncccn1 Amb33270049 [0,1,0,0,1,0|2,0,0]=4 2572 B13R1.135 COC(=O)[C@@H](C)Nc1cccnc1 Amb27430339 [0,1,0,0,1,0|2,0,0]=4 2573 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb533665 [0,1,0,0,1,0|0,0,0]=2 2574 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb6364970 [0,1,0,0,1,0|0,0,0]=2 2575 B13R1.135 COC(=O)[C@@H](N)Cc1cccnc1 Amb22756662 [0,1,0,0,1,0|1,0,0]=3 2576 B13R1.135 COC(=O)[C@@H](N)Cc1ncccn1 Amb30527040 [0,1,0,0,1,0|2,0,0]=4 2577 B13R1.135 COC(=O)[C@@H](O)Cc1ccccc1 Amb5722454 [0,1,0,0,1,0|0,0,0]=2 2578 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb3939007 [0,1,0,0,1,0|0,0,0]=2 2579 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb8396272 [0,1,0,0,1,0|0,0,0]=2 2580 B13R1.135 COC(=O)[C@H](N)Cc1ccccn1 Amb30527042 [0,1,0,0,1,0|1,0,0]=3 2581 B13R1.135 COC(=O)[C@H](N)Cc1cccnc1 Amb15691971 [0,1,0,0,1,0|1,0,0]=3 2582 B13R1.135 COC(=O)[C@H](O)Cc1ccccc1 Amb8390894 [0,1,0,0,1,0|0,0,0]=2 2583 B13R1.135 COC(=O)\C(Br)=C\c1ccccc1 Amb24331619 [0,1,0,0,1,0|0,0,2]=4 2584 B13R1.135 NC(Cc1ccccc1)C(=O)NO Amb22349822 [0,1,0,0,1,0|2,0,0]=4 2585 B13R1.135 NNC(=O)C(N)Cc1ccccc1 Amb16231875 [0,1,0,0,1,0|2,0,0]=4 2586 B13R1.135 NNC(=O)[C@@H](N)Cc1ccccc1 Amb3717717 [0,1,0,0,1,0|2,0,0]=4 2587 B13R1.135 N[C@@H](Cc1ccccc1)C(=O)CCl Amb31291751 [0,1,0,0,1,0|2,0,0]=4 2588 B13R1.135 N[C@H](Cc1ccccc1)C(=O)NO Amb27587806 [0,1,0,0,1,0|2,0,0]=4 2589 B13R1.135 O=C(NO)C(F)Cc1ccccc1 Amb28182984 [0,1,0,0,1,0|2,0,0]=4 2590 B13R1.254 CNS(=O)(=O)CCc1ccccc1 Amb9021674 [0,1,0,0,1,0|2,0,0]=4 2591 B13R1.417 CN\C(=C\Cc1ccccc1)OC Amb27947297 [0,1,0,0,1,0|1,0,1]=4 2592 B13R1.417 COC(=CCc1ccccc1)OC Amb22546894 [0,1,0,0,1,0|0,0,2]=4 2593 B13R1.417 C\N=C(\CCc1ccccc1)NC Amb25155427 [0,1,0,0,1,0|2,0,0]=4 2594 B13R1.528 C#CC(=O)CCc1ccccc1C Amb25134938 [0,1,0,0,1,0|1,0,1]=4 2595 B13R1.528 CCC(=O)CCc1ccccc1C Amb9031664 [0,1,0,0,1,0|1,0,0]=3 2596 B13R1.528 CCC(=O)CCc1ccccc1Cl Amb9031682 [0,1,0,0,1,0|1,0,0]=3 2597 B13R1.528 CCC(=O)CCc1ccccc1F Amb9031685 [0,1,0,0,1,0|1,0,0]=3 2598 B13R1.528 CCC(=O)CSc1ccccc1Br Amb32682962 [0,1,0,0,1,0|2,0,0]=4 2599 B13R1.528 CCC(=O)CSc1ccccc1C Amb19080442 [0,1,0,0,1,0|2,0,0]=4 2600 B13R1.528 CCC(=O)CSc1ccccc1Cl Amb32682965 [0,1,0,0,1,0|2,0,0]=4 2601 B13R1.528 CCC(=O)CSc1ccccc1F Amb18331047 [0,1,0,0,1,0|2,0,0]=4 2602 B13R1.528 CCC(=O)NCc1ccccc1Br Amb2085745 [0,1,0,0,1,0|2,0,0]=4 2603 B13R1.528 CCC(=O)NCc1ccccc1Cl Amb3094830 [0,1,0,0,1,0|2,0,0]=4 2604 B13R1.528 CCC(=O)NCc1ccccc1F Amb2020111 [0,1,0,0,1,0|2,0,0]=4 2605 B13R1.528 CCC(=O)NCc1ccccc1O Amb27173716 [0,1,0,0,1,0|2,0,0]=4 2606 B13R1.528 CNC(=O)CCc1ccccc1Cl Amb13957943 [0,1,0,0,1,0|1,0,0]=3 2607 B13R1.528 CNC(=O)CCc1ccccc1N Amb8941577 [0,1,0,0,1,0|1,0,0]=3 2608 B13R1.528 CNC(=O)CCc1ccccc1O Amb8333456 [0,1,0,0,1,0|1,0,0]=3 2609 B13R1.528 CNC(=O)CNc1ccccc1C Amb6714259 [0,1,0,0,1,0|2,0,0]=4 2610 B13R1.528 CNC(=O)COc1ccccc1Br Amb1174422 [0,1,0,0,1,0|2,0,0]=4 2611 B13R1.528 CNC(=O)COc1ccccc1Cl Amb8340723 [0,1,0,0,1,0|2,0,0]=4 2612 B13R1.528 CNC(=O)COc1ccccc1N Amb1121495 [0,1,0,0,1,0|2,0,0]=4 2613 B13R1.528 CNC(=O)COc1ccccc1O Amb1199497 [0,1,0,0,1,0|2,0,0]=4 2614 B13R1.528 CNC(=O)CSc1ccccc1C Amb27458330 [0,1,0,0,1,0|2,0,0]=4 2615 B13R1.528 CNC(=O)CSc1ccccc1Cl Amb8246920 [0,1,0,0,1,0|2,0,0]=4 2616 B13R1.528 CNC(=O)CSc1ccccc1F Amb8341742 [0,1,0,0,1,0|2,0,0]=4 2617 B13R1.528 CNC(=O)CSc1ccccc1N Amb6270099 [0,1,0,0,1,0|2,0,0]=4 2618 B13R1.528 CNC(=O)NCc1ccccc1C Amb27949555 [0,1,0,0,1,0|2,0,0]=4 2619 B13R1.528 CNC(=O)NCc1ccccc1Cl Amb2132766 [0,1,0,0,1,0|2,0,0]=4 2620 B13R1.528 CNC(=O)NCc1ccccc1F Amb22584226 [0,1,0,0,1,0|2,0,0]=4 2621 B13R1.528 COC(=N)CCc1ccccc1Br Amb18071214 [0,1,0,0,1,0|1,0,0]=3 2622 B13R1.528 COC(=N)CCc1ccccc1C Amb18065690 [0,1,0,0,1,0|1,0,0]=3 2623 B13R1.528 COC(=N)CCc1ccccc1Cl Amb18066439 [0,1,0,0,1,0|1,0,0]=3 2624 B13R1.528 COC(=N)CCc1ccccc1F Amb18066000 [0,1,0,0,1,0|1,0,0]=3 2625 B13R1.528 COC(=N)COc1ccccc1Br Amb18577242 [0,1,0,0,1,0|2,0,0]=4 2626 B13R1.528 COC(=N)COc1ccccc1C Amb18065837 [0,1,0,0,1,0|2,0,0]=4 2627 B13R1.528 COC(=N)COc1ccccc1Cl Amb18066507 [0,1,0,0,1,0|2,0,0]=4 2628 B13R1.528 COC(=N)COc1ccccc1F Amb18066092 [0,1,0,0,1,0|2,0,0]=4 2629 B13R1.528 COC(=O)C#Cc1ccccc1C Amb26396263 [0,1,0,0,1,0|0,0,2]=4 2630 B13R1.528 COC(=O)C#Cc1ccccc1Cl Amb2610345 [0,1,0,0,1,0|0,0,2]=4 2631 B13R1.528 COC(=O)C#Cc1ccccc1F Amb28120540 [0,1,0,0,1,0|0,0,2]=4 2632 B13R1.528 COC(=O)C#Cc1ccccc1N Amb27179206 [0,1,0,0,1,0|0,0,2]=4 2633 B13R1.528 COC(=O)C#Cc1ccccc1O Amb27859426 [0,1,0,0,1,0|0,0,2]=4 2634 B13R1.528 COC(=O)CCc1ccccc1Br Amb10604254 [0,1,0,0,1,0|0,0,0]=2 2635 B13R1.528 COC(=O)CCc1ccccc1C Amb17400660 [0,1,0,0,1,0|0,0,0]=2 2636 B13R1.528 COC(=O)CCc1ccccc1Cl Amb17402275 [0,1,0,0,1,0|0,0,0]=2 2637 B13R1.528 COC(=O)CCc1ccccc1F Amb17400908 [0,1,0,0,1,0|0,0,0]=2 2638 B13R1.528 COC(=O)CCc1ccccc1N Amb33803798 [0,1,0,0,1,0|0,0,0]=2 2639 B13R1.528 COC(=O)CCc1ccccc1O Amb2722678 [0,1,0,0,1,0|0,0,0]=2 2640 B13R1.528 COC(=O)CNc1ccccc1C Amb33527060 [0,1,0,0,1,0|1,0,0]=3 2641 B13R1.528 COC(=O)CNc1ccccc1Cl Amb6712398 [0,1,0,0,1,0|1,0,0]=3 2642 B13R1.528 COC(=O)CNc1ccccc1F Amb6712588 [0,1,0,0,1,0|1,0,0]=3 2643 B13R1.528 COC(=O)CNc1ccccc1N Amb7767918 [0,1,0,0,1,0|1,0,0]=3 2644 B13R1.528 COC(=O)CNc1cccnc1Cl Amb27814365 [0,1,0,0,1,0|2,0,0]=4 2645 B13R1.528 COC(=O)CNc1ccncc1F Amb35655199 [0,1,0,0,1,0|2,0,0]=4 2646 B13R1.528 COC(=O)CNc1ncccc1Br Amb27414522 [0,1,0,0,1,0|2,0,0]=4 2647 B13R1.528 COC(=O)CNc1ncccc1C Amb18809312 [0,1,0,0,1,0|2,0,0]=4 2648 B13R1.528 COC(=O)CNc1ncccc1N Amb7767913 [0,1,0,0,1,0|2,0,0]=4 2649 B13R1.528 COC(=O)COc1ccccc1Br Amb844184 [0,1,0,0,1,0|1,0,0]=3 2650 B13R1.528 COC(=O)COc1ccccc1C Amb844175 [0,1,0,0,1,0|1,0,0]=3 2651 B13R1.528 COC(=O)COc1ccccc1Cl Amb844182 [0,1,0,0,1,0|1,0,0]=3 2652 B13R1.528 COC(=O)COc1ccccc1F Amb7753081 [0,1,0,0,1,0|1,0,0]=3 2653 B13R1.528 COC(=O)COc1cccnc1N Amb9208372 [0,1,0,0,1,0|2,0,0]=4 2654 B13R1.528 COC(=O)COc1ncccc1O Amb24095895 [0,1,0,0,1,0|2,0,0]=4 2655 B13R1.528 COC(=O)CSc1ccccc1O Amb19044958 [0,1,0,0,1,0|1,0,0]=3 2656 B13R1.528 COC(=O)CSc1ncccc1O Amb24095896 [0,1,0,0,1,0|2,0,0]=4 2657 B13R1.528 COC(=O)NCc1ccccc1C Amb27854441 [0,1,0,0,1,0|1,0,0]=3 2658 B13R1.528 COC(=O)NCc1ccccc1Cl Amb22469956 [0,1,0,0,1,0|1,0,0]=3 2659 B13R1.528 COC(=O)NCc1ccccc1O Amb8390014 [0,1,0,0,1,0|1,0,0]=3 2660 B13R1.528 COC(=O)NCc1ccncc1C Amb28381085 [0,1,0,0,1,0|2,0,0]=4 2661 B13R1.528 COC(=O)NCc1cnccc1C Amb28249706 [0,1,0,0,1,0|2,0,0]=4 2662 B13R1.528 COC(=O)NCc1ncccc1C Amb27854091 [0,1,0,0,1,0|2,0,0]=4 2663 B13R1.528 COC(=O)NCc1ncccc1F Amb27977571 [0,1,0,0,1,0|2,0,0]=4 2664 B13R1.528 COC(=O)NCc1ncccc1O Amb28283614 [0,1,0,0,1,0|2,0,0]=4 2665 B13R1.528 COC(=O)\C=C\c1ccccc1Br Amb34002036 [0,1,0,0,1,0|0,0,2]=4 2666 B13R1.528 COC(=O)\C=C\c1ccccc1C Amb26325862 [0,1,0,0,1,0|0,0,2]=4 2667 B13R1.528 COC(=O)\C=C\c1ccccc1Cl Amb10808396 [0,1,0,0,1,0|0,0,2]=4 2668 B13R1.528 COC(=O)\C=C\c1ccccc1F Amb2432760 [0,1,0,0,1,0|0,0,2]=4 2669 B13R1.528 COC(=O)\C=C\c1ccccc1N Amb18127873 [0,1,0,0,1,0|0,0,2]=4 2670 B13R1.528 Cc1ccccc1CCC(=O)CCl Amb17139632 [0,1,0,0,1,0|2,0,0]=4 2671 B13R1.528 Cc1ccccc1CCC(=O)CN Amb18564059 [0,1,0,0,1,0|2,0,0]=4 2672 B13R1.528 Cc1ccccc1CCC(=O)CO Amb18065752 [0,1,0,0,1,0|2,0,0]=4 2673 B13R1.528 Cc1ccccc1CCC(=O)NN Amb8387841 [0,1,0,0,1,0|2,0,0]=4 2674 B13R1.528 NCC(=O)CCc1ccccc1Br Amb18156124 [0,1,0,0,1,0|2,0,0]=4 2675 B13R1.528 NCC(=O)CCc1ccccc1Cl Amb18066458 [0,1,0,0,1,0|2,0,0]=4 2676 B13R1.528 NNC(=O)CCc1ccccc1Br Amb24729756 [0,1,0,0,1,0|2,0,0]=4 2677 B13R1.528 NNC(=O)CCc1ccccc1F Amb27447821 [0,1,0,0,1,0|2,0,0]=4 2678 B13R1.528 NNC(=O)CCc1ccccc1O Amb1625126 [0,1,0,0,1,0|2,0,0]=4 2679 B13R1.528 Nc1ccccc1CCC(=O)NO Amb28364592 [0,1,0,0,1,0|2,0,0]=4 2680 B13R1.528 O=C(CCc1ccccc1Cl)NO Amb27826130 [0,1,0,0,1,0|2,0,0]=4 2681 B13R1.528 O=C(CCc1ccccc1O)NO Amb28182959 [0,1,0,0,1,0|2,0,0]=4 2682 B13R1.528 O=C(CCl)CCc1ccccc1Cl Amb17141004 [0,1,0,0,1,0|2,0,0]=4 2683 B13R1.528 O=C(CCl)CCc1ccccc1F Amb17139826 [0,1,0,0,1,0|2,0,0]=4 2684 B13R1.528 O=C(CO)CCc1ccccc1Br Amb18576942 [0,1,0,0,1,0|2,0,0]=4 2685 B13R1.528 O=C(CO)CCc1ccccc1Cl Amb18066485 [0,1,0,0,1,0|2,0,0]=4 2686 B13R1.528 O=C(CO)CCc1ccccc1F Amb18564200 [0,1,0,0,1,0|2,0,0]=4 2687 B13R1.162 CNC(=O)CCC(O)c1cccs1 Amb17337424 [0,1,0,0,1,0|2,0,0]=4 2688 B13R1.162 COC(=O)CCC(N)c1ccco1 Amb33429840 [0,1,0,0,1,0|1,0,0]=3 2689 B13R1.162 COC(=O)CCC(N)c1cccs1 Amb18322187 [0,1,0,0,1,0|1,0,0]=3 2690 B13R1.162 COC(=O)CCC(N)c1ccoc1 Amb33172527 [0,1,0,0,1,0|1,0,0]=3 2691 B13R1.162 COC(=O)CCC(N)c1ccon1 Amb33203402 [0,1,0,0,1,0|2,0,0]=4 2692 B13R1.162 COC(=O)CCC(N)c1ccsc1 Amb33171410 [0,1,0,0,1,0|1,0,0]=3 2693 B13R1.162 COC(=O)CCC(N)c1cnco1 Amb33319964 [0,1,0,0,1,0|2,0,0]=4 2694 B13R1.162 COC(=O)CCC(N)c1cncs1 Amb33268783 [0,1,0,0,1,0|2,0,0]=4 2695 B13R1.162 COC(=O)CCC(N)c1cscn1 Amb33417840 [0,1,0,0,1,0|2,0,0]=4 2696 B13R1.162 COC(=O)CCC(N)c1nccs1 Amb33310364 [0,1,0,0,1,0|2,0,0]=4 2697 B13R1.404 CCOC(=O)CCCn1cccn1 Amb6890130 [0,1,0,0,1,0|2,0,0]=4 2698 B13R1.404 CCOC(=O)COCc1ccco1 Amb9204470 [0,1,0,0,1,0|2,0,0]=4 2699 B13R1.404 CCOC(=O)NCCc1ccoc1 Amb22643619 [0,1,0,0,1,0|2,0,0]=4 2700 B13R1.545 COC(=O)CC(N)Cc1nccs1 Amb33035916 [0,1,0,0,1,0|2,0,0]=4 2701 B13R1.554 COC(=O)C(N)CCc1cccs1 Amb32940430 [0,1,0,0,1,0|1,0,0]=3 2702 B13R1.554 COC(=O)C(N)CCc1ccns1 Amb33036521 [0,1,0,0,1,0|2,0,0]=4 2703 B13R1.554 COC(=O)C(N)CCc1ccsc1 Amb33036925 [0,1,0,0,1,0|1,0,0]=3 2704 B13R1.554 COC(=O)C(N)CCn1cccn1 Amb18318592 [0,1,0,0,1,0|2,0,0]=4 2705 B13R1.554 COC(=O)C(N)CCn1ccnc1 Amb18318590 [0,1,0,0,1,0|2,0,0]=4 2706 B13R1.554 COC(=O)C(O)CCc1ccsc1 Amb33079497 [0,1,0,0,1,0|1,0,0]=3 2707 B13R1.554 COC(=O)C(O)CCn1cccn1 Amb32726889 [0,1,0,0,1,0|2,0,0]=4 2708 B13R1.599 COC(=O)CCCn1ccnc1N Amb32704653 [0,1,0,0,1,0|2,0,0]=4 2709 B13R1.599 COC(=O)CNCc1cscc1Br Amb32678212 [0,1,0,0,1,0|2,0,0]=4 2710 B13R1.599 COC(=O)CSCc1occc1C Amb32987544 [0,1,0,0,1,0|2,0,0]=4 2711 B13R1.717 COC(=O)CCCc1csc(N)n1 Amb20667848 [0,1,0,0,1,0|2,0,0]=4 2712 B13R1.717 COC(=O)CCCc1nc(C)cs1 Amb32652026 [0,1,0,0,1,0|2,0,0]=4 2713 B13R1.717 COC(=O)CCCn1cc(N)cn1 Amb8961160 [0,1,0,0,1,0|2,0,0]=4 2714 B13R1.717 COC(=O)CCCn1ccc(N)n1 Amb19057072 [0,1,0,0,1,0|2,0,0]=4 2715 B13R1.717 COC(=O)CCCn1cnc(N)c1 Amb32701737 [0,1,0,0,1,0|2,0,0]=4 2716 B13R1.717 COC(=O)CNCc1ccc(Cl)s1 Amb6707544 [0,1,0,0,1,0|2,0,0]=4 2717 B13R1.717 COC(=O)CSCc1ccc(Cl)o1 Amb32789195 [0,1,0,0,1,0|2,0,0]=4 2718 B15R1.26 CCC(=O)CCCSc1ccc(Br)cc1 Amb32682983 [0,1,0,0,0,1|1,0,0]=3 2719 B15R1.26 CCC(=O)CCCSc1ccc(C)cc1 Amb32682980 [0,1,0,0,0,1|1,0,0]=3 2720 B15R1.26 CCC(=O)CCCSc1ccc(Cl)cc1 Amb32682963 [0,1,0,0,0,1|1,0,0]=3 2721 B15R1.26 CCC(=O)CCCSc1ccc(F)cc1 Amb32682992 [0,1,0,0,0,1|1,0,0]=3 2722 B15R1.26 COC(=O)C#CCOc1ccc(Cl)cc1 Amb28397149 [0,1,0,0,0,1|0,0,2]=4 2723 B15R1.26 COC(=O)CCCOc1ccc(Br)cc1 Amb8950462 [0,1,0,0,0,1|0,0,0]=2 2724 B15R1.26 COC(=O)CCCOc1ccc(C)cc1 Amb8950458 [0,1,0,0,0,1|0,0,0]=2 2725 B15R1.26 COC(=O)CCCOc1ccc(Cl)cc1 Amb2721091 [0,1,0,0,0,1|0,0,0]=2 2726 B15R1.26 COC(=O)CCCOc1ccc(F)cc1 Amb8952305 [0,1,0,0,0,1|0,0,0]=2 2727 B15R1.26 COC(=O)CCCOc1ccc(N)cc1 Amb19373667 [0,1,0,0,0,1|0,0,0]=2 2728 B15R1.26 COC(=O)CCCOc1ccc(N)cc1 Amb8960801 [0,1,0,0,0,1|0,0,0]=2 2729 B15R1.26 COC(=O)CCCSc1ccc(Br)cc1 Amb8961490 [0,1,0,0,0,1|0,0,0]=2 2730 B15R1.26 Cc1ccc(CCCNC(=O)CCl)cc1 Amb31176181 [0,1,0,0,0,1|2,0,0]=4 2731 B15R1.26 O=C(CCl)NCCCc1ccc(Br)cc1 Amb31176189 [0,1,0,0,0,1|2,0,0]=4 2732 B15R1.26 O=C(CCl)NCCCc1ccc(Cl)cc1 Amb31176187 [0,1,0,0,0,1|2,0,0]=4 2733 B15R1.26 O=C(CCl)NCCCc1ccc(F)cc1 Amb31176184 [0,1,0,0,0,1|2,0,0]=4 2734 B15R1.315 CNS(=O)(=O)CCNCc1ccccc1 Amb28195786 [0,1,0,0,0,1|2,0,0]=4 2735 B15R1.452 COC(CCSCc1ccccc1)OC Amb32682472 [0,1,0,0,0,1|0,0,2]=4 2736 B15R1.741 CC(CCc1ccccc1)NC(=O)CCl Amb1644306 [0,1,0,0,0,1|2,0,0]=4 2737 B15R1.741 CC(CCc1ccccc1)NC(=O)CN Amb32428289 [0,1,0,0,0,1|2,0,0]=4 2738 B15R1.741 CCC(=O)CC(=O)OCc1ccccc1 Amb28255666 [0,1,0,0,0,1|1,0,1]=4 2739 B15R1.741 CNC(=O)CC(=O)NCc1ccccc1 Amb27950868 [0,1,0,0,0,1|1,0,1]=4 2740 B15R1.741 COC(=O)CC(=O)CCc1ccccc1 Amb17595507 [0,1,0,0,0,1|0,0,0]=2 2741 B15R1.741 COC(=O)CC(=O)CSc1ccccc1 Amb2182878 [0,1,0,0,0,1|0,0,1]=3 2742 B15R1.741 COC(=O)CC(=O)CSc1ccccn1 Amb13893683 [0,1,0,0,0,1|1,0,1]=4 2743 B15R1.741 COC(=O)CC(=O)NCc1ccccc1 Amb6811778 [0,1,0,0,0,1|0,0,1]=3 2744 B15R1.741 COC(=O)CC(=O)OCc1ccccc1 Amb19958253 [0,1,0,0,0,1|0,0,1]=3 2745 B15R1.741 COC(=O)CC(=O)\C=C\c1ccccc1 Amb34913397 [0,1,0,0,0,1|0,0,2]=4 2746 B15R1.741 COC(=O)CC(C)NCc1ccccc1 Amb9398411 [0,1,0,0,0,1|0,0,0]=2 2747 B15R1.741 COC(=O)CC(C)NCc1ccccn1 Amb9398629 [0,1,0,0,0,1|1,0,0]=3 2748 B15R1.741 COC(=O)CC(C)NCc1cccnc1 Amb9398689 [0,1,0,0,0,1|1,0,0]=3 2749 B15R1.741 COC(=O)CC(C)NCc1ccncc1 Amb9398691 [0,1,0,0,0,1|1,0,0]=3 2750 B15R1.741 COC(=O)CC(N)CCc1ccccc1 Amb32645727 [0,1,0,0,0,1|0,0,0]=2 2751 B15R1.741 COC(=O)C[C@@H](C)NCc1ccccc1 Amb28388658 [0,1,0,0,0,1|0,0,0]=2 2752 B15R1.741 COC(=O)C[C@@H](N)CCc1ccccc1 Amb33456352 [0,1,0,0,0,1|0,0,0]=2 2753 B15R1.741 COC(=O)C[C@@H](N)CCc1ccccc1 Amb33456353 [0,1,0,0,0,1|0,0,0]=2 2754 B15R1.741 COC(=O)C[C@H](N)CCc1ccccc1 Amb33456266 [0,1,0,0,0,1|0,0,0]=2 2755 B15R1.741 COC(=O)C[C@H](N)CCc1ccccc1 Amb33456271 [0,1,0,0,0,1|0,0,0]=2 2756 B15R1.741 COC(=O)NC(=N)OCc1ccccc1 Amb27876351 [0,1,0,0,0,1|1,0,1]=4 2757 B15R1.741 COC(=O)OC(=O)NCc1ccccc1 Amb27605843 [0,1,0,0,0,1|1,0,1]=4 2758 B15R1.741 COC(=O)\C=C(/C)CCc1ccccc1 Amb33109888 [0,1,0,0,0,1|0,0,1]=3 2759 B15R1.741 COC(=O)\C=C(\C)CCc1ccccc1 Amb33472087 [0,1,0,0,0,1|0,0,1]=3 2760 B15R1.778 C#CCC(=O)CCNCc1ccccc1 Amb33131466 [0,1,0,0,0,1|1,0,1]=4 2761 B15R1.778 CCCC(=O)CCNCc1ccccc1 Amb33131468 [0,1,0,0,0,1|1,0,0]=3 2762 B15R1.778 CCCC(=O)OCCCc1ccccc1 Amb22732786 [0,1,0,0,0,1|1,0,0]=3 2763 B15R1.778 CCCC(=O)OCCOc1ccccc1 Amb21964300 [0,1,0,0,0,1|2,0,0]=4 2764 B15R1.778 CCOC(=O)CCCOc1ccccc1 Amb22730739 [0,1,0,0,0,1|0,0,0]=2 2765 B15R1.778 CCOC(=O)CCCSc1ccccc1 Amb19888704 [0,1,0,0,0,1|0,0,0]=2 2766 B15R1.778 CCOC(=O)CCNCc1ccccc1 Amb1930738 [0,1,0,0,0,1|0,0,0]=2 2767 B15R1.778 CCOC(=O)CCNCc1ccccc1 Amb33280205 [0,1,0,0,0,1|0,0,0]=2 2768 B15R1.778 CCOC(=O)CCNCc1ccccn1 Amb9024198 [0,1,0,0,0,1|1,0,0]=3 2769 B15R1.778 CCOC(=O)CCNCc1cccnc1 Amb9024201 [0,1,0,0,0,1|1,0,0]=3 2770 B15R1.778 CCOC(=O)CCNCc1ccncc1 Amb9024200 [0,1,0,0,0,1|1,0,0]=3 2771 B15R1.778 CCOC(=O)CCOCc1ccccc1 Amb9026131 [0,1,0,0,0,1|0,0,0]=2 2772 B15R1.778 CCOC(=O)CNCCc1ccccc1 Amb6711761 [0,1,0,0,0,1|0,0,0]=2 2773 B15R1.778 CCOC(=O)CNOCc1ccccc1 Amb13884841 [0,1,0,0,0,1|1,0,0]=3 2774 B15R1.778 CCOC(=O)NNCCc1ccccc1 Amb24103548 [0,1,0,0,0,1|1,0,0]=3 2775 B15R1.778 CCOC(=O)\C=C\NCc1ccccc1 Amb27966691 [0,1,0,0,0,1|0,0,2]=4 2776 B15R1.778 CNCC(=O)NCCCc1ccccc1 Amb24115171 [0,1,0,0,0,1|1,0,0]=3 2777 B15R1.778 COCC(=O)CCNCc1ccccc1 Amb33131395 [0,1,0,0,0,1|0,0,0]=2 2778 B15R1.778 COCC(C)NCCCc1ccccc1 Amb6708768 [0,1,0,0,0,1|1,0,1]=4 2779 B15R1.778 C\C=C\C(=O)CCNCc1ccccc1 Amb33307195 [0,1,0,0,0,1|1,0,0]=3 2780 B15R1.778 N#CCC(=O)CCOCc1ccccc1 Amb22754626 [0,1,0,0,0,1|1,0,1]=4 2781 B15R1.778 N#CCC(=O)NCCCc1ccccc1 Amb1948524 [0,1,0,0,0,1|1,0,1]=4 2782 B15R1.778 N#CCC(=O)OCCCc1ccccc1 Amb17210530 [0,1,0,0,0,1|1,0,1]=4 2783 B15R1.778 NCCC(=O)NCCCc1ccccc1 Amb5785069 [0,1,0,0,0,1|1,0,0]=3 2784 B15R1.778 NCCC(=O)NCCOc1ccccc1 Amb17239848 [0,1,0,0,0,1|2,0,0]=4 2785 B15R1.778 NNOC(=O)CCOCc1ccccc1 Amb28079451 [0,1,0,0,0,1|1,0,0]=3 2786 B15R1.778 O=C(CCCl)NCCCc1ccccc1 Amb9330447 [0,1,0,0,0,1|1,0,0]=3 2787 B15R1.778 O=C(CCCl)NCCOc1ccccc1 Amb17326988 [0,1,0,0,0,1|2,0,0]=4 2788 B15R1.778 O=C(CCCl)NCCSc1ccccc1 Amb10975200 [0,1,0,0,0,1|2,0,0]=4 2789 B15R1.942 CCC(=O)CCCSc1cccc(Br)c1 Amb32682979 [0,1,0,0,0,1|1,0,0]=3 2790 B15R1.942 CCC(=O)CCCSc1cccc(C)c1 Amb32682954 [0,1,0,0,0,1|1,0,0]=3 2791 B15R1.942 CCC(=O)CCCSc1cccc(Cl)c1 Amb32682989 [0,1,0,0,0,1|1,0,0]=3 2792 B15R1.942 CCC(=O)CCCSc1cccc(F)c1 Amb32682993 [0,1,0,0,0,1|1,0,0]=3 2793 B15R1.942 CCC(=O)CCCSc1cncc(Br)c1 Amb33276274 [0,1,0,0,0,1|2,0,0]=4 2794 B15R1.942 CCC(=O)CCCSc1cncc(C)c1 Amb33276324 [0,1,0,0,0,1|2,0,0]=4 2795 B15R1.942 COC(=O)C#CCOc1cccc(Cl)c1 Amb28397562 [0,1,0,0,0,1|0,0,2]=4 2796 B15R1.942 COC(=O)CCCSc1cncc(Br)c1 Amb33276147 [0,1,0,0,0,1|1,0,0]=3 2797 B15R1.942 COC(=O)CCCSc1cncc(C)c1 Amb33276318 [0,1,0,0,0,1|1,0,0]=3 2798 B15R1.942 COC(=O)CCNCc1cccc(Br)c1 Amb32729433 [0,1,0,0,0,1|0,0,0]=2 2799 B15R1.942 COC(=O)CCNCc1cccc(C)c1 Amb8831552 [0,1,0,0,0,1|0,0,0]=2 2800 B15R1.942 COC(=O)CCOCc1cccc(Br)c1 Amb28905992 [0,1,0,0,0,1|0,0,0]=2 2801 B15R1.942 COC(=O)CCSCc1cccc(N)c1 Amb9482068 [0,1,0,0,0,1|0,0,0]=2 2802 B15R1.942 Cc1cccc(CCCNC(=O)CCl)c1 Amb31176180 [0,1,0,0,0,1|2,0,0]=4 2803 B15R1.942 O=C(CCl)NCCCc1cccc(Br)c1 Amb31176188 [0,1,0,0,0,1|2,0,0]=4 2804 B15R1.942 O=C(CCl)NCCCc1cccc(Cl)c1 Amb31176186 [0,1,0,0,0,1|2,0,0]=4 2805 B15R1.942 O=C(CCl)NCCCc1cccc(F)c1 Amb31176183 [0,1,0,0,0,1|2,0,0]=4 2806 B15R1.959 CC(CCNC(=O)CBr)c1ccccc1 Amb17329990 [0,1,0,0,0,1|2,0,0]=4 2807 B15R1.959 CNC(=O)CCNC(C)c1ccccc1 Amb20171951 [0,1,0,0,0,1|1,0,0]=3 2808 B15R1.959 CNC(=O)CSCC(=O)c1ccccc1 Amb22445282 [0,1,0,0,0,1|1,0,1]=4 2809 B15R1.959 COC(=O)CCCC(=O)c1ccccc1 Amb2720741 [0,1,0,0,0,1|0,0,0]=2 2810 B15R1.959 COC(=O)CCCC(N)c1ccccc1 Amb32653382 [0,1,0,0,0,1|0,0,0]=2 2811 B15R1.959 COC(=O)CCCC(N)c1ccccc1 Amb33552526 [0,1,0,0,0,1|0,0,0]=2 2812 B15R1.959 COC(=O)CCCC(O)c1ccccc1 Amb18627401 [0,1,0,0,0,1|0,0,0]=2 2813 B15R1.959 COC(=O)CCNC(=O)c1ccccc1 Amb684817 [0,1,0,0,0,1|0,0,1]=3 2814 B15R1.959 COC(=O)CCNC(=O)c1ccncc1 Amb13957929 [0,1,0,0,0,1|1,0,1]=4 2815 B15R1.959 COC(=O)CCNC(C)c1ccccc1 Amb22586709 [0,1,0,0,0,1|0,0,0]=2 2816 B15R1.959 COC(=O)CCNC(C)c1ccccc1 Amb842474 [0,1,0,0,0,1|0,0,0]=2 2817 B15R1.959 COC(=O)CSCC(=O)c1ccccc1 Amb9270776 [0,1,0,0,0,1|0,0,1]=3 2818 B15R1.964 CNC(=O)CCN(C)Cc1ccccc1 Amb19558615 [0,1,0,0,0,1|1,0,0]=3 2819 B15R1.964 COC(=O)CCC(=O)Nc1ccccc1 Amb6345853 [0,1,0,0,0,1|0,0,1]=3 2820 B15R1.964 COC(=O)CCC(N)Cc1ccccc1 Amb22059181 [0,1,0,0,0,1|0,0,0]=2 2821 B15R1.964 COC(=O)CCC(N)Cc1ccccc1 Amb28872538 [0,1,0,0,0,1|0,0,0]=2 2822 B15R1.964 COC(=O)CCN(C)Cc1ccccc1 Amb7755700 [0,1,0,0,0,1|0,0,0]=2 2823 B15R1.964 COC(=O)CNC(=O)Nc1ccccc1 Amb9260990 [0,1,0,0,0,1|1,0,1]=4 2824 B15R1.1091 CCC(=O)CCCSc1ccccc1Br Amb32682985 [0,1,0,0,0,1|1,0,0]=3 2825 B15R1.1091 CCC(=O)CCCSc1ccccc1C Amb32682960 [0,1,0,0,0,1|1,0,0]=3 2826 B15R1.1091 CCC(=O)CCCSc1ccccc1Cl Amb32682987 [0,1,0,0,0,1|1,0,0]=3 2827 B15R1.1091 CCC(=O)CCCSc1ccccc1F Amb32682991 [0,1,0,0,0,1|1,0,0]=3 2828 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl Amb20171988 [0,1,0,0,0,1|1,0,0]=3 2829 B15R1.1091 COC(=O)CCCOc1ccccc1Br Amb8961271 [0,1,0,0,0,1|0,0,0]=2 2830 B15R1.1091 COC(=O)CCCOc1ccccc1C Amb8952306 [0,1,0,0,0,1|0,0,0]=2 2831 B15R1.1091 COC(=O)CCCOc1ccccc1Cl Amb8961212 [0,1,0,0,0,1|0,0,0]=2 2832 B15R1.1091 COC(=O)CCCOc1ccccc1F Amb8961211 [0,1,0,0,0,1|0,0,0]=2 2833 B15R1.1091 COC(=O)CCCSc1ccccc1Br Amb8961489 [0,1,0,0,0,1|0,0,0]=2 2834 B15R1.1091 Cc1ccccc1CCCNC(=O)CCl Amb31176178 [0,1,0,0,0,1|2,0,0]=4 2835 B15R1.1091 NNC(=O)CCNCc1ccccc1Cl Amb20171990 [0,1,0,0,0,1|2,0,0]=4 2836 B15R1.1091 O=C(CCl)NCCCc1ccccc1Cl Amb31176185 [0,1,0,0,0,1|2,0,0]=4 2837 B15R1.1091 O=C(CCl)NCCCc1ccccc1F Amb31176182 [0,1,0,0,0,1|2,0,0]=4 2838 B15R1.1321 C=C(COCc1ccccc1)C(=O)OC Amb27478485 [0,1,0,0,0,1|0,0,1]=3 2839 B15R1.1321 CCC(=O)C(C)COCc1ccccc1 Amb25307969 [0,1,0,0,0,1|1,0,0]=3 2840 B15R1.1321 CCC(=O)[C@@H](C)COCc1ccccc1 Amb26622039 [0,1,0,0,0,1|1,0,0]=3 2841 B15R1.1321 CN(CCCc1ccccc1)C(=O)CCl Amb9451843 [0,1,0,0,0,1|2,0,0]=4 2842 B15R1.1321 CN(CCCc1ccccc1)C(=O)CN Amb9452004 [0,1,0,0,0,1|2,0,0]=4 2843 B15R1.1321 COC(=O)C(Br)COCc1ccccc1 Amb26452853 [0,1,0,0,0,1|0,0,0]=2 2844 B15R1.1321 COC(=O)C(C)CCCc1ccccc1 Amb8392134 [0,1,0,0,0,1|0,0,0]=2 2845 B15R1.1321 COC(=O)C(C)CNCc1ccccc1 Amb2725270 [0,1,0,0,0,1|0,0,0]=2 2846 B15R1.1321 COC(=O)C(C)CNCc1ccccn1 Amb9253100 [0,1,0,0,0,1|1,0,0]=3 2847 B15R1.1321 COC(=O)C(C)CNCc1cccnc1 Amb9253102 [0,1,0,0,0,1|1,0,0]=3 2848 B15R1.1321 COC(=O)C(C)CNCc1ccncc1 Amb9253101 [0,1,0,0,0,1|1,0,0]=3 2849 B15R1.1321 COC(=O)C(C)COCc1ccccc1 Amb9399794 [0,1,0,0,0,1|0,0,0]=2 2850 B15R1.1321 COC(=O)C(I)CNCc1ccccc1 Amb28047499 [0,1,0,0,0,1|0,0,0]=2 2851 B15R1.1321 COC(=O)C(N)CCCc1ccccc1 Amb34912861 [0,1,0,0,0,1|0,0,0]=2 2852 B15R1.1321 COC(=O)C(N)CCNc1ccccc1 Amb32993447 [0,1,0,0,0,1|0,0,0]=2 2853 B15R1.1321 COC(=O)C(N)CCSc1ccccc1 Amb33802740 [0,1,0,0,0,1|0,0,0]=2 2854 B15R1.1321 COC(=O)C(N)COCc1ccccc1 Amb24081016 [0,1,0,0,0,1|0,0,0]=2 2855 B15R1.1321 COC(=O)C(O)CCCc1ccccc1 Amb28963669 [0,1,0,0,0,1|0,0,0]=2 2856 B15R1.1321 COC(=O)C(O)COCc1ccccc1 Amb22641879 [0,1,0,0,0,1|0,0,0]=2 2857 B15R1.1321 COC(=O)[C@@H](C)CNCc1ccccc1 Amb27466484 [0,1,0,0,0,1|0,0,0]=2 2858 B15R1.1321 COC(=O)[C@@H](C)COCc1ccccc1 Amb26332074 [0,1,0,0,0,1|0,0,0]=2 2859 B15R1.1321 COC(=O)[C@@H](N)COCc1ccccc1 Amb10844864 [0,1,0,0,0,1|0,0,0]=2 2860 B15R1.1321 COC(=O)[C@@H](N)COCc1ccccc1 Amb22746151 [0,1,0,0,0,1|0,0,0]=2 2861 B15R1.1321 COC(=O)[C@@H](N)CSCc1ccccc1 Amb16183933 [0,1,0,0,0,1|0,0,0]=2 2862 B15R1.1321 COC(=O)[C@@H](N)CSCc1ccccc1 Amb19944285 [0,1,0,0,0,1|0,0,0]=2 2863 B15R1.1321 COC(=O)[C@@H](O)CNCc1ccccc1 Amb27604331 [0,1,0,0,0,1|0,0,0]=2 2864 B15R1.1321 COC(=O)[C@@H](O)COCc1ccccc1 Amb2697757 [0,1,0,0,0,1|0,0,0]=2 2865 B15R1.1321 COC(=O)[C@H](N)CCCc1ccccc1 Amb34912871 [0,1,0,0,0,1|0,0,0]=2 2866 B15R1.1321 COC(=O)[C@H](O)COCc1ccccc1 Amb17617212 [0,1,0,0,0,1|0,0,0]=2 2867 B15R1.1321 CON(C)C(=O)CCCc1ccccc1 Amb20673757 [0,1,0,0,0,1|2,0,0]=4 2868 B15R1.3664 C=C(C)C(=O)CCNCc1ccccc1 Amb33131467 [0,1,0,0,0,1|1,0,0]=3 2869 B15R1.3664 C=C(C)C(=O)OCCCc1ccccc1 Amb17934136 [0,1,0,0,0,1|1,0,0]=3 2870 B15R1.3664 CC(C)C(=O)CCNCc1ccccc1 Amb33131383 [0,1,0,0,0,1|1,0,0]=3 2871 B15R1.3664 CC(C)C(=O)OCCOc1ccccc1 Amb4018563 [0,1,0,0,0,1|2,0,0]=4 2872 B15R1.3664 CC(Cl)C(=O)NCCCc1ccccc1 Amb9241599 [0,1,0,0,0,1|1,0,0]=3 2873 B15R1.3664 CN(C)C(=N)CCOCc1ccccc1 Amb28458633 [0,1,0,0,0,1|2,0,0]=4 2874 B15R1.3664 CN(C)C(=O)CC\C=C\c1ccccc1 Amb24110297 [0,1,0,0,0,1|1,0,1]=4 2875 B15R1.3664 CN(C)C(=O)CNCCc1ccccc1 Amb6711711 [0,1,0,0,0,1|1,0,0]=3 2876 B15R1.3664 O=C(O)C(=O)NCCCc1ccccc1 Amb18529576 [0,1,0,0,0,1|2,0,0]=4 2877 B15R1.11 CCCC(=O)CSCc1ccc(Cl)cc1 Amb32683079 [0,2,0,0,0,0|2,0,0]=4 2878 B15R1.11 CCCC(=O)NCCc1ccc(O)cc1 Amb5797543 [0,2,0,0,0,0|2,0,0]=4 2879 B15R1.11 CCNC(=O)NCCc1ccc(O)cc1 Amb13883052 [0,2,0,0,0,0|2,0,0]=4 2880 B15R1.11 CCOC(=O)CCCc1ccc(Br)cc1 Amb18110225 [0,2,0,0,0,0|0,0,0]=2 2881 B15R1.11 CCOC(=O)CCCc1ccc(C)cc1 Amb18629310 [0,2,0,0,0,0|0,0,0]=2 2882 B15R1.11 CCOC(=O)CCCc1ccc(Cl)cc1 Amb18110226 [0,2,0,0,0,0|0,0,0]=2 2883 B15R1.11 CCOC(=O)CCCc1ccc(F)cc1 Amb18110227 [0,2,0,0,0,0|0,0,0]=2 2884 B15R1.11 CCOC(=O)CCCc1ccc(N)cc1 Amb20247754 [0,2,0,0,0,0|0,0,0]=2 2885 B15R1.11 CCOC(=O)CCCc1ccc(N)cc1 Amb34157974 [0,2,0,0,0,0|0,0,0]=2 2886 B15R1.11 CCOC(=O)CCCc1ccc(O)cc1 Amb22491838 [0,2,0,0,0,0|0,0,0]=2 2887 B15R1.11 CCOC(=O)CCNc1ccc(Br)cc1 Amb1981436 [0,2,0,0,0,0|1,0,0]=3 2888 B15R1.11 CCOC(=O)CCNc1ccc(C)cc1 Amb8867124 [0,2,0,0,0,0|1,0,0]=3 2889 B15R1.11 CCOC(=O)CCNc1ccc(Cl)cc1 Amb9026321 [0,2,0,0,0,0|1,0,0]=3 2890 B15R1.11 CCOC(=O)CCNc1ccc(F)cc1 Amb8867892 [0,2,0,0,0,0|1,0,0]=3 2891 B15R1.11 CCOC(=O)CCNc1ccc(N)cc1 Amb32418450 [0,2,0,0,0,0|1,0,0]=3 2892 B15R1.11 CCOC(=O)CCNc1ccc(N)cn1 Amb32419306 [0,2,0,0,0,0|2,0,0]=4 2893 B15R1.11 CCOC(=O)CCOc1ccc(I)cc1 Amb9026183 [0,2,0,0,0,0|1,0,0]=3 2894 B15R1.11 CCOC(=O)CCOc1ccc(N)cc1 Amb33803418 [0,2,0,0,0,0|1,0,0]=3 2895 B15R1.11 CCOC(=O)CCSc1ccc(C)cc1 Amb8390017 [0,2,0,0,0,0|1,0,0]=3 2896 B15R1.11 CCOC(=O)CCSc1ccc(F)cc1 Amb2725823 [0,2,0,0,0,0|1,0,0]=3 2897 B15R1.11 CCOC(=O)CNCc1ccc(Br)cc1 Amb17305755 [0,2,0,0,0,0|1,0,0]=3 2898 B15R1.11 CCOC(=O)CNCc1ccc(C)cc1 Amb13951238 [0,2,0,0,0,0|1,0,0]=3 2899 B15R1.11 CCOC(=O)CNCc1ccc(C)cc1 Amb6713722 [0,2,0,0,0,0|1,0,0]=3 2900 B15R1.11 CCOC(=O)CNCc1ccc(Cl)cc1 Amb6738129 [0,2,0,0,0,0|1,0,0]=3 2901 B15R1.11 CCOC(=O)CNCc1ccc(F)cc1 Amb33547867 [0,2,0,0,0,0|1,0,0]=3 2902 B15R1.11 CCOC(=O)CNCc1ccc(F)cc1 Amb6712528 [0,2,0,0,0,0|1,0,0]=3 2903 B15R1.11 CCOC(=O)CSCc1ccc(N)cc1 Amb9482685 [0,2,0,0,0,0|1,0,0]=3 2904 B15R1.11 CCOC(=O)NCCc1ccc(O)cc1 Amb2697961 [0,2,0,0,0,0|1,0,0]=3 2905 B15R1.11 CCOC(=O)\C=C\Cc1ccc(Cl)cc1 Amb22169827 [0,2,0,0,0,0|0,0,2]=4 2906 B15R1.11 CNCC(=O)NCCc1ccc(F)cc1 Amb6267810 [0,2,0,0,0,0|2,0,0]=4 2907 B15R1.11 COCC(=O)CSCc1ccc(Cl)cc1 Amb32683188 [0,2,0,0,0,0|1,0,0]=3 2908 B15R1.11 COCC(=O)NCCc1ccc(Cl)cc1 Amb22547654 [0,2,0,0,0,0|1,0,0]=3 2909 B15R1.11 Cc1ccc(CCNC(=O)CCCl)cc1 Amb17329838 [0,2,0,0,0,0|2,0,0]=4 2910 B15R1.11 Cc1ccc(CCNC(=O)CCN)cc1 Amb17403323 [0,2,0,0,0,0|2,0,0]=4 2911 B15R1.11 NCCC(=O)NCCc1ccc(Cl)cc1 Amb5785052 [0,2,0,0,0,0|2,0,0]=4 2912 B15R1.11 NCCC(=O)NCCc1ccc(F)cc1 Amb5784995 [0,2,0,0,0,0|2,0,0]=4 2913 B15R1.11 O=C(CCBr)NCCc1ccc(O)cc1 Amb17333048 [0,2,0,0,0,0|2,0,0]=4 2914 B15R1.11 O=C(CCCl)NCCc1ccc(F)cc1 Amb6248943 [0,2,0,0,0,0|2,0,0]=4 2915 B15R1.112 CC(Br)C(=O)NCCc1ccc(Cl)cc1 Amb9174113 [0,2,0,0,0,0|2,0,0]=4 2916 B15R1.112 CC(Br)C(=O)NCCc1ccc(F)cc1 Amb17324172 [0,2,0,0,0,0|2,0,0]=4 2917 B15R1.112 CC(Br)C(=O)NCCc1ccc(O)cc1 Amb17324171 [0,2,0,0,0,0|2,0,0]=4 2918 B15R1.112 CC(C)C(=O)CSCc1ccc(Cl)cc1 Amb32682909 [0,2,0,0,0,0|2,0,0]=4 2919 B15R1.112 CC(C)C(=O)NCCc1ccc(Br)cc1 Amb3986754 [0,2,0,0,0,0|2,0,0]=4 2920 B15R1.112 CC(C)C(=O)NCCc1ccc(N)cc1 Amb17140116 [0,2,0,0,0,0|2,0,0]=4 2921 B15R1.112 CC(C)C(=O)NCCc1ccc(O)cc1 Amb5797620 [0,2,0,0,0,0|2,0,0]=4 2922 B15R1.112 CC(Cl)C(=O)NCCc1ccc(F)cc1 Amb9703474 [0,2,0,0,0,0|2,0,0]=4 2923 B15R1.112 CC(Cl)C(=O)NCCc1ccc(O)cc1 Amb17325051 [0,2,0,0,0,0|2,0,0]=4 2924 B15R1.112 CC(N)C(=O)NCCc1ccc(Br)cc1 Amb17419745 [0,2,0,0,0,0|2,0,0]=4 2925 B15R1.112 CN(C)C(=O)CCCc1ccc(N)cc1 Amb17338565 [0,2,0,0,0,0|1,0,0]=3 2926 B15R1.112 CN(C)C(=O)CCOc1ccc(Br)cc1 Amb15714341 [0,2,0,0,0,0|2,0,0]=4 2927 B15R1.112 CN(C)C(=O)CCOc1ccc(N)cc1 Amb13951785 [0,2,0,0,0,0|2,0,0]=4 2928 B15R1.112 CN(C)C(=O)CNCc1ccc(Br)cc1 Amb8938543 [0,2,0,0,0,0|2,0,0]=4 2929 B15R1.112 CN(C)C(=O)CNCc1ccc(Cl)cc1 Amb6738091 [0,2,0,0,0,0|2,0,0]=4 2930 B15R1.112 CN(C)C(=O)CNCc1ccc(F)cc1 Amb6712477 [0,2,0,0,0,0|2,0,0]=4 2931 B15R1.112 CN(C)C(=O)NCCc1ccc(N)cc1 Amb31183148 [0,2,0,0,0,0|2,0,0]=4 2932 B15R1.112 C[C@@H](N)C(=O)NCCc1ccc(Cl)cc1 Amb18014714 [0,2,0,0,0,0|2,0,0]=4 2933 B15R1.112 C[C@@H](N)C(=O)NCCc1ccc(F)cc1 Amb18014660 [0,2,0,0,0,0|2,0,0]=4 2934 B15R1.112 Cc1ccc(CCNC(=O)C(C)Cl)cc1 Amb17331890 [0,2,0,0,0,0|2,0,0]=4 2935 B15R1.112 Cc1ccc(CCNC(=O)C(C)N)cc1 Amb17403324 [0,2,0,0,0,0|2,0,0]=4 2936 B15R1.112 Cc1ccc(CNCC(=O)N(C)C)cc1 Amb6713679 [0,2,0,0,0,0|2,0,0]=4 2937 B15R1.112 O=C(O)C(=O)CCCc1ccc(Br)cc1 Amb33006013 [0,2,0,0,0,0|2,0,0]=4 2938 B15R1.112 O=C(O)C(=O)CCCc1ccc(F)cc1 Amb33320032 [0,2,0,0,0,0|2,0,0]=4 2939 B15R1.132 CCC(=O)NCC(O)c1ccc(Br)cc1 Amb17364711 [0,2,0,0,0,0|2,0,0]=4 2940 B15R1.132 CCC(=O)NCC(O)c1ccc(C)cc1 Amb17338748 [0,2,0,0,0,0|2,0,0]=4 2941 B15R1.132 CCC(=O)NCC(O)c1ccc(Cl)cc1 Amb17343947 [0,2,0,0,0,0|2,0,0]=4 2942 B15R1.132 CCC(=O)NCC(O)c1ccc(F)cc1 Amb17339618 [0,2,0,0,0,0|2,0,0]=4 2943 B15R1.132 CNC(=O)CCC(=O)c1ccc(Br)cc1 Amb1230588 [0,2,0,0,0,0|1,0,1]=4 2944 B15R1.132 CNC(=O)CCC(=O)c1ccc(C)cc1 Amb15823510 [0,2,0,0,0,0|1,0,1]=4 2945 B15R1.132 CNC(=O)CCC(=O)c1ccc(Cl)cc1 Amb17343482 [0,2,0,0,0,0|1,0,1]=4 2946 B15R1.132 CNC(=O)CCC(=O)c1ccc(F)cc1 Amb17339209 [0,2,0,0,0,0|1,0,1]=4 2947 B15R1.132 CNC(=O)CCC(=O)c1ccc(N)cc1 Amb17338507 [0,2,0,0,0,0|1,0,1]=4 2948 B15R1.132 CNC(=O)CCC(O)c1ccc(Br)cc1 Amb17364714 [0,2,0,0,0,0|1,0,0]=3 2949 B15R1.132 CNC(=O)CCC(O)c1ccc(C)cc1 Amb17338777 [0,2,0,0,0,0|1,0,0]=3 2950 B15R1.132 CNC(=O)CCC(O)c1ccc(Cl)cc1 Amb17343952 [0,2,0,0,0,0|1,0,0]=3 2951 B15R1.132 CNC(=O)CCC(O)c1ccc(F)cc1 Amb17339622 [0,2,0,0,0,0|1,0,0]=3 2952 B15R1.132 COC(=O)CCC(=O)c1ccc(Br)cc1 Amb2666621 [0,2,0,0,0,0|0,0,1]=3 2953 B15R1.132 COC(=O)CCC(=O)c1ccc(C)cc1 Amb4024939 [0,2,0,0,0,0|0,0,1]=3 2954 B15R1.132 COC(=O)CCC(=O)c1ccc(Cl)cc1 Amb17343658 [0,2,0,0,0,0|0,0,1]=3 2955 B15R1.132 COC(=O)CCC(=O)c1ccc(F)cc1 Amb6361103 [0,2,0,0,0,0|0,0,1]=3 2956 B15R1.132 COC(=O)CCC(=O)c1ccc(N)cc1 Amb17403392 [0,2,0,0,0,0|0,0,1]=3 2957 B15R1.132 COC(=O)CCC(N)c1ccc(Br)cc1 Amb32645733 [0,2,0,0,0,0|0,0,0]=2 2958 B15R1.132 COC(=O)CCC(N)c1ccc(Br)cn1 Amb33009465 [0,2,0,0,0,0|1,0,0]=3 2959 B15R1.132 COC(=O)CCC(N)c1ccc(Br)nc1 Amb33009459 [0,2,0,0,0,0|1,0,0]=3 2960 B15R1.132 COC(=O)CCC(N)c1ccc(C)cc1 Amb33449563 [0,2,0,0,0,0|0,0,0]=2 2961 B15R1.132 COC(=O)CCC(N)c1ccc(C)cn1 Amb33361917 [0,2,0,0,0,0|1,0,0]=3 2962 B15R1.132 COC(=O)CCC(N)c1ccc(C)nc1 Amb33080026 [0,2,0,0,0,0|1,0,0]=3 2963 B15R1.132 COC(=O)CCC(N)c1ccc(Cl)cc1 Amb33220789 [0,2,0,0,0,0|0,0,0]=2 2964 B15R1.132 COC(=O)CCC(N)c1ccc(Cl)cn1 Amb33390420 [0,2,0,0,0,0|1,0,0]=3 2965 B15R1.132 COC(=O)CCC(N)c1ccc(Cl)nc1 Amb33406537 [0,2,0,0,0,0|1,0,0]=3 2966 B15R1.132 COC(=O)CCC(N)c1ccc(F)cc1 Amb33172103 [0,2,0,0,0,0|0,0,0]=2 2967 B15R1.132 COC(=O)CCC(N)c1ccc(F)cn1 Amb32953148 [0,2,0,0,0,0|1,0,0]=3 2968 B15R1.132 COC(=O)CCC(N)c1ccc(F)nc1 Amb33359275 [0,2,0,0,0,0|1,0,0]=3 2969 B15R1.132 COC(=O)CCC(N)c1ccc(O)cc1 Amb33079363 [0,2,0,0,0,0|0,0,0]=2 2970 B15R1.132 COC(=O)CCC(N)c1cnc(C)cn1 Amb33374307 [0,2,0,0,0,0|2,0,0]=4 2971 B15R1.132 COC(=O)CCC(N)c1ncc(Br)cn1 Amb33006257 [0,2,0,0,0,0|2,0,0]=4 2972 B15R1.132 COC(=O)CCC(O)c1ccc(Br)cc1 Amb18108514 [0,2,0,0,0,0|0,0,0]=2 2973 B15R1.132 COC(=O)CCN(C)c1ccc(Br)cn1 Amb32664366 [0,2,0,0,0,0|2,0,0]=4 2974 B15R1.132 COC(=O)CNC(=O)c1ccc(N)cc1 Amb2339872 [0,2,0,0,0,0|1,0,1]=4 2975 B15R1.132 COC(=O)CNC(=O)c1ccc(N)cc1 Amb2371210 [0,2,0,0,0,0|1,0,1]=4 2976 B15R1.206 CCc1ccc(CCCC(=O)OC)cc1 Amb18628143 [0,2,0,0,0,0|0,0,0]=2 2977 B15R1.206 COC(=O)CCCc1ccc(CO)cc1 Amb16233194 [0,2,0,0,0,0|0,0,0]=2 2978 B15R1.206 COC(=O)CCCc1ccc(OC)cc1 Amb18110196 [0,2,0,0,0,0|0,0,0]=2 2979 B15R1.206 COC(=O)CCNc1ccc(OC)cc1 Amb9024007 [0,2,0,0,0,0|1,0,0]=3 2980 B15R1.206 COC(=O)CCOc1ccc(OC)cc1 Amb9202550 [0,2,0,0,0,0|1,0,0]=3 2981 B15R1.206 COC(=O)CCSc1ccc(C#N)cc1 Amb9264461 [0,2,0,0,0,0|1,0,0]=3 2982 B15R1.206 COC(=O)CNCc1ccc(OC)cc1 Amb33801443 [0,2,0,0,0,0|1,0,0]=3 2983 B15R1.981 COC(=O)CC(=O)Cc1ccc(Br)cc1 Amb33850002 [0,2,0,0,0,0|0,0,1]=3 2984 B15R1.981 COC(=O)CC(=O)Cc1ccc(C)cc1 Amb19943932 [0,2,0,0,0,0|0,0,1]=3 2985 B15R1.981 COC(=O)CC(=O)Cc1ccc(F)cc1 Amb9133084 [0,2,0,0,0,0|0,0,1]=3 2986 B15R1.981 COC(=O)CC(=O)Nc1ccc(Br)cc1 Amb6811749 [0,2,0,0,0,0|1,0,1]=4 2987 B15R1.981 COC(=O)CC(=O)Nc1ccc(C)cc1 Amb6811774 [0,2,0,0,0,0|1,0,1]=4 2988 B15R1.981 COC(=O)CC(=O)Nc1ccc(Cl)cc1 Amb6811744 [0,2,0,0,0,0|1,0,1]=4 2989 B15R1.981 COC(=O)CC(=O)Nc1ccc(F)cc1 Amb6811751 [0,2,0,0,0,0|1,0,1]=4 2990 B15R1.981 COC(=O)CC(Br)Cc1ccc(C)cc1 Amb18629522 [0,2,0,0,0,0|0,0,0]=2 2991 B15R1.981 COC(=O)CC(Br)Cc1ccc(F)cc1 Amb18111049 [0,2,0,0,0,0|0,0,0]=2 2992 B15R1.981 COC(=O)CC(Cl)Cc1ccc(C)cc1 Amb18111204 [0,2,0,0,0,0|0,0,0]=2 2993 B15R1.981 COC(=O)CC(Cl)Cc1ccc(Cl)cc1 Amb18110696 [0,2,0,0,0,0|0,0,0]=2 2994 B15R1.981 COC(=O)CC(Cl)Cc1ccc(F)cc1 Amb18629899 [0,2,0,0,0,0|0,0,0]=2 2995 B15R1.981 COC(=O)CC(N)Cc1ccc(Br)cc1 Amb18629780 [0,2,0,0,0,0|0,0,0]=2 2996 B15R1.981 COC(=O)CC(N)Cc1ccc(C)cc1 Amb18629754 [0,2,0,0,0,0|0,0,0]=2 2997 B15R1.981 COC(=O)CC(N)Cc1ccc(Cl)cc1 Amb18628875 [0,2,0,0,0,0|0,0,0]=2 2998 B15R1.981 COC(=O)CC(N)Cc1ccc(Cl)cc1 Amb32653086 [0,2,0,0,0,0|0,0,0]=2 2999 B15R1.981 COC(=O)CC(N)Cc1ccc(F)cc1 Amb18629806 [0,2,0,0,0,0|0,0,0]=2 3000 B15R1.1001 CCC(=O)C(C)SCc1ccc(Cl)cc1 Amb32682948 [0,2,0,0,0,0|2,0,0]=4 3001 B15R1.1001 COC(=O)C(C)CNc1ccc(Br)cc1 Amb9400481 [0,2,0,0,0,0|1,0,0]=3 3002 B15R1.1001 COC(=O)C(C)CNc1ccc(C)cn1 Amb18095568 [0,2,0,0,0,0|2,0,0]=4 3003 B15R1.1001 COC(=O)C(C)CNc1ccc(Cl)cn1 Amb18095607 [0,2,0,0,0,0|2,0,0]=4 3004 B15R1.1001 COC(=O)C(C)NCc1ccc(F)cc1 Amb33746357 [0,2,0,0,0,0|1,0,0]=3 3005 B15R1.1001 COC(=O)C(C)SCc1ccc(N)cc1 Amb17497482 [0,2,0,0,0,0|1,0,0]=3 3006 B15R1.1001 COC(=O)C(N)CCc1ccc(Br)cc1 Amb33006022 [0,2,0,0,0,0|0,0,0]=2 3007 B15R1.1001 COC(=O)C(N)CCc1ccc(F)cc1 Amb32645645 [0,2,0,0,0,0|0,0,0]=2 3008 B15R1.1001 COC(=O)C(N)COc1ccc(Br)cc1 Amb22642972 [0,2,0,0,0,0|1,0,0]=3 3009 B15R1.1001 COC(=O)C(N)COc1ccc(Cl)cc1 Amb22642971 [0,2,0,0,0,0|1,0,0]=3 3010 B15R1.1001 COC(=O)C(N)COc1ccc(F)cc1 Amb22642643 [0,2,0,0,0,0|1,0,0]=3 3011 B15R1.1001 COC(=O)C(N)COc1ccc(F)cc1 Amb32662450 [0,2,0,0,0,0|1,0,0]=3 3012 B15R1.1001 COC(=O)C(N)CSc1ccc(Cl)cc1 Amb22642977 [0,2,0,0,0,0|1,0,0]=3 3013 B15R1.1001 COC(=O)C(N)CSc1ccc(F)cc1 Amb22642975 [0,2,0,0,0,0|1,0,0]=3 3014 B15R1.1001 COC(=O)C(N)\C=C\c1ccc(F)cc1 Amb33418779 [0,2,0,0,0,0|0,0,2]=4 3015 B15R1.1001 COC(=O)C(O)CCc1ccc(Br)cc1 Amb33006002 [0,2,0,0,0,0|0,0,0]=2 3016 B15R1.1001 COC(=O)C(O)CCc1ccc(F)cc1 Amb33474072 [0,2,0,0,0,0|0,0,0]=2 3017 B15R1.1001 COC(=O)C(O)\C=C\c1ccc(F)cc1 Amb33202033 [0,2,0,0,0,0|0,0,2]=4 3018 B15R1.1001 COC(=O)[C@@H](N)\C=C\c1ccc(F)cc1 Amb31289577 [0,2,0,0,0,0|0,0,2]=4 3019 B15R1.1001 COC(=O)[C@H](C)NCc1ccc(Cl)cc1 Amb9228617 [0,2,0,0,0,0|1,0,0]=3 3020 B15R1.3836 COC(=O)C#CCc1ccc(Br)cc1F Amb35672808 [0,2,0,0,0,0|0,0,2]=4 3021 B15R1.3836 COC(=O)CCCc1ccc(C)cc1C Amb18629278 [0,2,0,0,0,0|0,0,0]=2 3022 B15R1.3836 COC(=O)CCCc1ccc(Cl)cc1Cl Amb18629277 [0,2,0,0,0,0|0,0,0]=2 3023 B15R1.3836 COC(=O)CCCc1ccc(Cl)cc1N Amb21864903 [0,2,0,0,0,0|0,0,0]=2 3024 B15R1.3836 COC(=O)CCNc1ccc(Br)cc1C Amb9026249 [0,2,0,0,0,0|1,0,0]=3 3025 B15R1.3836 COC(=O)CCNc1ccc(C)cc1Br Amb9026215 [0,2,0,0,0,0|1,0,0]=3 3026 B15R1.3836 COC(=O)CCNc1ncc(C)cc1Br Amb33483019 [0,2,0,0,0,0|2,0,0]=4 3027 B15R1.3836 COC(=O)CCOc1ccc(Cl)cc1Br Amb9203764 [0,2,0,0,0,0|1,0,0]=3 3028 B15R1.3836 COC(=O)CCOc1ccc(Cl)cc1Cl Amb9203253 [0,2,0,0,0,0|1,0,0]=3 3029 B15R1.3836 COC(=O)CCOc1ccc(F)cc1F Amb9206346 [0,2,0,0,0,0|1,0,0]=3 3030 B15R1.11630 CCC(=O)CCCc1ccc(Cl)c(C)c1 Amb33253092 [0,2,0,0,0,0|1,0,0]=3 3031 B15R1.11630 CNC(=O)CCCN1C=CC(=O)C(N)=C1 Amb32699657 [0,2,0,0,0,0|2,0,0]=4 3032 B15R1.11630 CNC(=O)CCCc1ccc(O)c(O)c1 Amb24102783 [0,2,0,0,0,0|1,0,0]=3 3033 B15R1.11630 CNC(=O)CNCc1ccc(Cl)c(C)c1 Amb33253352 [0,2,0,0,0,0|2,0,0]=4 3034 B15R1.11630 COC(=O)C#CCc1ccc(C)c(C)c1 Amb27754467 [0,2,0,0,0,0|0,0,2]=4 3035 B15R1.11630 COC(=O)C#CCc1ccc(Cl)c(Cl)c1 Amb28382578 [0,2,0,0,0,0|0,0,2]=4 3036 B15R1.11630 COC(=O)CCCN1C=CC(=O)C(N)=C1 Amb32700172 [0,2,0,0,0,0|1,0,0]=3 3037 B15R1.11630 COC(=O)CCCc1ccc(C)c(C)c1 Amb18108524 [0,2,0,0,0,0|0,0,0]=2 3038 B15R1.11630 COC(=O)CCCc1ccc(Cl)c(C)c1 Amb18110194 [0,2,0,0,0,0|0,0,0]=2 3039 B15R1.11630 COC(=O)CCCc1ccc(Cl)c(Cl)c1 Amb18629298 [0,2,0,0,0,0|0,0,0]=2 3040 B15R1.11630 COC(=O)CCCc1ccc(F)c(C)c1 Amb18110204 [0,2,0,0,0,0|0,0,0]=2 3041 B15R1.11630 COC(=O)CCCc1ccc(F)c(F)c1 Amb18110213 [0,2,0,0,0,0|0,0,0]=2 3042 B15R1.11630 COC(=O)CCNc1ccc(Br)c(C)c1 Amb8867875 [0,2,0,0,0,0|1,0,0]=3 3043 B15R1.11630 COC(=O)CCNc1ccc(C)c(Br)c1 Amb18607730 [0,2,0,0,0,0|1,0,0]=3 3044 B15R1.11630 COC(=O)CCNc1ccc(C)c(Cl)c1 Amb8867853 [0,2,0,0,0,0|1,0,0]=3 3045 B15R1.11630 COC(=O)CNCc1ccc(Cl)c(C)c1 Amb33253354 [0,2,0,0,0,0|1,0,0]=3 3046 B15R1.11630 COC(=O)CNCc1ccc(F)c(F)c1 Amb19339858 [0,2,0,0,0,0|1,0,0]=3 3047 B15R1.11630 COC(=O)CNCc1ccc(F)c(F)c1 Amb6686956 [0,2,0,0,0,0|1,0,0]=3 3048 B15R1.89 CCCC(=O)OCC(C)c1ccccc1 Amb6357445 [0,2,0,0,0,0|2,0,0]=4 3049 B15R1.89 CCOC(=O)CCC(=O)c1ccccc1 Amb6305630 [0,2,0,0,0,0|0,0,1]=3 3050 B15R1.89 CCOC(=O)CCC(=O)c1ccccn1 Amb2699950 [0,2,0,0,0,0|1,0,1]=4 3051 B15R1.89 CCOC(=O)CCC(=O)c1cccnc1 Amb2699951 [0,2,0,0,0,0|1,0,1]=4 3052 B15R1.89 CCOC(=O)CCC(=O)c1ccncc1 Amb2699952 [0,2,0,0,0,0|1,0,1]=4 3053 B15R1.89 CCOC(=O)CCC(Br)c1ccccc1 Amb24089411 [0,2,0,0,0,0|0,0,0]=2 3054 B15R1.89 CCOC(=O)CCC(Cl)c1ccccc1 Amb17217298 [0,2,0,0,0,0|0,0,0]=2 3055 B15R1.89 CCOC(=O)CCC(N)c1cccnc1 Amb24117099 [0,2,0,0,0,0|1,0,0]=3 3056 B15R1.89 CCOC(=O)CCC(N)c1cccnc1 Amb30876862 [0,2,0,0,0,0|1,0,0]=3 3057 B15R1.89 CCOC(=O)CCC(O)c1ccccc1 Amb32666885 [0,2,0,0,0,0|0,0,0]=2 3058 B15R1.89 CCOC(=O)CC[C@H](N)c1ncccn1 Amb32716232 [0,2,0,0,0,0|2,0,0]=4 3059 B15R1.89 CCOC(=O)CNC(=O)c1ccccc1 Amb6356937 [0,2,0,0,0,0|1,0,1]=4 3060 B15R1.89 CCOC(=O)CNC(C)c1ccccc1 Amb6706943 [0,2,0,0,0,0|1,0,0]=3 3061 B15R1.89 CCOC(=O)CN[C@@H](C)c1ccccc1 Amb17739848 [0,2,0,0,0,0|1,0,0]=3 3062 B15R1.89 CCOC(=O)CN[C@H](C)c1ccccc1 Amb17935772 [0,2,0,0,0,0|1,0,0]=3 3063 B15R1.89 CCOC(=O)\C=N/[C@@H](C)c1ccccc1 Amb32405805 [0,2,0,0,0,0|1,0,1]=4 3064 B15R1.89 O=C(CCBr)NCC(O)c1ccccc1 Amb17330748 [0,2,0,0,0,0|2,0,0]=4 3065 B15R1.133 CNC(=O)CCC(=O)c1cccc(Br)c1 Amb17363513 [0,2,0,0,0,0|1,0,1]=4 3066 B15R1.133 CNC(=O)CCC(=O)c1cccc(N)c1 Amb17338506 [0,2,0,0,0,0|1,0,1]=4 3067 B15R1.133 CNC(=O)CCC(O)c1cccc(Br)c1 Amb17364715 [0,2,0,0,0,0|1,0,0]=3 3068 B15R1.133 CNC(=O)CCC(O)c1cccc(N)c1 Amb17339067 [0,2,0,0,0,0|1,0,0]=3 3069 B15R1.133 COC(=O)CCC(=O)c1cccc(N)c1 Amb33802420 [0,2,0,0,0,0|0,0,1]=3 3070 B15R1.133 COC(=O)CCC(N)c1cc(C)ccn1 Amb33358870 [0,2,0,0,0,0|1,0,0]=3 3071 B15R1.133 COC(=O)CCC(N)c1cc(Cl)ccn1 Amb33261282 [0,2,0,0,0,0|1,0,0]=3 3072 B15R1.133 COC(=O)CCC(N)c1cc(F)ccn1 Amb33320241 [0,2,0,0,0,0|1,0,0]=3 3073 B15R1.133 COC(=O)CCC(N)c1cccc(Br)c1 Amb33005020 [0,2,0,0,0,0|0,0,0]=2 3074 B15R1.133 COC(=O)CCC(N)c1cccc(Br)n1 Amb33005056 [0,2,0,0,0,0|1,0,0]=3 3075 B15R1.133 COC(=O)CCC(N)c1cccc(C)c1 Amb33079148 [0,2,0,0,0,0|0,0,0]=2 3076 B15R1.133 COC(=O)CCC(N)c1cccc(C)n1 Amb33474651 [0,2,0,0,0,0|1,0,0]=3 3077 B15R1.133 COC(=O)CCC(N)c1cccc(Cl)c1 Amb32750805 [0,2,0,0,0,0|0,0,0]=2 3078 B15R1.133 COC(=O)CCC(N)c1cccc(Cl)n1 Amb33406934 [0,2,0,0,0,0|1,0,0]=3 3079 B15R1.133 COC(=O)CCC(N)c1cccc(F)c1 Amb33474562 [0,2,0,0,0,0|0,0,0]=2 3080 B15R1.133 COC(=O)CCC(N)c1cccc(O)c1 Amb33474412 [0,2,0,0,0,0|0,0,0]=2 3081 B15R1.133 COC(=O)CCC(N)c1ccnc(C)c1 Amb33428650 [0,2,0,0,0,0|1,0,0]=3 3082 B15R1.133 COC(=O)CCC(N)c1ccnc(Cl)c1 Amb33390278 [0,2,0,0,0,0|1,0,0]=3 3083 B15R1.133 COC(=O)CCC(N)c1cncc(Br)c1 Amb33009464 [0,2,0,0,0,0|1,0,0]=3 3084 B15R1.133 COC(=O)CCC(N)c1cncc(C)c1 Amb33359122 [0,2,0,0,0,0|1,0,0]=3 3085 B15R1.133 COC(=O)CCC(N)c1cncc(F)c1 Amb33359811 [0,2,0,0,0,0|1,0,0]=3 3086 B15R1.133 COC(=O)CNC(=O)c1cccc(N)c1 Amb33536683 [0,2,0,0,0,0|1,0,1]=4 3087 B15R1.133 COC(=O)CNC(C)c1cccc(Br)c1 Amb6687009 [0,2,0,0,0,0|1,0,0]=3 3088 B15R1.311 CNS(=O)(=O)CCC(C)c1ccccc1 Amb32691700 [0,2,0,0,0,0|2,0,0]=4 3089 B15R1.500 CC(Br)C(=O)NCC(O)c1ccccc1 Amb17332798 [0,2,0,0,0,0|2,0,0]=4 3090 B15R1.500 CC(C)C(=O)NCC(O)c1ccccc1 Amb3997825 [0,2,0,0,0,0|2,0,0]=4 3091 B15R1.500 CC(C)C(=O)OCC(C)c1ccccc1 Amb6357444 [0,2,0,0,0,0|2,0,0]=4 3092 B15R1.500 CC(Cl)C(=O)NCC(C)c1ccccc1 Amb2303939 [0,2,0,0,0,0|2,0,0]=4 3093 B15R1.500 CC(NCC(=O)N(C)C)c1ccccc1 Amb9749847 [0,2,0,0,0,0|2,0,0]=4 3094 B15R1.500 CN(C)C(=O)CCC(=O)c1ccccc1 Amb17338275 [0,2,0,0,0,0|1,0,1]=4 3095 B15R1.500 CN(C)C(=O)CCC(O)c1ccccc1 Amb17338776 [0,2,0,0,0,0|1,0,0]=3 3096 B15R1.947 COC(=O)C(=O)CC(=O)c1ccccc1 Amb1212252 [0,2,0,0,0,0|0,0,2]=4 3097 B15R1.947 COC(=O)C(C)NC(=O)c1ccccc1 Amb3997938 [0,2,0,0,0,0|1,0,1]=4 3098 B15R1.947 COC(=O)C(C)NC(C)c1ccccc1 Amb33747613 [0,2,0,0,0,0|1,0,0]=3 3099 B15R1.947 COC(=O)C(N)CC(=O)c1ccccc1 Amb33726915 [0,2,0,0,0,0|0,0,1]=3 3100 B15R1.947 COC(=O)C(N)CC(C)c1ccccc1 Amb33746110 [0,2,0,0,0,0|0,0,0]=2 3101 B15R1.947 COC(=O)C(N)CN(C)c1ccccc1 Amb33726824 [0,2,0,0,0,0|1,0,0]=3 3102 B15R1.947 COC(=O)[C@H](C)NC(=O)c1ccccc1 Amb6357136 [0,2,0,0,0,0|1,0,1]=4 3103 B15R1.950 COC(=O)CC(=O)N(C)c1ccccc1 Amb17403408 [0,2,0,0,0,0|1,0,1]=4 3104 B15R1.950 COC(=O)CC(Br)C(=O)c1ccccc1 Amb18114950 [0,2,0,0,0,0|0,0,1]=3 3105 B15R1.950 COC(=O)CC(N)C(=O)c1ccccc1 Amb18108593 [0,2,0,0,0,0|0,0,1]=3 3106 B15R1.950 COC(=O)CC(N)C(C)c1ccccc1 Amb33495876 [0,2,0,0,0,0|0,0,0]=2 3107 B15R1.1094 COC(=O)CNS(=O)(=O)c1ccccc1 Amb2582841 [0,2,0,0,0,0|2,0,0]=4 3108 B15R1.1097 CCC(C#CC(=O)OC)c1ccccc1 Amb27875896 [0,2,0,0,0,0|0,0,2]=4 3109 B15R1.1097 CCC(NCC(=O)OC)c1ccccc1 Amb9742865 [0,2,0,0,0,0|1,0,0]=3 3110 B15R1.1097 CCN(CCC(=O)OC)c1ccccc1 Amb7775290 [0,2,0,0,0,0|1,0,0]=3 3111 B15R1.1097 COC(=O)CCC(C#N)c1ccccn1 Amb32429830 [0,2,0,0,0,0|1,0,0]=3 3112 B15R1.5815 COC(=O)CCC(=O)c1ccccc1N Amb22057692 [0,2,0,0,0,0|0,0,1]=3 3113 B15R1.5815 COC(=O)CCC(N)c1ccccc1Br Amb33005065 [0,2,0,0,0,0|0,0,0]=2 3114 B15R1.5815 COC(=O)CCC(N)c1ccccc1C Amb33359704 [0,2,0,0,0,0|0,0,0]=2 3115 B15R1.5815 COC(=O)CCC(N)c1ccccc1Cl Amb33406902 [0,2,0,0,0,0|0,0,0]=2 3116 B15R1.5815 COC(=O)CCC(N)c1ccccc1F Amb33358996 [0,2,0,0,0,0|0,0,0]=2 3117 B15R1.5815 COC(=O)CCC(N)c1ccccc1O Amb33428827 [0,2,0,0,0,0|0,0,0]=2 3118 B15R1.5815 COC(=O)CCC(N)c1cccnc1Br Amb33005082 [0,2,0,0,0,0|1,0,0]=3 3119 B15R1.5815 COC(=O)CCC(N)c1cccnc1C Amb32878948 [0,2,0,0,0,0|1,0,0]=3 3120 B15R1.5815 COC(=O)CCC(N)c1cccnc1Cl Amb33261775 [0,2,0,0,0,0|1,0,0]=3 3121 B15R1.5815 COC(=O)CCC(N)c1cccnc1F Amb33449715 [0,2,0,0,0,0|1,0,0]=3 3122 B15R1.5815 COC(=O)CCC(N)c1ccncc1Br Amb33005672 [0,2,0,0,0,0|1,0,0]=3 3123 B15R1.5815 COC(=O)CCC(N)c1ccncc1C Amb33426454 [0,2,0,0,0,0|1,0,0]=3 3124 B15R1.5815 COC(=O)CCC(N)c1ccncc1Cl Amb33390270 [0,2,0,0,0,0|1,0,0]=3 3125 B15R1.5815 COC(=O)CCC(N)c1ccncc1F Amb32953905 [0,2,0,0,0,0|1,0,0]=3 3126 B15R1.5815 COC(=O)CCC(N)c1cnccc1C Amb33079949 [0,2,0,0,0,0|1,0,0]=3 3127 B15R1.5815 COC(=O)CCC(N)c1cncnc1C Amb33148944 [0,2,0,0,0,0|2,0,0]=4 3128 B15R1.5815 COC(=O)CCC(N)c1ncccc1Br Amb33005032 [0,2,0,0,0,0|1,0,0]=3 3129 B15R1.5815 COC(=O)CCC(N)c1ncccc1C Amb32954777 [0,2,0,0,0,0|1,0,0]=3 3130 B15R1.5815 COC(=O)CCC(N)c1ncccc1F Amb33172599 [0,2,0,0,0,0|1,0,0]=3 3131 B15R1.5815 COC(=O)CCC(N)c1nccnc1C Amb33142501 [0,2,0,0,0,0|2,0,0]=4 3132 B15R1.5815 COC(=O)CNC(=O)c1ccccc1C Amb6347536 [0,2,0,0,0,0|1,0,1]=4 3133 B15R1.339 N[C@@H](Cc1ccccc1)CS(=O)(=O)O[Na] Amb35825296 [0,2,0,0,0,0|2,0,0]=4 3134 B15R1.348 CNS(=O)(=O)C(C)CCc1ccccc1 Amb32691865 [0,2,0,0,0,0|2,0,0]=4 3135 B15R1.9539 NCCS(=O)(=O)CCCc1ccccc1 Amb17500565 [0,2,0,0,0,0|2,0,0]=4 3136 B15R1.157 C#CCCC(=O)CNCc1ccccc1 Amb33131580 [0,2,0,0,0,0|2,0,0]=4 3137 B15R1.157 C=CCCC(=O)CNCc1ccccc1 Amb33131582 [0,2,0,0,0,0|2,0,0]=4 3138 B15R1.157 C=CCOC(=O)CNCc1ccccc1 Amb28208298 [0,2,0,0,0,0|1,0,0]=3 3139 B15R1.157 CC#CCC(=O)CNCc1ccccc1 Amb33131581 [0,2,0,0,0,0|2,0,0]=4 3140 B15R1.157 CCCCC(=O)CNCc1ccccc1 Amb33131583 [0,2,0,0,0,0|2,0,0]=4 3141 B15R1.157 CCCOC(=O)CNCc1ccccc1 Amb28422434 [0,2,0,0,0,0|1,0,0]=3 3142 B15R1.157 CCOCC(=O)CCCc1ccccc1 Amb33129307 [0,2,0,0,0,0|0,0,0]=2 3143 B15R1.157 CCOCC(=O)CNCc1ccccc1 Amb33131586 [0,2,0,0,0,0|1,0,0]=3 3144 B15R1.157 CCOCC(N)CCCc1ccccc1 Amb33129327 [0,2,0,0,0,0|1,0,1]=4 3145 B15R1.157 CCOCC(O)CCCc1ccccc1 Amb33129297 [0,2,0,0,0,0|0,0,2]=4 3146 B15R1.157 CCONC(=O)CNCc1ccccc1 Amb27396626 [0,2,0,0,0,0|1,0,0]=3 3147 B15R1.157 CCSCC(=O)CCCc1ccccc1 Amb32703973 [0,2,0,0,0,0|0,1,0]=3 3148 B15R1.157 CNCCC(=O)NCCc1ccccc1 Amb24115262 [0,2,0,0,0,0|2,0,0]=4 3149 B15R1.157 NCCNC(=O)CCCc1ccccc1 Amb33552638 [0,2,0,0,0,0|1,0,0]=3 3150 B15R1.157 NCCNC(=O)CCCc1ccccc1 Amb7773547 [0,2,0,0,0,0|1,0,0]=3 3151 B15R1.157 NCCNC(=O)COCc1ccccc1 Amb27400889 [0,2,0,0,0,0|2,0,0]=4 3152 B15R1.157 O=C(CCCCl)NCCc1ccccc1 Amb6531289 [0,2,0,0,0,0|2,0,0]=4 3153 B15R1.157 [N-]=[N+]=NCC(=O)CCCc1ccccc1 Amb33129309 [0,2,0,0,0,0|2,0,0]=4 3154 B15R1.633 CCCC(=O)CSCc1cccc(C)c1 Amb32683083 [0,2,0,0,0,0|2,0,0]=4 3155 B15R1.633 CCOC(=N)CCNc1cccc(C)c1 Amb24103640 [0,2,0,0,0,0|2,0,0]=4 3156 B15R1.633 CCOC(=O)CCCc1cccc(O)c1 Amb15692061 [0,2,0,0,0,0|0,0,0]=2 3157 B15R1.633 CCOC(=O)CCNc1cc(N)ccn1 Amb32419284 [0,2,0,0,0,0|2,0,0]=4 3158 B15R1.633 CCOC(=O)CCNc1cccc(Br)c1 Amb9026326 [0,2,0,0,0,0|1,0,0]=3 3159 B15R1.633 CCOC(=O)CCNc1cccc(Cl)n1 Amb32421646 [0,2,0,0,0,0|2,0,0]=4 3160 B15R1.633 CCOC(=O)CCNc1cccc(O)c1 Amb18607736 [0,2,0,0,0,0|1,0,0]=3 3161 B15R1.633 CCOC(=O)CCOc1cc(Cl)ccn1 Amb22301621 [0,2,0,0,0,0|2,0,0]=4 3162 B15R1.633 CCOC(=O)CCSc1cc(Cl)ccn1 Amb22301624 [0,2,0,0,0,0|2,0,0]=4 3163 B15R1.633 CCOC(=O)CCSc1cccc(N)c1 Amb33803034 [0,2,0,0,0,0|1,0,0]=3 3164 B15R1.633 CCOC(=O)CCSc1cncc(Br)c1 Amb33276015 [0,2,0,0,0,0|2,0,0]=4 3165 B15R1.633 CCOC(=O)CCSc1cncc(C)c1 Amb33276316 [0,2,0,0,0,0|2,0,0]=4 3166 B15R1.633 CCOC(=O)CNCc1cccc(C)c1 Amb17305756 [0,2,0,0,0,0|1,0,0]=3 3167 B15R1.633 CCOC(=O)CNCc1cccc(Cl)c1 Amb17305757 [0,2,0,0,0,0|1,0,0]=3 3168 B15R1.633 CNCC(=O)CCOc1cccc(F)c1 Amb33417027 [0,2,0,0,0,0|2,0,0]=4 3169 B15R1.633 COCC(=O)CSCc1cccc(C)c1 Amb32683208 [0,2,0,0,0,0|1,0,0]=3 3170 B15R1.633 Cc1cccc(CCNC(=O)CCBr)c1 Amb17333179 [0,2,0,0,0,0|2,0,0]=4 3171 B15R1.633 Cc1cccc(CCNC(=O)CCN)c1 Amb17403319 [0,2,0,0,0,0|2,0,0]=4 3172 B15R1.633 NCCC(=O)CCOc1cccc(F)c1 Amb33417772 [0,2,0,0,0,0|2,0,0]=4 3173 B15R1.633 NCCC(=O)NCCc1cccc(Cl)c1 Amb5785117 [0,2,0,0,0,0|2,0,0]=4 3174 B15R1.633 NCCC(=O)NCCc1cccc(F)c1 Amb9429162 [0,2,0,0,0,0|2,0,0]=4 3175 B15R1.809 CC(Cc1ccccc1)NC(=O)CCBr Amb17327276 [0,2,0,0,0,0|2,0,0]=4 3176 B15R1.809 CCCC(=O)CN(C)Cc1ccccc1 Amb27808164 [0,2,0,0,0,0|2,0,0]=4 3177 B15R1.809 CCOC(=O)CC(=N)Oc1ccccc1 Amb20247941 [0,2,0,0,0,0|1,0,1]=4 3178 B15R1.809 CCOC(=O)CC(=O)Cc1ccccc1 Amb33539362 [0,2,0,0,0,0|0,0,1]=3 3179 B15R1.809 CCOC(=O)CC(=O)Nc1ccccc1 Amb2051237 [0,2,0,0,0,0|1,0,1]=4 3180 B15R1.809 CCOC(=O)CC(Br)Cc1ccccc1 Amb18111253 [0,2,0,0,0,0|0,0,0]=2 3181 B15R1.809 CCOC(=O)CC(Cl)Cc1ccccc1 Amb18111252 [0,2,0,0,0,0|0,0,0]=2 3182 B15R1.809 CCOC(=O)CC(N)Cc1ccccc1 Amb18110985 [0,2,0,0,0,0|0,0,0]=2 3183 B15R1.809 CCOC(=O)CN(C)Cc1ccccn1 Amb9428012 [0,2,0,0,0,0|2,0,0]=4 3184 B15R1.809 CCOC(=O)C[C@@H](N)Cc1ccccc1 Amb33039571 [0,2,0,0,0,0|0,0,0]=2 3185 B15R1.809 CCOC(=O)C[C@H](N)Cc1ccccc1 Amb33804747 [0,2,0,0,0,0|0,0,0]=2 3186 B15R1.826 CCNC(=O)C(C)NCc1ccccc1 Amb7756826 [0,2,0,0,0,0|2,0,0]=4 3187 B15R1.826 CCOC(=O)C(=O)CCc1ccccc1 Amb1233213 [0,2,0,0,0,0|0,0,1]=3 3188 B15R1.826 CCOC(=O)C(=O)CCc1cccnc1 Amb24066472 [0,2,0,0,0,0|1,0,1]=4 3189 B15R1.826 CCOC(=O)C(=O)NCc1ccccc1 Amb2221403 [0,2,0,0,0,0|1,0,1]=4 3190 B15R1.826 CCOC(=O)C(C)NCc1ccccc1 Amb2724169 [0,2,0,0,0,0|1,0,0]=3 3191 B15R1.826 CCOC(=O)C(C)\N=C\c1ccccc1 Amb17609055 [0,2,0,0,0,0|1,0,1]=4 3192 B15R1.826 CCOC(=O)C(Cl)CCc1ccccc1 Amb20621212 [0,2,0,0,0,0|0,0,0]=2 3193 B15R1.826 CCOC(=O)C(F)OCc1ccccc1 Amb27242341 [0,2,0,0,0,0|1,0,0]=3 3194 B15R1.826 CCOC(=O)C(N)CCc1ccccc1 Amb3941426 [0,2,0,0,0,0|0,0,0]=2 3195 B15R1.826 CCOC(=O)C(N)CCc1ccccn1 Amb33803676 [0,2,0,0,0,0|1,0,0]=3 3196 B15R1.826 CCOC(=O)C(N)CCc1ccncc1 Amb33038471 [0,2,0,0,0,0|1,0,0]=3 3197 B15R1.826 CCOC(=O)C(N)CCc1cnccn1 Amb33330524 [0,2,0,0,0,0|2,0,0]=4 3198 B15R1.826 CCOC(=O)C(N)CCc1cnccn1 Amb33330854 [0,2,0,0,0,0|2,0,0]=4 3199 B15R1.826 CCOC(=O)C(O)CCc1ccccc1 Amb20621230 [0,2,0,0,0,0|0,0,0]=2 3200 B15R1.826 CCOC(=O)[C@@H](C)NCc1ccccc1 Amb27767100 [0,2,0,0,0,0|1,0,0]=3 3201 B15R1.826 CCOC(=O)[C@@H](C)OCc1ccccc1 Amb19132242 [0,2,0,0,0,0|1,0,0]=3 3202 B15R1.826 CCOC(=O)[C@@H](N)CCc1ccccc1 Amb2612895 [0,2,0,0,0,0|0,0,0]=2 3203 B15R1.826 CCOC(=O)[C@@H](N)CCc1ccccc1 Amb8393713 [0,2,0,0,0,0|0,0,0]=2 3204 B15R1.826 CCOC(=O)[C@@H](O)CCc1ccccc1 Amb8628957 [0,2,0,0,0,0|0,0,0]=2 3205 B15R1.826 CCOC(=O)[C@H](C)NCc1ccccc1 Amb25131194 [0,2,0,0,0,0|1,0,0]=3 3206 B15R1.826 CCOC(=O)[C@H](N)CCc1ccccc1 Amb15690587 [0,2,0,0,0,0|0,0,0]=2 3207 B15R1.826 CCOC(=O)[C@H](N)CCc1ccccc1 Amb33299912 [0,2,0,0,0,0|0,0,0]=2 3208 B15R1.826 CCOC(=O)[C@H](O)CCc1ccccc1 Amb3939673 [0,2,0,0,0,0|0,0,0]=2 3209 B15R1.826 CN(CCc1ccccc1)C(=O)CCN Amb17239058 [0,2,0,0,0,0|2,0,0]=4 3210 B15R1.826 COCC(=O)N(C)CCc1ccncc1 Amb16900818 [0,2,0,0,0,0|2,0,0]=4 3211 B15R1.1252 CCCC(=O)CSCc1ccccc1C Amb32683085 [0,2,0,0,0,0|2,0,0]=4 3212 B15R1.1252 CCCC(=O)CSCc1ccccc1Cl Amb32683076 [0,2,0,0,0,0|2,0,0]=4 3213 B15R1.1252 CCOC(=N)CCNc1ccccc1C Amb24103639 [0,2,0,0,0,0|2,0,0]=4 3214 B15R1.1252 CCOC(=O)CCCc1ccccc1N Amb33802745 [0,2,0,0,0,0|0,0,0]=2 3215 B15R1.1252 CCOC(=O)CCCc1ccccc1O Amb15692062 [0,2,0,0,0,0|0,0,0]=2 3216 B15R1.1252 CCOC(=O)CCNc1ccccc1Br Amb9026324 [0,2,0,0,0,0|1,0,0]=3 3217 B15R1.1252 CCOC(=O)CCNc1ccccc1N Amb32418445 [0,2,0,0,0,0|1,0,0]=3 3218 B15R1.1252 CCOC(=O)CCNc1cccnc1Cl Amb18095540 [0,2,0,0,0,0|2,0,0]=4 3219 B15R1.1252 CCOC(=O)CCNc1ccncc1N Amb30621961 [0,2,0,0,0,0|2,0,0]=4 3220 B15R1.1252 CCOC(=O)CCNc1ncccc1N Amb32418467 [0,2,0,0,0,0|2,0,0]=4 3221 B15R1.1252 CCOC(=O)CCSc1ncccc1N Amb33802369 [0,2,0,0,0,0|2,0,0]=4 3222 B15R1.1252 CCOC(=O)CNCc1ccccc1O Amb32663765 [0,2,0,0,0,0|1,0,0]=3 3223 B15R1.1252 COCC(=O)CSCc1ccccc1C Amb32683209 [0,2,0,0,0,0|1,0,0]=3 3224 B15R1.1252 COCC(=O)CSCc1ccccc1Cl Amb32683183 [0,2,0,0,0,0|1,0,0]=3 3225 B15R1.1252 Cc1ccccc1CCNC(=O)CCN Amb17403316 [0,2,0,0,0,0|2,0,0]=4 3226 B15R1.1252 NCCC(=O)NCCc1ccccc1Cl Amb17406913 [0,2,0,0,0,0|2,0,0]=4 3227 B15R1.1252 NCCC(=O)NCCc1ccccc1F Amb5784994 [0,2,0,0,0,0|2,0,0]=4 3228 B15R1.1252 O=C(CCCl)NCCc1ccccc1F Amb6246372 [0,2,0,0,0,0|2,0,0]=4 3229 B15R1.1306 CNC(CCCc1ccccc1)COC Amb33129317 [0,2,0,0,0,0|1,0,1]=4 3230 B15R1.9084 C=C(C)CC(=O)CNCc1ccccc1 Amb33307510 [0,2,0,0,0,0|2,0,0]=4 3231 B15R1.9084 C=C(C)CC(=O)COCc1ccccc1 Amb27965237 [0,2,0,0,0,0|2,0,0]=4 3232 B15R1.9084 CC(=O)CC(=O)NCCc1ccccc1 Amb1871453 [0,2,0,0,0,0|2,0,0]=4 3233 B15R1.9084 CC(C)=CC(=O)COCc1ccccc1 Amb28384290 [0,2,0,0,0,0|2,0,0]=4 3234 B15R1.9084 CC(C)CC(=O)CNCc1ccccc1 Amb33131584 [0,2,0,0,0,0|2,0,0]=4 3235 B15R1.9084 CC(C)CC(=O)COCc1ccccc1 Amb27862700 [0,2,0,0,0,0|2,0,0]=4 3236 B15R1.9084 CC(C)OC(=O)CNCc1ccccc1 Amb27877790 [0,2,0,0,0,0|1,0,0]=3 3237 B15R1.9084 CC(C)OC(=O)NOCc1ccccc1 Amb28380915 [0,2,0,0,0,0|2,0,0]=4 3238 B15R1.9084 CN(C)CC(=O)CCCc1ccccc1 Amb33129310 [0,2,0,0,0,0|1,0,0]=3 3239 B15R1.9084 CN(C)CC(=O)NCCc1ccccc1 Amb17827032 [0,2,0,0,0,0|2,0,0]=4 3240 B15R1.9084 CS(=O)CC(=O)CCCc1ccccc1 Amb33129311 [0,2,0,0,0,0|0,1,0]=3 3241 B15R1.488 COC(OC)C(Cl)CCc1ccccc1 Amb32680287 [0,2,0,0,0,0|0,0,2]=4 3242 B15R1.762 COC(=O)CC(=O)Nc1ccccc1Br Amb17420066 [0,2,0,0,0,0|1,0,1]=4 3243 B15R1.762 COC(=O)CC(=O)Nc1ccccc1C Amb17403407 [0,2,0,0,0,0|1,0,1]=4 3244 B15R1.762 COC(=O)CC(=O)Nc1ccccc1Cl Amb6811742 [0,2,0,0,0,0|1,0,1]=4 3245 B15R1.762 COC(=O)CC(=O)Nc1ccccc1F Amb6811818 [0,2,0,0,0,0|1,0,1]=4 3246 B15R1.966 CCC(=O)CN(CC)Cc1ccccc1 Amb27971520 [0,2,0,0,0,0|2,0,0]=4 3247 B15R1.966 CC\C(=C\C(=O)OC)Cc1ccccc1 Amb33472144 [0,2,0,0,0,0|0,0,2]=4 3248 B15R1.966 CNC(CC(=O)OC)Cc1ccccc1 Amb18629741 [0,2,0,0,0,0|0,0,0]=2 3249 B15R1.973 COC(=O)C(C)C(=O)Cc1ccccc1 Amb20668885 [0,2,0,0,0,0|0,0,1]=3 3250 B15R1.973 COC(=O)C(C)N(C)Cc1ccccc1 Amb19340558 [0,2,0,0,0,0|1,0,0]=3 3251 B15R1.973 COC(=O)C(N)C(C)Oc1cccnc1 Amb22643010 [0,2,0,0,0,0|2,0,0]=4 3252 B15R1.973 COC(=O)C(N)C(C)Sc1ccccc1 Amb22642992 [0,2,0,0,0,0|1,0,0]=3 3253 B15R1.973 COC(=O)C(N)C(C)Sc1ccccn1 Amb22642999 [0,2,0,0,0,0|2,0,0]=4 3254 B15R1.973 COC(=O)C(N)C(O)Cc1ccccc1 Amb33802739 [0,2,0,0,0,0|0,0,0]=2 3255 B15R1.973 COC(=O)C(N)\C(C)=C\c1ccccc1 Amb33476153 [0,2,0,0,0,0|0,0,2]=4 3256 B15R1.973 COC(=O)C(O)\C(C)=C\c1ccccc1 Amb33476762 [0,2,0,0,0,0|0,0,2]=4 3257 B15R1.973 COC(=O)[C@@H](C)N(C)Cc1ccccc1 Amb16182995 [0,2,0,0,0,0|1,0,0]=3 3258 B15R1.973 COC(=O)[C@H](C)N(C)Cc1ccccc1 Amb16182999 [0,2,0,0,0,0|1,0,0]=3 3259 B15R1.982 COC(=O)CC(=O)Cc1cccc(F)c1 Amb28990236 [0,2,0,0,0,0|0,0,1]=3 3260 B15R1.982 COC(=O)CC(=O)Nc1cccc(Br)c1 Amb17420067 [0,2,0,0,0,0|1,0,1]=4 3261 B15R1.982 COC(=O)CC(=O)Nc1cccc(C)c1 Amb6811737 [0,2,0,0,0,0|1,0,1]=4 3262 B15R1.982 COC(=O)CC(=O)Nc1cccc(Cl)c1 Amb6811730 [0,2,0,0,0,0|1,0,1]=4 3263 B15R1.982 COC(=O)CC(=O)Nc1cccc(F)c1 Amb17404067 [0,2,0,0,0,0|1,0,1]=4 3264 B15R1.1002 CCC(=O)C(C)SCc1cccc(C)c1 Amb32683017 [0,2,0,0,0,0|2,0,0]=4 3265 B15R1.1002 COC(=O)C(C)CNc1cc(C)ccn1 Amb18095603 [0,2,0,0,0,0|2,0,0]=4 3266 B15R1.1002 COC(=O)C(C)CNc1cccc(Br)c1 Amb9400483 [0,2,0,0,0,0|1,0,0]=3 3267 B15R1.1002 COC(=O)C(C)CNc1cccc(O)c1 Amb18607737 [0,2,0,0,0,0|1,0,0]=3 3268 B15R1.1002 COC(=O)C(C)NCc1cccc(F)c1 Amb33737613 [0,2,0,0,0,0|1,0,0]=3 3269 B15R1.1002 COC(=O)C(N)CCc1cccc(Br)c1 Amb33006647 [0,2,0,0,0,0|0,0,0]=2 3270 B15R1.1002 COC(=O)C(N)COc1cccc(Cl)c1 Amb22642973 [0,2,0,0,0,0|1,0,0]=3 3271 B15R1.1002 COC(=O)C(N)COc1cccc(F)c1 Amb22642642 [0,2,0,0,0,0|1,0,0]=3 3272 B15R1.1002 COC(=O)C(N)COc1cccc(F)c1 Amb32662449 [0,2,0,0,0,0|1,0,0]=3 3273 B15R1.1002 COC(=O)C(O)CCc1cccc(Br)c1 Amb33006670 [0,2,0,0,0,0|0,0,0]=2 3274 B15R1.1323 CCC(=O)C(C)SCc1ccccc1C Amb32683005 [0,2,0,0,0,0|2,0,0]=4 3275 B15R1.1323 CCC(=O)C(C)SCc1ccccc1Cl Amb32682943 [0,2,0,0,0,0|2,0,0]=4 3276 B15R1.1323 COC(=O)C(C)CNc1ccccc1Br Amb9400479 [0,2,0,0,0,0|1,0,0]=3 3277 B15R1.1323 COC(=O)C(C)CNc1cccnc1Cl Amb18095605 [0,2,0,0,0,0|2,0,0]=4 3278 B15R1.1323 COC(=O)C(C)CNc1ncccc1C Amb18095608 [0,2,0,0,0,0|2,0,0]=4 3279 B15R1.1323 COC(=O)C(C)NCc1ccccc1Cl Amb33747612 [0,2,0,0,0,0|1,0,0]=3 3280 B15R1.1323 COC(=O)C(N)COc1ccccc1Cl Amb22642974 [0,2,0,0,0,0|1,0,0]=3 3281 B15R1.1323 COC(=O)C(N)COc1ccccc1F Amb22642640 [0,2,0,0,0,0|1,0,0]=3 3282 B15R1.1323 COC(=O)C(N)COc1ccccc1F Amb32662447 [0,2,0,0,0,0|1,0,0]=3 3283 B15R1.1370 CNC(=O)C(CO)NCc1ccccc1 Amb28190010 [0,2,0,0,0,0|2,0,0]=4 3284 B15R1.1370 COC(=O)C(CN)NCc1ccccc1 Amb28199388 [0,2,0,0,0,0|1,0,0]=3 3285 B15R1.1370 COC(=O)C(CO)NCc1ccccc1 Amb19958334 [0,2,0,0,0,0|1,0,0]=3 3286 B15R1.1370 COC(=O)[C@@H](CO)NCc1ccccc1 Amb17739824 [0,2,0,0,0,0|1,0,0]=3 3287 B15R1.1370 COC(=O)[C@H](CO)NCc1ccccc1 Amb17609325 [0,2,0,0,0,0|1,0,0]=3 3288 B15R1.1420 COC(=O)C(C)(C)NCc1ccccc1 Amb28750957 [0,2,0,0,0,0|1,0,0]=3 3289 B15R1.1420 COC(=O)C(C)(C)NCc1ccccc1 Amb9591862 [0,2,0,0,0,0|1,0,0]=3 3290 B15R1.1420 COC(=O)C(C)(N)CCc1ccccc1 Amb33746358 [0,2,0,0,0,0|0,0,0]=2 3291 B15R1.1420 COC(=O)C(C)(N)COc1ccccc1 Amb19350979 [0,2,0,0,0,0|1,0,0]=3 3292 B15R1.1420 COC(=O)C(C)(N)COc1ccccc1 Amb22059041 [0,2,0,0,0,0|1,0,0]=3 3293 B15R1.3678 CC(C)C(=O)C(C)NCc1ccccc1 Amb27831995 [0,2,0,0,0,0|2,0,0]=4 3294 B15R1.3678 CC(N)C(=O)N(C)CCc1ccccc1 Amb17403315 [0,2,0,0,0,0|2,0,0]=4 3295 B15R1.85 COC(=O)CCCc1ccccc1OC Amb18895907 [0,2,0,0,0,0|0,0,0]=2 3296 B15R1.85 COC(=O)CCSc1ncccc1C#N Amb9259518 [0,2,0,0,0,0|2,0,0]=4 3297 B15R1.257 CC(C)C(=O)CSCc1ccccc1Cl Amb32682917 [0,2,0,0,0,0|2,0,0]=4 3298 B15R1.257 CC(Cl)C(=O)NCCc1ccccc1F Amb6247665 [0,2,0,0,0,0|2,0,0]=4 3299 B15R1.257 CC(N)C(=O)NCCc1ccccc1Cl Amb17406914 [0,2,0,0,0,0|2,0,0]=4 3300 B15R1.257 CN(C)C(=O)CCOc1ccccc1Br Amb17276065 [0,2,0,0,0,0|2,0,0]=4 3301 B15R1.257 CN(C)C(=O)CCOc1ccccc1N Amb17239837 [0,2,0,0,0,0|2,0,0]=4 3302 B15R1.257 CN(C)C(=O)CNCc1ccccc1Br Amb8938581 [0,2,0,0,0,0|2,0,0]=4 3303 B15R1.257 CN(C)C(=O)CNCc1ccccc1Cl Amb6709995 [0,2,0,0,0,0|2,0,0]=4 3304 B15R1.257 CN(C)C(=O)CNCc1ccccc1F Amb6712727 [0,2,0,0,0,0|2,0,0]=4 3305 B15R1.257 CN(C)C(=O)CNCc1ccccc1O Amb8943410 [0,2,0,0,0,0|2,0,0]=4 3306 B15R1.257 C[C@@H](N)C(=O)NCCc1ccccc1F Amb18014659 [0,2,0,0,0,0|2,0,0]=4 3307 B15R1.257 Cc1ccccc1CCNC(=O)C(C)Cl Amb13951110 [0,2,0,0,0,0|2,0,0]=4 3308 B15R1.257 Cc1ccccc1CCNC(=O)C(C)N Amb17403317 [0,2,0,0,0,0|2,0,0]=4 3309 B15R1.257 Cc1ccccc1CNCC(=O)N(C)C Amb8938564 [0,2,0,0,0,0|2,0,0]=4 3310 B15R1.257 Cc1ccccc1CSCC(=O)C(C)C Amb32682931 [0,2,0,0,0,0|2,0,0]=4 3311 B15R1.1368 CNC(=O)CCCN1C=CC=C(N)C1=O Amb32699656 [0,2,0,0,0,0|2,0,0]=4 3312 B15R1.1368 COC(=O)C#CCc1cccc(F)c1F Amb27800602 [0,2,0,0,0,0|0,0,2]=4 3313 B15R1.1368 COC(=O)CCCN1C=CC=C(N)C1=O Amb32701742 [0,2,0,0,0,0|1,0,0]=3 3314 B15R1.1368 COC(=O)CCOc1cccc(F)c1F Amb33624912 [0,2,0,0,0,0|1,0,0]=3 3315 B15R1.3175 CNC(=O)CCCN1C=C(N)C=CC1=O Amb32699663 [0,2,0,0,0,0|2,0,0]=4 3316 B15R1.3175 COC(=O)C#CCc1cc(C)ccc1C Amb28076601 [0,2,0,0,0,0|0,0,2]=4 3317 B15R1.3175 COC(=O)CCCc1cc(C)ccc1C Amb18110215 [0,2,0,0,0,0|0,0,0]=2 3318 B15R1.3175 COC(=O)CCCc1cc(Cl)ccc1O Amb18628198 [0,2,0,0,0,0|0,0,0]=2 3319 B15R1.3175 COC(=O)CCCc1cc(F)ccc1F Amb18110212 [0,2,0,0,0,0|0,0,0]=2 3320 B15R1.3175 COC(=O)CCCn1cc(N)ccc1=O Amb8961159 [0,2,0,0,0,0|1,0,0]=3 3321 B15R1.3175 COC(=O)CCNc1c[n+]([O-])ccc1N Amb33483733 [0,2,0,0,0,0|2,0,0]=4 3322 B15R1.3175 COC(=O)CCOc1cc(Cl)ccc1Cl Amb9203252 [0,2,0,0,0,0|1,0,0]=3 3323 B15R1.3175 COC(=O)CCSc1cc(C)ccc1N Amb33726879 [0,2,0,0,0,0|1,0,0]=3 3324 B15R1.3175 COC(=O)CCSc1cc(Cl)ccc1N Amb32655955 [0,2,0,0,0,0|1,0,0]=3 3325 B15R1.3175 COC(=O)CNCc1cc(Cl)ccc1O Amb6687076 [0,2,0,0,0,0|1,0,0]=3 3326 B15R1.42427 COC(=O)CCOc1c(Br)cccc1Br Amb9206347 [0,2,0,0,0,0|1,0,0]=3 3327 B15R1.42427 COC(=O)CNCc1c(F)cccc1Cl Amb6687114 [0,2,0,0,0,0|1,0,0]=3 3328 B15R1.42427 COC(=O)CNCc1c(F)cncc1F Amb32993257 [0,2,0,0,0,0|2,0,0]=4 3329 B15R1.42427 COC(=O)CSCc1c(Cl)cccc1Cl Amb6854198 [0,2,0,0,0,0|1,0,0]=3 3330 B15R1.121 CC(N)C(=O)CCOc1cccc(F)c1 Amb33417790 [0,2,0,0,0,0|2,0,0]=4 3331 B15R1.121 CC(N)C(=O)NCCc1cccc(Br)c1 Amb17419741 [0,2,0,0,0,0|2,0,0]=4 3332 B15R1.121 CN(C)C(=O)CCCc1cccc(N)c1 Amb17338567 [0,2,0,0,0,0|1,0,0]=3 3333 B15R1.121 CN(C)C(=O)CCOc1cccc(Br)c1 Amb17276067 [0,2,0,0,0,0|2,0,0]=4 3334 B15R1.121 CN(C)C(=O)CCOc1cccc(N)c1 Amb17239839 [0,2,0,0,0,0|2,0,0]=4 3335 B15R1.121 CN(C)C(=O)CNCc1cccc(Br)c1 Amb8938549 [0,2,0,0,0,0|2,0,0]=4 3336 B15R1.121 CN(C)C(=O)CNCc1cccc(F)c1 Amb7756838 [0,2,0,0,0,0|2,0,0]=4 3337 B15R1.121 CN(C)C(=O)CNCc1cccc(O)c1 Amb8938573 [0,2,0,0,0,0|2,0,0]=4 3338 B15R1.121 C[C@@H](N)C(=O)NCCc1cccc(Cl)c1 Amb18527983 [0,2,0,0,0,0|2,0,0]=4 3339 B15R1.121 Cc1cccc(CCNC(=O)C(C)Br)c1 Amb17324301 [0,2,0,0,0,0|2,0,0]=4 3340 B15R1.121 Cc1cccc(CCNC(=O)C(C)N)c1 Amb17403320 [0,2,0,0,0,0|2,0,0]=4 3341 B15R1.121 Cc1cccc(CSCC(=O)C(C)C)c1 Amb32682930 [0,2,0,0,0,0|2,0,0]=4 3342 B15R1.121 O=C(O)C(=O)CCCc1cccc(Br)c1 Amb33006695 [0,2,0,0,0,0|2,0,0]=4 3343 B15R1.931 CCC(=O)CSCc1cc(C)cc(C)c1 Amb32682950 [0,2,0,0,0,0|2,0,0]=4 3344 B15R1.931 CCC(=O)NCCc1cc(O)cc(F)c1 Amb32993451 [0,2,0,0,0,0|2,0,0]=4 3345 B15R1.931 COC(=O)CCNc1cc(C)cc(C)c1 Amb9026336 [0,2,0,0,0,0|1,0,0]=3 3346 B15R1.1569 COC(=O)CCCc1cccc(CO)c1 Amb16233193 [0,2,0,0,0,0|0,0,0]=2 3347 B15R1.1569 COC(=O)CCNc1cccc(OC)c1 Amb9026349 [0,2,0,0,0,0|1,0,0]=3 3348 B15R1.9095 CC(C)(C)C(=O)CNCc1ccccc1 Amb27206617 [0,2,0,0,0,0|2,0,0]=4 3349 B15R1.9095 CC(C)(C)C(=O)CSCc1ccccc1 Amb9215942 [0,2,0,0,0,0|2,0,0]=4 3350 B15R1.9095 CC(C)(C)C(=O)NCCc1ccccc1 Amb6360909 [0,2,0,0,0,0|2,0,0]=4 3351 B15R1.9095 CC(C)(N)C(=O)NCCc1ccccc1 Amb17078311 [0,2,0,0,0,0|2,0,0]=4 3352 B13R2.1 CCNC1CCc2ccccc21 Amb10610131 [1,0,0,1,0,0|2,0,0]=4 3353 B13R2.1 CCNC1CCc2ccccc21 Amb9722140 [1,0,0,1,0,0|2,0,0]=4 3354 B13R2.1 CCSC1CCc2ccccc21 Amb27220071 [1,0,0,1,0,0|2,0,0]=4 3355 B13R2.1 CNCC1CCc2ccccc21 Amb17470428 [1,0,0,1,0,0|1,0,1]=4 3356 B13R2.1 COCC1CSc2ccccc21 Amb27410794 [1,0,0,1,0,0|1,0,1]=4 3357 B13R2.1 COCC1NCc2ccccc21 Amb27457641 [1,0,0,1,0,0|1,0,1]=4 3358 B13R2.1 CONC1CCc2ccccc21 Amb27470590 [1,0,0,1,0,0|1,0,0]=3 3359 B13R2.1 CONC1COc2ccccc21 Amb27868132 [1,0,0,1,0,0|2,0,0]=4 3360 B13R2.1 CO\N=C1\CCc2ccccc21 Amb22752143 [1,0,0,1,0,0|1,0,1]=4 3361 B13R2.1 NOCC1CCc2ccccc21 Amb33145741 [1,0,0,1,0,0|1,0,1]=4 3362 B13R2.3 C1=COC(c2ccccc2)CC1 Amb26038784 [1,0,0,1,0,0|2,0,0]=4 3363 B13R2.3 C1=NCC(c2ccccc2)CN1 Amb22536298 [1,0,0,1,0,0|2,0,0]=4 3364 B13R2.3 c1cc(C2CCCOC2)ccn1 Amb24320761 [1,0,0,1,0,0|1,0,1]=4 3365 B13R2.3 c1ccc(C2CCCCC2)cc1 Amb6357376 [1,0,0,1,0,0|1,0,1]=4 3366 B13R2.3 c1ccc(C2CCCNC2)cc1 Amb1995213 [1,0,0,1,0,0|1,0,1]=4 3367 B13R2.3 c1ccc(C2CCCNC2)cc1 Amb2236473 [1,0,0,1,0,0|1,0,1]=4 3368 B13R2.3 c1ccc(C2CCNCC2)cc1 Amb1019521 [1,0,0,1,0,0|2,0,0]=4 3369 B13R2.3 c1ccc(C2CCNCC2)cc1 Amb2099643 [1,0,0,1,0,0|2,0,0]=4 3370 B13R2.3 c1ccc(C2CCOCC2)cc1 Amb21856446 [1,0,0,1,0,0|2,0,0]=4 3371 B13R2.3 c1ccc(C2COCCN2)cc1 Amb10068848 [1,0,0,1,0,0|1,0,1]=4 3372 B13R2.3 c1ccc(C2COCCN2)cc1 Amb18528726 [1,0,0,1,0,0|1,0,1]=4 3373 B13R2.3 c1ccc(C2COCCN2)cc1 Amb5750999 [1,0,0,1,0,0|1,0,1]=4 3374 B13R2.3 c1ccc([C@@H]2CCCNC2)cc1 Amb19888364 [1,0,0,1,0,0|1,0,1]=4 3375 B13R2.3 c1ccc([C@@H]2COCCN2)cc1 Amb20242902 [1,0,0,1,0,0|1,0,1]=4 3376 B13R2.3 c1ccc([C@@H]2COCCN2)cc1 Amb22274558 [1,0,0,1,0,0|1,0,1]=4 3377 B13R2.3 c1ccc([C@H]2CCCNC2)cc1 Amb19888168 [1,0,0,1,0,0|1,0,1]=4 3378 B13R2.3 c1ccc([C@H]2CCCNC2)cc1 Amb22755507 [1,0,0,1,0,0|1,0,1]=4 3379 B13R2.3 c1ccc([C@H]2COCCN2)cc1 Amb20242901 [1,0,0,1,0,0|1,0,1]=4 3380 B13R2.3 c1ccc([C@H]2COCCN2)cc1 Amb24077482 [1,0,0,1,0,0|1,0,1]=4 3381 B13R2.3 c1cncc(C2CCCOC2)c1 Amb24320762 [1,0,0,1,0,0|1,0,1]=4 3382 B13R2.15 CC1CCCC1c2ccccc2 Amb28060308 [1,0,0,1,0,0|1,0,1]=4 3383 B13R2.15 CC1NCCC1c2ccccc2 Amb18279882 [1,0,0,1,0,0|2,0,0]=4 3384 B13R2.15 CN1CCC[C@@H]1c2ccccc2 Amb25817229 [1,0,0,1,0,0|1,0,1]=4 3385 B13R2.15 CN1CCC[C@H]1c2ccccc2 Amb27603452 [1,0,0,1,0,0|1,0,1]=4 3386 B13R2.15 C[C@@H]1NCCC1c2ccccc2 Amb27616689 [1,0,0,1,0,0|2,0,0]=4 3387 B13R2.15 C[C@@H]1NCC[C@H]1c2ccccc2 Amb27420012 [1,0,0,1,0,0|2,0,0]=4 3388 B13R2.25 CCNC1CC1c2ccccc2 Amb18983170 [1,0,0,1,0,0|2,0,0]=4 3389 B13R2.25 CCN[C@@H]1C[C@H]1c2ccccc2 Amb27814227 [1,0,0,1,0,0|2,0,0]=4 3390 B13R2.25 CCN[C@H]1C[C@@H]1c2ccccc2 Amb28457419 [1,0,0,1,0,0|2,0,0]=4 3391 B13R2.25 CNCC1CC1c2ccccc2 Amb17568106 [1,0,0,1,0,0|1,0,1]=4 3392 B13R2.25 CNC[C@@H]1C[C@@H]1c2ccccc2 Amb27434473 [1,0,0,1,0,0|1,0,1]=4 3393 B13R2.25 CNC[C@@H]1C[C@H]1c2ccccc2 Amb29837831 [1,0,0,1,0,0|1,0,1]=4 3394 B13R2.25 CONC1CC1c2ccccc2 Amb28126379 [1,0,0,1,0,0|1,0,0]=3 3395 B13R2.25 CSC[C@@H]1C[C@H]1c2ccccc2 Amb28183079 [1,0,0,1,0,0|0,1,1]=4 3396 B13R2.25 N\N=C\[C@@H]1C[C@H]1c2ccccc2 Amb27256220 [1,0,0,1,0,0|2,0,0]=4 3397 B13R2.25 O\N=C\C1CC1c2ccccc2 Amb30666642 [1,0,0,1,0,0|2,0,0]=4 3398 B13R2.56 CNC1CCC1c2ccccc2 Amb27858960 [1,0,0,1,0,0|1,0,1]=4 3399 B13R2.64 C1=CCC(Cc2ccccc2)C1 Amb29888235 [1,0,0,1,0,0|1,0,0]=3 3400 B13R2.64 C1=CCC(Cc2cccnc2)C1 Amb29888236 [1,0,0,1,0,0|2,0,0]=4 3401 B13R2.64 C1=CCN(Cc2ccccc2)C1 Amb9820128 [1,0,0,1,0,0|2,0,0]=4 3402 B13R2.64 C1=N[C@@H](Cc2ccccc2)CN1 Amb27475965 [1,0,0,1,0,0|2,0,0]=4 3403 B13R2.64 C1=N[C@H](Cc2ccccc2)CN1 Amb27834345 [1,0,0,1,0,0|2,0,0]=4 3404 B13R2.64 c1ccc(CC2CCNC2)cc1 Amb24097496 [1,0,0,1,0,0|1,0,1]=4 3405 B13R2.64 c1ccc(CC2CCNC2)cc1 Amb3940960 [1,0,0,1,0,0|1,0,1]=4 3406 B13R2.64 c1ccc(CC2CCOC2)cc1 Amb27770987 [1,0,0,1,0,0|0,0,1]=3 3407 B13R2.64 c1ccc(CC2COCN2)cc1 Amb18563410 [1,0,0,1,0,0|1,0,1]=4 3408 B13R2.64 c1ccc(CN2CCOC2)cc1 Amb22229191 [1,0,0,1,0,0|1,0,1]=4 3409 B13R2.64 c1ccc(C[C@H]2COCN2)cc1 Amb27634861 [1,0,0,1,0,0|1,0,1]=4 3410 B13R2.64 c1ccc(NC2CCOC2)cc1 Amb25310936 [1,0,0,1,0,0|1,0,1]=4 3411 B13R2.64 c1ccc(NC2CCOC2)cc1 Amb32729444 [1,0,0,1,0,0|1,0,1]=4 3412 B13R2.67 c1ccc2c(c1)CCCCCC2 Amb6359536 [1,0,0,1,0,0|1,0,1]=4 3413 B13R2.67 c1ccc2c(c1)CCCCNC2 Amb27616673 [1,0,0,1,0,0|1,0,1]=4 3414 B13R2.67 c1ccc2c(c1)CCCNCC2 Amb28246443 [1,0,0,1,0,0|2,0,0]=4 3415 B13R2.1028 CCCCC1Cc2ccccc21 Amb17758498 [1,0,0,1,0,0|1,0,1]=4 3416 B13R2.1028 CCNCC1Cc2ccccc21 Amb18289168 [1,0,0,1,0,0|2,0,0]=4 3417 B13R2.1613 CCC1=NCCc2ccccc21 Amb25035624 [1,0,0,1,0,0|2,0,0]=4 3418 B13R2.1613 CNC1=NCCc2ccccc21 Amb28240971 [1,0,0,1,0,0|2,0,0]=4 3419 B13R2.1613 CNC1CCCc2ccccc21 Amb6892384 [1,0,0,1,0,0|1,0,1]=4 3420 B13R2.1613 CNC1CCCc2ccccc21 Amb9703046 [1,0,0,1,0,0|1,0,1]=4 3421 B13R2.1613 CN[C@@H]1CCCc2ccccc21 Amb20241467 [1,0,0,1,0,0|1,0,1]=4 3422 B13R2.1613 COC1=CCCc2ccccc21 Amb8392114 [1,0,0,1,0,0|0,0,1]=3 3423 B13R2.1613 COC1=NCCc2ccccc21 Amb24665738 [1,0,0,1,0,0|1,0,0]=3 3424 B13R2.1613 COC1CCCc2ccccc21 Amb2228261 [1,0,0,1,0,0|0,0,1]=3 3425 B13R2.1613 COC1CCNc2ccccc21 Amb18062248 [1,0,0,1,0,0|1,0,1]=4 3426 B13R2.1613 COC1CNCc2ccccc21 Amb32410200 [1,0,0,1,0,0|1,0,1]=4 3427 B13R2.1613 COC1OCCc2ccccc21 Amb22284603 [1,0,0,1,0,0|1,0,1]=4 3428 B13R2.1613 N\N=C1\CCCc2ccccc21 Amb27664746 [1,0,0,1,0,0|2,0,0]=4 3429 B13R2.1613 O\N=C1/CCCc2ccccc21 Amb22727930 [1,0,0,1,0,0|2,0,0]=4 3430 B13R2.1613 O\N=C1\CCCc2ccccc21 Amb6296018 [1,0,0,1,0,0|2,0,0]=4 3431 B13R2.2382 c1ccc(CCCC2CO2)cc1 Amb32952083 [1,0,0,1,0,0|0,0,1]=3 3432 B13R2.2382 c1ccc(COCC2CO2)cc1 Amb1152968 [1,0,0,1,0,0|1,0,1]=4 3433 B13R2.2382 c1ccc(COC[C@@H]2CO2)cc1 Amb8387156 [1,0,0,1,0,0|1,0,1]=4 3434 B13R2.2382 c1ccc(COC[C@H]2CO2)cc1 Amb6357200 [1,0,0,1,0,0|1,0,1]=4 3435 B13R2.2382 c1ccc(OCCC2CO2)cc1 Amb33082993 [1,0,0,1,0,0|1,0,1]=4 3436 B13R2.2382 c1ccc(OCC[C@@H]2CO2)cc1 Amb33080555 [1,0,0,1,0,0|1,0,1]=4 3437 B13R2.2382 c1ccc(OCC[C@H]2CO2)cc1 Amb33481809 [1,0,0,1,0,0|1,0,1]=4 3438 B13R2.2383 c1ccc(CCC2CCN2)cc1 Amb26353890 [1,0,0,1,0,0|2,0,0]=4 3439 B13R2.2383 c1ccc(CCC2CNC2)cc1 Amb25266065 [1,0,0,1,0,0|1,0,1]=4 3440 B13R2.2383 c1ccc(CNC2COC2)cc1 Amb22586474 [1,0,0,1,0,0|1,0,1]=4 3441 B13R2.2383 c1ccc(CNC2COC2)cc1 Amb22899641 [1,0,0,1,0,0|1,0,1]=4 3442 B13R2.2383 c1ccc(COC2COC2)cc1 Amb27616758 [1,0,0,1,0,0|1,0,1]=4 3443 B13R2.2383 c1ccc(CSC2COC2)cc1 Amb27198300 [1,0,0,1,0,0|1,0,1]=4 3444 B13R2.5252 CC1=CCCCc2ccccc21 Amb27986008 [1,0,0,1,0,0|1,0,0]=3 3445 B13R2.5252 CC1=CCCNc2ccccc21 Amb28077152 [1,0,0,1,0,0|2,0,0]=4 3446 B13R2.5252 CC1NCCCc2ccccc21 Amb25685960 [1,0,0,1,0,0|2,0,0]=4 3447 B13R2.5252 CN1CCCCc2ccccc21 Amb6359492 [1,0,0,1,0,0|1,0,1]=4 3448 B13R2.10 BrC1CCC(c2ccccc2)C1 Amb28123862 [1,0,0,1,0,0|1,0,1]=4 3449 B13R2.10 CC1=NC(c2ccccc2)CN1 Amb28071281 [1,0,0,1,0,0|2,0,0]=4 3450 B13R2.10 CC1=NN(c2ccccc2)CC1 Amb2613383 [1,0,0,1,0,0|2,0,0]=4 3451 B13R2.10 CN1CC[C@@H](c2ccccc2)C1 Amb26877498 [1,0,0,1,0,0|2,0,0]=4 3452 B13R2.10 CN1CC[C@H](c2ccccc2)C1 Amb27227886 [1,0,0,1,0,0|2,0,0]=4 3453 B13R2.10 C[C@@H]1CCC(c2ccccc2)N1 Amb30633699 [1,0,0,1,0,0|1,0,1]=4 3454 B13R2.10 C[C@@H]1CC[C@H](c2ccccc2)N1 Amb28135456 [1,0,0,1,0,0|1,0,1]=4 3455 B13R2.10 C[C@H]1CCC(c2ccccc2)N1 Amb33801332 [1,0,0,1,0,0|1,0,1]=4 3456 B13R2.10 C[C@H]1CC[C@H](c2ccccc2)N1 Amb27631396 [1,0,0,1,0,0|1,0,1]=4 3457 B13R2.10 FC1CCC(c2ccccc2)C1 Amb27163345 [1,0,0,1,0,0|1,0,1]=4 3458 B13R2.10 NC1=NCC(c2ccccc2)O1 Amb17608294 [1,0,0,1,0,0|2,0,0]=4 3459 B13R2.10 NC1CCC(c2ccccc2)C1 Amb17400101 [1,0,0,1,0,0|1,0,1]=4 3460 B13R2.10 NC1CCC(c2ccccc2)C1 Amb28555798 [1,0,0,1,0,0|1,0,1]=4 3461 B13R2.10 NN1CCC(c2ccccc2)C1 Amb26605785 [1,0,0,1,0,0|2,0,0]=4 3462 B13R2.10 N[C@@H]1CC[C@H](c2ccccc2)C1 Amb26394038 [1,0,0,1,0,0|1,0,1]=4 3463 B13R2.10 N[C@H]1CC[C@@H](c2ccccc2)C1 Amb27660989 [1,0,0,1,0,0|1,0,1]=4 3464 B13R2.10 N[C@H]1CC[C@@H](c2ccccc2)C1 Amb32663166 [1,0,0,1,0,0|1,0,1]=4 3465 B13R2.10 N[C@H]1CC[C@H](c2ccccc2)C1 Amb27449247 [1,0,0,1,0,0|1,0,1]=4 3466 B13R2.10 O=C1C=C(c2ccccc2)CC1 Amb10669546 [1,0,0,1,0,0|0,0,2]=4 3467 B13R2.10 O=C1C=C[C@H](c2ccccc2)C1 Amb27177992 [1,0,0,1,0,0|0,0,2]=4 3468 B13R2.10 O=C1CC(c2ccccc2)CN1 Amb1772919 [1,0,0,1,0,0|1,0,0]=3 3469 B13R2.10 O=C1CC(c2ccccc2)CO1 Amb28280068 [1,0,0,1,0,0|1,0,0]=3 3470 B13R2.10 O=C1CC(c2ccccc2)NN1 Amb9798684 [1,0,0,1,0,0|2,0,0]=4 3471 B13R2.10 O=C1CC(c2ccccn2)CN1 Amb13952281 [1,0,0,1,0,0|2,0,0]=4 3472 B13R2.10 O=C1CC(c2cccnc2)CN1 Amb13783612 [1,0,0,1,0,0|2,0,0]=4 3473 B13R2.10 O=C1CC(c2ccncc2)CN1 Amb17400108 [1,0,0,1,0,0|2,0,0]=4 3474 B13R2.10 O=C1CCC(c2ccccc2)C1 Amb17138497 [1,0,0,1,0,0|0,0,0]=2 3475 B13R2.10 O=C1CCC(c2ccccc2)N1 Amb17470413 [1,0,0,1,0,0|1,0,0]=3 3476 B13R2.10 O=C1CCC(c2ccccc2)O1 Amb4393092 [1,0,0,1,0,0|0,0,0]=2 3477 B13R2.10 O=C1CCC(c2ccccn2)C1 Amb17138526 [1,0,0,1,0,0|1,0,0]=3 3478 B13R2.10 O=C1CCC(c2cccnc2)C1 Amb17138527 [1,0,0,1,0,0|1,0,0]=3 3479 B13R2.10 O=C1CCC(c2ccncc2)C1 Amb17138528 [1,0,0,1,0,0|1,0,0]=3 3480 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb32410134 [1,0,0,1,0,0|1,0,0]=3 3481 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb33528256 [1,0,0,1,0,0|1,0,0]=3 3482 B13R2.10 O=C1CCN(c2ccccc2)N1 Amb6315525 [1,0,0,1,0,0|2,0,0]=4 3483 B13R2.10 O=C1CCN(c2ccncc2)C1 Amb23449311 [1,0,0,1,0,0|2,0,0]=4 3484 B13R2.10 O=C1CC[C@@H](c2ccccc2)C1 Amb24323281 [1,0,0,1,0,0|0,0,0]=2 3485 B13R2.10 O=C1CC[C@@H](c2ccccc2)N1 Amb27242426 [1,0,0,1,0,0|1,0,0]=3 3486 B13R2.10 O=C1CC[C@@H](c2cccnc2)N1 Amb27389343 [1,0,0,1,0,0|2,0,0]=4 3487 B13R2.10 O=C1CC[C@H](c2ccccc2)C1 Amb24484347 [1,0,0,1,0,0|0,0,0]=2 3488 B13R2.10 O=C1CC[C@H](c2ccccc2)N1 Amb27227911 [1,0,0,1,0,0|1,0,0]=3 3489 B13R2.10 O=C1CC[C@H](c2ccccc2)O1 Amb28437127 [1,0,0,1,0,0|0,0,0]=2 3490 B13R2.10 O=C1CN=C(c2ccccc2)O1 Amb3987291 [1,0,0,1,0,0|1,0,1]=4 3491 B13R2.10 O=C1CNC(c2ccccc2)O1 Amb26032124 [1,0,0,1,0,0|1,0,0]=3 3492 B13R2.10 O=C1COC(c2ccccn2)C1 Amb35718935 [1,0,0,1,0,0|2,0,0]=4 3493 B13R2.10 O=C1COC(c2cccnc2)C1 Amb29866228 [1,0,0,1,0,0|2,0,0]=4 3494 B13R2.10 O=C1COC(c2ccncc2)C1 Amb29866229 [1,0,0,1,0,0|2,0,0]=4 3495 B13R2.10 O=C1CSC(c2ccccc2)N1 Amb2221753 [1,0,0,1,0,0|2,0,0]=4 3496 B13R2.10 O=C1CSC(c2ccccc2)O1 Amb25793869 [1,0,0,1,0,0|1,0,0]=3 3497 B13R2.10 O=C1C[C@@H](c2ccccc2)CN1 Amb25277165 [1,0,0,1,0,0|1,0,0]=3 3498 B13R2.10 O=C1C[C@@H](c2ccccc2)CO1 Amb27451585 [1,0,0,1,0,0|1,0,0]=3 3499 B13R2.10 O=C1C[C@H](c2ccccc2)CN1 Amb23401452 [1,0,0,1,0,0|1,0,0]=3 3500 B13R2.10 O=C1NC(c2ccccc2)CO1 Amb6346517 [1,0,0,1,0,0|2,0,0]=4 3501 B13R2.10 O=C1NC(c2ccccc2)CS1 Amb23439132 [1,0,0,1,0,0|2,0,0]=4 3502 B13R2.10 O=C1NCC(c2ccccc2)N1 Amb22056050 [1,0,0,1,0,0|2,0,0]=4 3503 B13R2.10 O=C1NCC(c2ccccc2)O1 Amb16232576 [1,0,0,1,0,0|1,0,0]=3 3504 B13R2.10 O=C1NCC(c2ccccc2)S1 Amb27614799 [1,0,0,1,0,0|1,1,0]=4 3505 B13R2.10 O=C1NCC(c2ccccn2)O1 Amb18639394 [1,0,0,1,0,0|2,0,0]=4 3506 B13R2.10 O=C1NCC(c2cccnc2)O1 Amb17232462 [1,0,0,1,0,0|2,0,0]=4 3507 B13R2.10 O=C1NCC(c2ccncc2)O1 Amb18639408 [1,0,0,1,0,0|2,0,0]=4 3508 B13R2.10 O=C1NC[C@@H](c2ccccc2)O1 Amb24574681 [1,0,0,1,0,0|1,0,0]=3 3509 B13R2.10 O=C1N[C@@H](c2ccccc2)CO1 Amb6295901 [1,0,0,1,0,0|2,0,0]=4 3510 B13R2.10 O=C1N[C@@H](c2ccccc2)CS1 Amb28143674 [1,0,0,1,0,0|2,0,0]=4 3511 B13R2.10 O=C1N[C@H](c2ccccc2)CO1 Amb6295900 [1,0,0,1,0,0|2,0,0]=4 3512 B13R2.10 O=C1N[C@H](c2ccccc2)CS1 Amb24653499 [1,0,0,1,0,0|2,0,0]=4 3513 B13R2.10 O=C1OCC(c2ccccc2)O1 Amb27790954 [1,0,0,1,0,0|1,0,0]=3 3514 B13R2.10 O=S1CCC(c2ccccc2)C1 Amb27404989 [1,0,0,1,0,0|1,0,0]=3 3515 B13R2.10 OC1=NCC(c2ccccc2)C1 Amb19866679 [1,0,0,1,0,0|1,0,1]=4 3516 B13R2.10 OC1CCC(c2ccccc2)C1 Amb17400115 [1,0,0,1,0,0|0,0,2]=4 3517 B13R2.10 OC1CCC(c2ccccc2)O1 Amb22752551 [1,0,0,1,0,0|0,0,2]=4 3518 B13R2.10 OC1CC[C@@H](c2ccccc2)O1 Amb26320377 [1,0,0,1,0,0|0,0,2]=4 3519 B13R2.10 O[C@@H]1CC[C@@H](c2ccccc2)C1 Amb27218901 [1,0,0,1,0,0|0,0,2]=4 3520 B13R2.10 O[C@@H]1CC[C@H](c2ccccc2)C1 Amb27431425 [1,0,0,1,0,0|0,0,2]=4 3521 B13R2.10 O[C@H]1CC[C@H](c2ccccc2)C1 Amb27420311 [1,0,0,1,0,0|0,0,2]=4 3522 B13R2.10 S=C1NCC(c2ccccc2)O1 Amb27817813 [1,0,0,1,0,0|1,1,0]=4 3523 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb23401475 [1,0,0,1,0,0|1,0,1]=4 3524 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb27237117 [1,0,0,1,0,0|1,0,1]=4 3525 B13R2.31 O=C1CC(Cc2ccccc2)C1 Amb23401474 [1,0,0,1,0,0|0,0,0]=2 3526 B13R2.31 O=C1CC(Cc2ccccc2)N1 Amb27468739 [1,0,0,1,0,0|1,0,0]=3 3527 B13R2.31 O=C1CC(Oc2ccccc2)C1 Amb23439309 [1,0,0,1,0,0|1,0,0]=3 3528 B13R2.31 O=C1CC(Sc2ccccc2)C1 Amb32670640 [1,0,0,1,0,0|1,0,0]=3 3529 B13R2.31 O=C1CC(Sc2ccccc2)N1 Amb27264782 [1,0,0,1,0,0|2,0,0]=4 3530 B13R2.31 O=C1CC([Se]c2ccccc2)N1 Amb2612117 [1,0,0,1,0,0|2,0,0]=4 3531 B13R2.31 O=C1CN(Cc2ccccc2)C1 Amb10602421 [1,0,0,1,0,0|1,0,0]=3 3532 B13R2.31 O=C1C[C@@H](Cc2ccccc2)N1 Amb28243189 [1,0,0,1,0,0|1,0,0]=3 3533 B13R2.31 O=C1C[C@@H](Sc2ccccc2)N1 Amb27647757 [1,0,0,1,0,0|2,0,0]=4 3534 B13R2.31 OC1CC(Cc2ccccc2)C1 Amb23401472 [1,0,0,1,0,0|0,0,2]=4 3535 B13R2.72 CC(=O)C1CCc2ccccc21 Amb24400099 [1,0,0,1,0,0|0,0,0]=2 3536 B13R2.72 CC(=O)C1COc2ccccc21 Amb23586289 [1,0,0,1,0,0|1,0,0]=3 3537 B13R2.72 CC(=O)N1CCc2ccccc21 Amb6357858 [1,0,0,1,0,0|1,0,0]=3 3538 B13R2.72 CC(=O)N1CCc2cccnc21 Amb25873902 [1,0,0,1,0,0|2,0,0]=4 3539 B13R2.72 CC(=O)N1CCc2ccncc21 Amb23412123 [1,0,0,1,0,0|2,0,0]=4 3540 B13R2.72 CC(=O)N1CCc2cnccc21 Amb25847503 [1,0,0,1,0,0|2,0,0]=4 3541 B13R2.72 CC(=O)N1CNc2ccccc21 Amb28366373 [1,0,0,1,0,0|2,0,0]=4 3542 B13R2.72 CC(=O)N1COc2ccccc21 Amb28244203 [1,0,0,1,0,0|2,0,0]=4 3543 B13R2.72 CC(=O)N1CSc2ccccc21 Amb27416836 [1,0,0,1,0,0|2,0,0]=4 3544 B13R2.72 CC(=O)N1OCc2ccccc21 Amb27756375 [1,0,0,1,0,0|2,0,0]=4 3545 B13R2.72 CC(=O)[C@@H]1CCc2ccccc21 Amb25834379 [1,0,0,1,0,0|0,0,0]=2 3546 B13R2.72 CC(N)C1CCc2ccccc21 Amb27810846 [1,0,0,1,0,0|1,0,1]=4 3547 B13R2.72 CS(=O)C1CCc2ccccc21 Amb26912150 [1,0,0,1,0,0|1,0,0]=3 3548 B13R2.72 C[C@@H](N)C1CCc2ccccc21 Amb25259826 [1,0,0,1,0,0|1,0,1]=4 3549 B13R2.72 C[C@@H](O)C1CCc2ccccc21 Amb25077224 [1,0,0,1,0,0|0,0,2]=4 3550 B13R2.72 C[C@H](N)C1CCc2ccccc21 Amb28072910 [1,0,0,1,0,0|1,0,1]=4 3551 B13R2.72 C[C@H](O)C1CCc2ccccc21 Amb25378827 [1,0,0,1,0,0|0,0,2]=4 3552 B13R2.72 N=C(N)C1CCc2ccccc21 Amb24484327 [1,0,0,1,0,0|2,0,0]=4 3553 B13R2.72 NC(=O)C1CCc2ccccc21 Amb4035852 [1,0,0,1,0,0|1,0,0]=3 3554 B13R2.72 NC(=O)C1CCc2cnccc21 Amb5719884 [1,0,0,1,0,0|2,0,0]=4 3555 B13R2.72 NC(=O)C1CNc2ccccc21 Amb19320765 [1,0,0,1,0,0|2,0,0]=4 3556 B13R2.72 NC(=O)C1COc2ccccc21 Amb27404619 [1,0,0,1,0,0|2,0,0]=4 3557 B13R2.72 NC(=O)N1CCc2ccccc21 Amb1124478 [1,0,0,1,0,0|2,0,0]=4 3558 B13R2.72 NC(=O)[C@@H]1CCc2ccccc21 Amb27460722 [1,0,0,1,0,0|1,0,0]=3 3559 B13R2.72 NC(=S)C1CCc2ccccc21 Amb27831962 [1,0,0,1,0,0|1,1,0]=4 3560 B13R2.72 O=C(Cl)C1COc2ccccc21 Amb24436426 [1,0,0,1,0,0|2,0,0]=4 3561 B13R2.72 O=C(Cl)C1NCc2ccccc21 Amb27623703 [1,0,0,1,0,0|2,0,0]=4 3562 B13R2.72 O=C(Cl)N1CCc2ccccc21 Amb20670451 [1,0,0,1,0,0|2,0,0]=4 3563 B13R2.72 O=C(O)C1=CCc2ccccc21 Amb2691224 [1,0,0,1,0,0|0,0,2]=4 3564 B13R2.72 O=C(O)C1C=Cc2ccccc21 Amb17470411 [1,0,0,1,0,0|0,0,2]=4 3565 B13R2.72 O=C(O)C1CCc2ccccc21 Amb18538487 [1,0,0,1,0,0|0,0,0]=2 3566 B13R2.72 O=C(O)C1CCc2cccnc21 Amb22372226 [1,0,0,1,0,0|1,0,0]=3 3567 B13R2.72 O=C(O)C1CCc2cccnc21 Amb32652229 [1,0,0,1,0,0|1,0,0]=3 3568 B13R2.72 O=C(O)C1CCc2ccncc21 Amb28138053 [1,0,0,1,0,0|1,0,0]=3 3569 B13R2.72 O=C(O)C1CCc2ncncc21 Amb18829043 [1,0,0,1,0,0|2,0,0]=4 3570 B13R2.72 O=C(O)C1CNc2ccccc21 Amb22497686 [1,0,0,1,0,0|1,0,0]=3 3571 B13R2.72 O=C(O)C1CNc2ccccc21 Amb2698471 [1,0,0,1,0,0|1,0,0]=3 3572 B13R2.72 O=C(O)C1COc2ccccc21 Amb19372915 [1,0,0,1,0,0|1,0,0]=3 3573 B13R2.72 O=C(O)C1CSc2ccccc21 Amb19335022 [1,0,0,1,0,0|1,0,0]=3 3574 B13R2.72 O=C(O)C1NCc2ccccc21 Amb22491461 [1,0,0,1,0,0|1,0,0]=3 3575 B13R2.72 O=C(O)C1NCc2ccccc21 Amb2699615 [1,0,0,1,0,0|1,0,0]=3 3576 B13R2.72 O=C(O)C1NCc2cnccc21 Amb18829011 [1,0,0,1,0,0|2,0,0]=4 3577 B13R2.72 O=C(O)C1OCc2ccccc21 Amb18829056 [1,0,0,1,0,0|1,0,0]=3 3578 B13R2.72 O=C(O)N1CSc2ccccc21 Amb24061895 [1,0,0,1,0,0|2,0,0]=4 3579 B13R2.72 O=C(O)[C@@H]1CCc2ccccc21 Amb24729539 [1,0,0,1,0,0|0,0,0]=2 3580 B13R2.72 O=C(O)[C@@H]1NCc2ccccc21 Amb22748827 [1,0,0,1,0,0|1,0,0]=3 3581 B13R2.72 O=C(O)[C@@H]1NCc2ccccc21 Amb30869293 [1,0,0,1,0,0|1,0,0]=3 3582 B13R2.72 O=C(O)[C@H]1CCc2ccccc21 Amb24470066 [1,0,0,1,0,0|0,0,0]=2 3583 B13R2.72 O=C(O)[C@H]1NCc2ccccc21 Amb25200954 [1,0,0,1,0,0|1,0,0]=3 3584 B13R2.72 O=C(O)[C@H]1NCc2ccccc21 Amb33872272 [1,0,0,1,0,0|1,0,0]=3 3585 B13R2.72 OC(=S)N1CCc2ccccc21 Amb27797481 [1,0,0,1,0,0|1,1,0]=4 3586 B13R2.163 N=C1CCCc2ccccc2N1 Amb8507493 [1,0,0,1,0,0|2,0,0]=4 3587 B13R2.163 NC1CCCc2ccccc2C1 Amb24355951 [1,0,0,1,0,0|1,0,1]=4 3588 B13R2.163 O=C1CCCc2ccccc2C1 Amb6360022 [1,0,0,1,0,0|0,0,0]=2 3589 B13R2.163 O=C1CCCc2ccccc2N1 Amb1077569 [1,0,0,1,0,0|1,0,0]=3 3590 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [1,0,0,1,0,0|0,0,0]=2 3591 B13R2.163 O=C1CCCc2cccnc2N1 Amb21962431 [1,0,0,1,0,0|2,0,0]=4 3592 B13R2.163 O=C1CCCc2ccncc2N1 Amb28074006 [1,0,0,1,0,0|2,0,0]=4 3593 B13R2.163 O=C1CCCc2ncccc2N1 Amb28319382 [1,0,0,1,0,0|2,0,0]=4 3594 B13R2.163 O=C1CCNc2ccccc2C1 Amb18829955 [1,0,0,1,0,0|1,0,0]=3 3595 B13R2.163 O=C1CCNc2ccccc2N1 Amb1666975 [1,0,0,1,0,0|2,0,0]=4 3596 B13R2.163 O=C1CCOc2ccccc2C1 Amb24352115 [1,0,0,1,0,0|1,0,0]=3 3597 B13R2.163 O=C1CCOc2ccccc2N1 Amb10608982 [1,0,0,1,0,0|2,0,0]=4 3598 B13R2.163 O=C1CCSc2ccccc2C1 Amb25878594 [1,0,0,1,0,0|1,0,0]=3 3599 B13R2.163 O=C1CCSc2ccccc2N1 Amb1154582 [1,0,0,1,0,0|2,0,0]=4 3600 B13R2.163 O=C1CNCc2ccccc2N1 Amb17606145 [1,0,0,1,0,0|2,0,0]=4 3601 B13R2.163 O=C1CNCc2ccccc2N1 Amb28872408 [1,0,0,1,0,0|2,0,0]=4 3602 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [1,0,0,1,0,0|2,0,0]=4 3603 B13R2.163 O=C1Cc2ccccc2CCN1 Amb16203437 [1,0,0,1,0,0|1,0,0]=3 3604 B13R2.163 O=C1NCCc2ccccc2N1 Amb25869873 [1,0,0,1,0,0|2,0,0]=4 3605 B13R2.163 OC1CCCc2ccccc2C1 Amb3987828 [1,0,0,1,0,0|0,0,2]=4 3606 B13R2.423 CC(=O)C1CC1c2ccccc2 Amb534893 [1,0,0,1,0,0|0,0,0]=2 3607 B13R2.423 CC(=O)C1CC1c2cnccn2 Amb35601041 [1,0,0,1,0,0|2,0,0]=4 3608 B13R2.423 CC(=O)C1CC1c2cncnc2 Amb27960546 [1,0,0,1,0,0|2,0,0]=4 3609 B13R2.423 CC(=O)C1N=C1c2ccccc2 Amb25863961 [1,0,0,1,0,0|1,0,1]=4 3610 B13R2.423 CC(=O)C1OC1c2ccccn2 Amb27426800 [1,0,0,1,0,0|2,0,0]=4 3611 B13R2.423 CC(=O)C1OC1c2cccnc2 Amb26055012 [1,0,0,1,0,0|2,0,0]=4 3612 B13R2.423 CC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb27780823 [1,0,0,1,0,0|0,0,0]=2 3613 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [1,0,0,1,0,0|0,0,0]=2 3614 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccn2 Amb33457459 [1,0,0,1,0,0|1,0,0]=3 3615 B13R2.423 CC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb26481631 [1,0,0,1,0,0|1,0,0]=3 3616 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [1,0,0,1,0,0|1,0,0]=3 3617 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccn2 Amb26055245 [1,0,0,1,0,0|2,0,0]=4 3618 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2cccnc2 Amb27758910 [1,0,0,1,0,0|2,0,0]=4 3619 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccncc2 Amb25375191 [1,0,0,1,0,0|2,0,0]=4 3620 B13R2.423 CC(=O)[C@H]1CC1c2ccccc2 Amb27770300 [1,0,0,1,0,0|0,0,0]=2 3621 B13R2.423 CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb28054879 [1,0,0,1,0,0|0,0,0]=2 3622 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [1,0,0,1,0,0|0,0,0]=2 3623 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [1,0,0,1,0,0|1,0,0]=3 3624 B13R2.423 CC(=O)[C@H]1O[C@H]1c2ccccc2 Amb27966798 [1,0,0,1,0,0|1,0,0]=3 3625 B13R2.423 CC(Cl)C1CC1c2ccccc2 Amb27426778 [1,0,0,1,0,0|1,0,1]=4 3626 B13R2.423 CC(N)C1CC1c2ccccc2 Amb10610180 [1,0,0,1,0,0|1,0,1]=4 3627 B13R2.423 CC(N)C1CC1c2ccccc2 Amb7807914 [1,0,0,1,0,0|1,0,1]=4 3628 B13R2.423 CC(N)[C@@H]1C[C@H]1c2ccccc2 Amb26926536 [1,0,0,1,0,0|1,0,1]=4 3629 B13R2.423 CC(N)[C@@H]1C[C@H]1c2ccccc2 Amb32652180 [1,0,0,1,0,0|1,0,1]=4 3630 B13R2.423 CC(O)C1CC1c2ccccc2 Amb17605479 [1,0,0,1,0,0|0,0,2]=4 3631 B13R2.423 CC(O)[C@H]1C[C@@H]1c2ccccc2 Amb27664262 [1,0,0,1,0,0|0,0,2]=4 3632 B13R2.423 C[C@@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb27857504 [1,0,0,1,0,0|0,0,2]=4 3633 B13R2.423 NC(=O)C1CC1c2cccnc2 Amb25701875 [1,0,0,1,0,0|2,0,0]=4 3634 B13R2.423 NC(=O)C1CC1c2ccncc2 Amb27598012 [1,0,0,1,0,0|2,0,0]=4 3635 B13R2.423 NC(=O)C1OC1c2ccccc2 Amb26844548 [1,0,0,1,0,0|2,0,0]=4 3636 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb25965684 [1,0,0,1,0,0|1,0,0]=3 3637 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb26624595 [1,0,0,1,0,0|1,0,0]=3 3638 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2cccnc2 Amb27473517 [1,0,0,1,0,0|2,0,0]=4 3639 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccncc2 Amb29837838 [1,0,0,1,0,0|2,0,0]=4 3640 B13R2.423 NC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb27878627 [1,0,0,1,0,0|2,0,0]=4 3641 B13R2.423 NC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24519129 [1,0,0,1,0,0|2,0,0]=4 3642 B13R2.423 NC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27984902 [1,0,0,1,0,0|2,0,0]=4 3643 B13R2.423 NC(=S)C1CC1c2ccccc2 Amb27616774 [1,0,0,1,0,0|1,1,0]=4 3644 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [1,0,0,1,0,0|1,0,0]=3 3645 B13R2.423 O=C(Cl)[C@@H]1C[C@H]1c2ccccc2 Amb3939047 [1,0,0,1,0,0|1,0,0]=3 3646 B13R2.423 O=C(Cl)[C@@H]1O[C@H]1c2ccccc2 Amb25205379 [1,0,0,1,0,0|2,0,0]=4 3647 B13R2.423 O=C(O)C1=C(c2ccccc2)C1 Amb28121109 [1,0,0,1,0,0|0,0,2]=4 3648 B13R2.423 O=C(O)C1CC1c2ccccc2 Amb534800 [1,0,0,1,0,0|0,0,0]=2 3649 B13R2.423 O=C(O)C1CC1c2ccccn2 Amb28991402 [1,0,0,1,0,0|1,0,0]=3 3650 B13R2.423 O=C(O)C1CC1c2ccccn2 Amb9677166 [1,0,0,1,0,0|1,0,0]=3 3651 B13R2.423 O=C(O)C1CC1c2cccnc2 Amb9677138 [1,0,0,1,0,0|1,0,0]=3 3652 B13R2.423 O=C(O)C1CC1c2ccncc2 Amb19514911 [1,0,0,1,0,0|1,0,0]=3 3653 B13R2.423 O=C(O)C1CC1c2ccncc2 Amb9677129 [1,0,0,1,0,0|1,0,0]=3 3654 B13R2.423 O=C(O)C1CC1c2ccncn2 Amb24662852 [1,0,0,1,0,0|2,0,0]=4 3655 B13R2.423 O=C(O)C1CC1c2cnccn2 Amb26336135 [1,0,0,1,0,0|2,0,0]=4 3656 B13R2.423 O=C(O)C1CC1c2cncnc2 Amb23571328 [1,0,0,1,0,0|2,0,0]=4 3657 B13R2.423 O=C(O)C1CC1c2ncccn2 Amb33270696 [1,0,0,1,0,0|2,0,0]=4 3658 B13R2.423 O=C(O)C1OC1c2ccccc2 Amb3775834 [1,0,0,1,0,0|1,0,0]=3 3659 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [1,0,0,1,0,0|0,0,0]=2 3660 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2cccnc2 Amb27234646 [1,0,0,1,0,0|1,0,0]=3 3661 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccc2 Amb33524226 [1,0,0,1,0,0|0,0,0]=2 3662 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccn2 Amb25983800 [1,0,0,1,0,0|1,0,0]=3 3663 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccn2 Amb31260868 [1,0,0,1,0,0|1,0,0]=3 3664 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cccnc2 Amb26636966 [1,0,0,1,0,0|1,0,0]=3 3665 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncc2 Amb25299768 [1,0,0,1,0,0|1,0,0]=3 3666 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncc2 Amb28594202 [1,0,0,1,0,0|1,0,0]=3 3667 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncn2 Amb33269039 [1,0,0,1,0,0|2,0,0]=4 3668 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncn2 Amb35753095 [1,0,0,1,0,0|2,0,0]=4 3669 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cnccn2 Amb33360019 [1,0,0,1,0,0|2,0,0]=4 3670 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cncnc2 Amb33472947 [1,0,0,1,0,0|2,0,0]=4 3671 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ncccn2 Amb33270686 [1,0,0,1,0,0|2,0,0]=4 3672 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [1,0,0,1,0,0|0,0,0]=2 3673 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccccn2 Amb27488853 [1,0,0,1,0,0|1,0,0]=3 3674 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2cccnc2 Amb26928613 [1,0,0,1,0,0|1,0,0]=3 3675 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccncc2 Amb27974957 [1,0,0,1,0,0|1,0,0]=3 3676 B13R2.423 O=C(O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [1,0,0,1,0,0|0,0,0]=2 3677 B13R2.423 O=C([O-])C1OC1c2ccccc2 Amb4008297 [1,0,0,1,0,0|1,0,1]=4 3678 B13R2.423 O=C([O-])C1OC1c2ccccc2 Amb431197 [1,0,0,1,0,0|1,0,1]=4 3679 B13R2.423 O=S([O-])[C@@H]1C[C@H]1c2ccccc2 Amb32755429 [1,0,0,1,0,0|1,0,1]=4 3680 B13R2.423 O=[N+]([O-])C1CC1c2ccccc2 Amb27651637 [1,0,0,1,0,0|1,0,1]=4 3681 B13R2.423 O=[N+]([O-])[C@@H]1CC1c2ccccc2 Amb27635928 [1,0,0,1,0,0|1,0,1]=4 3682 B13R2.423 O=[N+]([O-])[C@H]1C[C@@H]1c2ccccc2 Amb26989678 [1,0,0,1,0,0|1,0,1]=4 3683 B13R2.423 OB(O)C1CC1c2ccccc2 Amb26632211 [1,0,0,1,0,0|1,0,1]=4 3684 B13R2.423 OB(O)[C@@H]1C[C@H]1c2ccccc2 Amb24711708 [1,0,0,1,0,0|1,0,1]=4 3685 B13R2.423 OB(O)[C@H]1C[C@@H]1c2ccccc2 Amb27420204 [1,0,0,1,0,0|1,0,1]=4 3686 B13R2.3122 CC1(C)CCCc2ccccc21 Amb25328610 [1,0,0,1,0,0|1,0,1]=4 3687 B13R2.3122 CC1(N)CCCc2ccccc21 Amb13952456 [1,0,0,1,0,0|1,0,1]=4 3688 B13R2.3122 CC1(N)CCCc2ccccc21 Amb9676140 [1,0,0,1,0,0|1,0,1]=4 3689 B13R2.3122 CC1(O)CCCc2ccccc21 Amb6332075 [1,0,0,1,0,0|0,0,2]=4 3690 B13R2.3122 C[N+]1(C)CCCc2ccccc21 Amb5717952 [1,0,0,1,0,0|2,0,0]=4 3691 B13R2.5881 CC(=O)NC1Cc2ccccc21 Amb17778879 [1,0,0,1,0,0|1,0,0]=3 3692 B13R2.5881 CC(=O)OC1Cc2ccccc21 Amb17778687 [1,0,0,1,0,0|1,0,0]=3 3693 B13R2.5881 CC(=O)\C=C1/Cc2ccccc21 Amb21948332 [1,0,0,1,0,0|0,0,2]=4 3694 B13R2.5881 O=C(O)CC1=Cc2ccccc21 Amb25148617 [1,0,0,1,0,0|0,0,2]=4 3695 B13R2.5881 O=C(O)CC1Cc2ccccc21 Amb25279494 [1,0,0,1,0,0|0,0,0]=2 3696 B13R2.5881 O=C(O)\C=C1\Cc2ccccc21 Amb28288611 [1,0,0,1,0,0|0,0,2]=4 3697 B13R2.32 CC1=C(C)c2ccccc2CC1 Amb31292547 [0,0,0,1,1,0|2,0,0]=4 3698 B13R2.32 CC1C(=O)CCc2ccccc21 Amb4605911 [0,0,0,1,1,0|1,0,0]=3 3699 B13R2.32 CN1C(=O)CCc2ccccc21 Amb17322846 [0,0,0,1,1,0|1,0,0]=3 3700 B13R2.32 CN1C(=O)CNc2ccccc21 Amb8471882 [0,0,0,1,1,0|2,0,0]=4 3701 B13R2.32 CN1C(=O)COc2ccccc21 Amb1351378 [0,0,0,1,1,0|2,0,0]=4 3702 B13R2.32 CN1C(=O)CSc2ccccc21 Amb3484441 [0,0,0,1,1,0|2,0,0]=4 3703 B13R2.32 CN1C(=O)NCc2ccccc21 Amb28243973 [0,0,0,1,1,0|2,0,0]=4 3704 B13R2.32 CN1C(=S)CCc2ccccc21 Amb28185012 [0,0,0,1,1,0|1,1,0]=4 3705 B13R2.32 NC1C(=O)CCc2ccccc21 Amb27481724 [0,0,0,1,1,0|2,0,0]=4 3706 B13R2.32 O=C1CCc2ccccc2C1=O Amb28200177 [0,0,0,1,1,0|2,0,0]=4 3707 B13R2.32 O=C1CCc2ccccc2C1Cl Amb27484080 [0,0,0,1,1,0|2,0,0]=4 3708 B13R2.32 O=C1CCc2ccccc2C1F Amb25092927 [0,0,0,1,1,0|2,0,0]=4 3709 B13R2.32 O=C1CCc2ccccc2N1O Amb1099957 [0,0,0,1,1,0|2,0,0]=4 3710 B13R2.33 C=C1CNc2ccccc2CO1 Amb27669840 [0,0,0,1,1,0|2,0,0]=4 3711 B13R2.33 O=C1C=Cc2ccccc2CC1 Amb17593958 [0,0,0,1,1,0|1,0,1]=4 3712 B13R2.33 O=C1CCc2ccccc2CC1 Amb6359959 [0,0,0,1,1,0|1,0,0]=3 3713 B13R2.33 O=C1CCc2ccccc2CN1 Amb610462 [0,0,0,1,1,0|1,0,0]=3 3714 B13R2.33 O=C1CCc2ccccc2OC1 Amb26925695 [0,0,0,1,1,0|2,0,0]=4 3715 B13R2.33 O=C1CCc2cccnc2CC1 Amb26546938 [0,0,0,1,1,0|2,0,0]=4 3716 B13R2.33 O=C1CCc2cccnc2CC1 Amb32663810 [0,0,0,1,1,0|2,0,0]=4 3717 B13R2.33 O=C1CNc2ccccc2CN1 Amb17620443 [0,0,0,1,1,0|2,0,0]=4 3718 B13R2.33 O=C1COc2ccccc2CN1 Amb2137257 [0,0,0,1,1,0|2,0,0]=4 3719 B13R2.57 CNC1=Nc2ccccc2CC1 Amb26443433 [0,0,0,1,1,0|2,0,0]=4 3720 B13R2.57 COC1=Nc2ccccc2CC1 Amb27179706 [0,0,0,1,1,0|1,0,0]=3 3721 B13R2.57 COC1=Nc2ccccc2OC1 Amb33218462 [0,0,0,1,1,0|2,0,0]=4 3722 B13R2.57 COC1=Nc2ccccc2SC1 Amb24116116 [0,0,0,1,1,0|2,0,0]=4 3723 B13R2.373 CC1C(=O)CC1c2ccccc2 Amb20668234 [0,0,0,1,1,0|1,0,0]=3 3724 B13R2.373 CC1C(=O)CC1c2ccccn2 Amb27241620 [0,0,0,1,1,0|2,0,0]=4 3725 B13R2.373 CC1C(=O)CN1c2ccccc2 Amb27471934 [0,0,0,1,1,0|2,0,0]=4 3726 B13R2.373 CC1C(=O)NC1c2ccccc2 Amb19149073 [0,0,0,1,1,0|2,0,0]=4 3727 B13R2.373 C[C@@H]1C(=O)N[C@H]1c2ccccc2 Amb28286725 [0,0,0,1,1,0|2,0,0]=4 3728 B13R2.373 C[C@H]1C(=O)N[C@H]1c2ccccc2 Amb27849042 [0,0,0,1,1,0|2,0,0]=4 3729 B13R2.373 O=C1CC(c2ccccc2)C1=O Amb27245972 [0,0,0,1,1,0|2,0,0]=4 3730 B13R2.3203 CC1(CCc2ccccc2)CO1 Amb18798137 [0,0,0,1,1,0|1,0,1]=4 3731 B13R2.15272 CCC(=O)C1Cc2ccccc21 Amb28250023 [0,0,0,1,1,0|1,0,0]=3 3732 B13R2.15272 CNC(=O)C1Cc2ccccc21 Amb27166885 [0,0,0,1,1,0|1,0,0]=3 3733 B13R2.15272 COC(=O)C1Cc2ccccc21 Amb27616823 [0,0,0,1,1,0|0,0,0]=2 3734 B13R2.15272 NCC(=O)C1Cc2ccccc21 Amb27616822 [0,0,0,1,1,0|2,0,0]=4 3735 B13R2.15272 O=C(CBr)C1Cc2ccccc21 Amb25669623 [0,0,0,1,1,0|2,0,0]=4 3736 B13R2.12 O=C1CCC(c2ccco2)CC1 Amb18563610 [0,0,0,1,1,0|2,0,0]=4 3737 B13R2.12 O=C1CCC(c2cccs2)CC1 Amb18564147 [0,0,0,1,1,0|2,0,0]=4 3738 B13R2.12 O=C1CCC(c2cccs2)CN1 Amb17400887 [0,0,0,1,1,0|2,0,0]=4 3739 B13R2.142 O=C1CC(Cc2cccs2)CN1 Amb27231604 [0,0,0,1,1,0|2,0,0]=4 3740 B13R2.142 O=C1CC(Cn2cccc2)CN1 Amb27815348 [0,0,0,1,1,0|2,0,0]=4 3741 B13R2.142 O=C1NC(Cc2ccco2)CO1 Amb28040921 [0,0,0,1,1,0|2,0,0]=4 3742 B13R2.1095 COC(=O)C1CCc2ccnn21 Amb27208751 [0,0,0,1,1,0|2,0,0]=4 3743 B13R2.1095 COC(=O)C1CCc2oncc21 Amb23596856 [0,0,0,1,1,0|2,0,0]=4 3744 B13R2.2348 CC1C(=O)CCC1c2ccco2 Amb27482940 [0,0,0,1,1,0|2,0,0]=4 3745 B13R2.2348 CC1C(=O)CCC1c2cccs2 Amb27251516 [0,0,0,1,1,0|2,0,0]=4 3746 B13R2.2348 CC1C(=O)CCC1c2ccsc2 Amb28364049 [0,0,0,1,1,0|2,0,0]=4 3747 B15R2.4 C#CC(=O)NC1CCc2ccccc21 Amb30017881 [0,0,0,1,0,1|1,0,1]=4 3748 B15R2.4 C=CC(=O)NC1CCc2ccccc21 Amb9516904 [0,0,0,1,0,1|1,0,1]=4 3749 B15R2.4 CCC(=O)NC1CCc2ccccc21 Amb8340525 [0,0,0,1,0,1|1,0,0]=3 3750 B15R2.4 CCC(=O)NN1CCc2ccccc21 Amb647231 [0,0,0,1,0,1|2,0,0]=4 3751 B15R2.4 CNC(=O)CC1CCc2ccccc21 Amb17234743 [0,0,0,1,0,1|1,0,0]=3 3752 B15R2.4 CNC(=O)NC1CCc2ccccc21 Amb24181769 [0,0,0,1,0,1|1,0,0]=3 3753 B15R2.4 COC(=O)CC1CNc2ccccc21 Amb17592979 [0,0,0,1,0,1|0,0,0]=2 3754 B15R2.4 COC(=O)CC1CNc2ccccc21 Amb32674605 [0,0,0,1,0,1|0,0,0]=2 3755 B15R2.4 COC(=O)CC1COc2ccccc21 Amb27791137 [0,0,0,1,0,1|0,0,0]=2 3756 B15R2.4 COC(=O)CC1NCc2ccccc21 Amb22497860 [0,0,0,1,0,1|0,0,0]=2 3757 B15R2.4 COC(=O)C[C@H]1NCc2ccccc21 Amb27878658 [0,0,0,1,0,1|0,0,0]=2 3758 B15R2.4 COC(=O)Cc1coc2ccccc12 Amb25354938 [0,0,0,1,0,1|0,0,2]=4 3759 B15R2.4 COC(=O)Cc1noc2ccccc12 Amb3593284 [0,0,0,1,0,1|1,0,1]=4 3760 B15R2.4 COC(=O)Cc1nsc2ccccc12 Amb27463594 [0,0,0,1,0,1|1,0,1]=4 3761 B15R2.4 COC(=O)Cc1onc2ccccc12 Amb27851594 [0,0,0,1,0,1|1,0,1]=4 3762 B15R2.4 COC(=O)Cn1ccc2ccccc21 Amb3703082 [0,0,0,1,0,1|0,0,2]=4 3763 B15R2.4 COC(=O)Cn1cnc2ccccc21 Amb1744624 [0,0,0,1,0,1|1,0,1]=4 3764 B15R2.4 COC(=O)Cn1ncc2ccccc21 Amb19060886 [0,0,0,1,0,1|1,0,1]=4 3765 B15R2.4 COC(=O)Cn1nnc2ccccc21 Amb5248131 [0,0,0,1,0,1|2,0,0]=4 3766 B15R2.4 COC(=O)NC1CCc2ccccc21 Amb27588053 [0,0,0,1,0,1|0,0,0]=2 3767 B15R2.4 COC(=O)\C=C1\CCc2ccccc21 Amb28289805 [0,0,0,1,0,1|0,0,1]=3 3768 B15R2.4 COC(=O)\C=C1\CCc2cccnc21 Amb33492941 [0,0,0,1,0,1|1,0,1]=4 3769 B15R2.4 COC(=O)\C=C1\COc2ccccc21 Amb27593964 [0,0,0,1,0,1|0,0,2]=4 3770 B15R2.4 NNC(=O)CC1CCc2ccccc21 Amb27407362 [0,0,0,1,0,1|2,0,0]=4 3771 B15R2.4 NNC(=O)CC1CNc2ccccc21 Amb27406277 [0,0,0,1,0,1|2,0,0]=4 3772 B15R2.4 NNC(=O)OC1CCc2ccccc21 Amb27830916 [0,0,0,1,0,1|2,0,0]=4 3773 B15R2.4 O=C(CBr)NC1CCc2ccccc21 Amb17329466 [0,0,0,1,0,1|2,0,0]=4 3774 B15R2.4 O=C(CBr)N[C@@H]1CCc2ccccc21 Amb27883611 [0,0,0,1,0,1|2,0,0]=4 3775 B15R2.4 O=C(CBr)N[C@H]1CCc2ccccc21 Amb27650509 [0,0,0,1,0,1|2,0,0]=4 3776 B15R2.4 O=C(CCl)NC1CCc2ccccc21 Amb9516901 [0,0,0,1,0,1|2,0,0]=4 3777 B15R2.4 O=C(CCl)N[C@H]1CCc2ccccc21 Amb27958274 [0,0,0,1,0,1|2,0,0]=4 3778 B15R2.15 COC1=NC(Cc2ccccc2)CO1 Amb22549387 [0,0,0,1,0,1|1,0,0]=3 3779 B15R2.29 BrC1=CCN(Cc2ccccc2)CC1 Amb13885738 [0,0,0,1,0,1|2,0,0]=4 3780 B15R2.29 C=C1CCN(Cc2ccccc2)CC1 Amb10569116 [0,0,0,1,0,1|2,0,0]=4 3781 B15R2.29 CC1=CCN(Cc2ccccc2)CC1 Amb20240699 [0,0,0,1,0,1|2,0,0]=4 3782 B15R2.29 CC1=CCN(Cc2ccccc2)CC1 Amb8388555 [0,0,0,1,0,1|2,0,0]=4 3783 B15R2.29 CC1CCC(Nc2ccccc2)CO1 Amb35698668 [0,0,0,1,0,1|1,0,1]=4 3784 B15R2.29 CC1CNC(Cc2ccccc2)CO1 Amb18563409 [0,0,0,1,0,1|1,0,1]=4 3785 B15R2.29 O=C1C=CC(Cc2ccccc2)CC1 Amb25793582 [0,0,0,1,0,1|1,0,1]=4 3786 B15R2.29 O=C1CCC(=Nc2ccccc2)CC1 Amb27228881 [0,0,0,1,0,1|1,0,1]=4 3787 B15R2.29 O=C1CCC(Cc2ccccc2)CC1 Amb13777318 [0,0,0,1,0,1|1,0,0]=3 3788 B15R2.29 O=C1CCC(Cc2ccccc2)CN1 Amb27388034 [0,0,0,1,0,1|1,0,0]=3 3789 B15R2.29 O=C1CCC(Cc2ccccn2)CC1 Amb27833056 [0,0,0,1,0,1|2,0,0]=4 3790 B15R2.29 O=C1CCC(Nc2ccccn2)CN1 Amb27604878 [0,0,0,1,0,1|2,0,0]=4 3791 B15R2.29 O=C1CCC(Oc2ccccc2)CC1 Amb25825595 [0,0,0,1,0,1|1,0,0]=3 3792 B15R2.29 O=C1CCC(Oc2ccccn2)CC1 Amb23598210 [0,0,0,1,0,1|2,0,0]=4 3793 B15R2.29 O=C1CCC(Sc2ccccc2)CC1 Amb26855446 [0,0,0,1,0,1|1,0,0]=3 3794 B15R2.29 O=C1CCN(Cc2ccccc2)CC1 Amb2684677 [0,0,0,1,0,1|1,0,0]=3 3795 B15R2.29 O=C1CCN(Cc2ccccn2)CC1 Amb6265802 [0,0,0,1,0,1|2,0,0]=4 3796 B15R2.29 O=C1CCN(Cc2cccnc2)CC1 Amb3941154 [0,0,0,1,0,1|2,0,0]=4 3797 B15R2.29 O=C1CCN(Cc2ccncc2)CC1 Amb33532790 [0,0,0,1,0,1|2,0,0]=4 3798 B15R2.29 O=C1CNC(Cc2ccccc2)CN1 Amb18819212 [0,0,0,1,0,1|1,0,0]=3 3799 B15R2.29 O=C1COC(Cc2ccccc2)CN1 Amb26405206 [0,0,0,1,0,1|1,0,0]=3 3800 B15R2.29 O=C1NCC(Cc2ccccc2)CO1 Amb28346309 [0,0,0,1,0,1|0,0,0]=2 3801 B15R2.29 O=C1OCC(Nc2ccccc2)CO1 Amb28121065 [0,0,0,1,0,1|1,0,0]=3 3802 B15R2.29 O=S1CCC(Nc2ccccc2)CC1 Amb18955527 [0,0,0,1,0,1|2,0,0]=4 3803 B15R2.29 O=S1CCC(Nc2ccccc2)CC1 Amb21988474 [0,0,0,1,0,1|2,0,0]=4 3804 B15R2.32 CC1C(=O)CCNC1c2ccccc2 Amb1778613 [0,0,0,1,0,1|1,0,0]=3 3805 B15R2.32 CN1C(=O)CNCC1c2ccccc2 Amb27387910 [0,0,0,1,0,1|1,0,0]=3 3806 B15R2.32 CN1C(=O)CNCC1c2ccccn2 Amb28205394 [0,0,0,1,0,1|2,0,0]=4 3807 B15R2.32 CN1C(=O)CNCC1c2cccnc2 Amb25191024 [0,0,0,1,0,1|2,0,0]=4 3808 B15R2.32 CN1C(=O)CNCC1c2ccncc2 Amb25700145 [0,0,0,1,0,1|2,0,0]=4 3809 B15R2.32 C[C@@H]1C(=O)CCN[C@H]1c2ccccc2 Amb27199721 [0,0,0,1,0,1|1,0,0]=3 3810 B15R2.32 NC1=C(c2ccccc2)CCCC1=O Amb27758644 [0,0,0,1,0,1|2,0,0]=4 3811 B15R2.32 NC1C(=O)NCCC1c2ccccc2 Amb27755554 [0,0,0,1,0,1|2,0,0]=4 3812 B15R2.32 O=C1CCCC(c2ccccc2)=C1O Amb8394182 [0,0,0,1,0,1|2,0,0]=4 3813 B15R2.32 O=C1CCC[C@@H](c2ccccc2)[C@@H]1O Amb28435788 [0,0,0,1,0,1|2,0,0]=4 3814 B15R2.32 O=C1CCNC(c2ccccc2)N1O Amb27223891 [0,0,0,1,0,1|2,0,0]=4 3815 B15R2.32 O=C1CCO[C@@H](c2ccccc2)[C@@H]1O Amb27420319 [0,0,0,1,0,1|2,0,0]=4 3816 B15R2.283 CC1CC(NCc2ccccc2)CO1 Amb35686686 [0,0,0,1,0,1|1,0,1]=4 3817 B15R2.283 N=C1CN(CCc2ccccc2)NO1 Amb27795767 [0,0,0,1,0,1|2,0,0]=4 3818 B15R2.283 NC1=NC(CSc2ccccc2)CO1 Amb27784910 [0,0,0,1,0,1|2,0,0]=4 3819 B15R2.283 NC1=NCC(CCc2ccccc2)O1 Amb27746954 [0,0,0,1,0,1|2,0,0]=4 3820 B15R2.283 NC1=N[C@@H](CCc2ccccc2)CO1 Amb27969242 [0,0,0,1,0,1|1,0,0]=3 3821 B15R2.283 NC1=N[C@H](CCc2ccccc2)CO1 Amb27879567 [0,0,0,1,0,1|1,0,0]=3 3822 B15R2.283 NC1=N[C@H](COc2ccccc2)CO1 Amb27464440 [0,0,0,1,0,1|2,0,0]=4 3823 B15R2.283 O=C1C=C(NCc2ccccc2)CO1 Amb23562822 [0,0,0,1,0,1|0,0,2]=4 3824 B15R2.283 O=C1C=C[C@H](OCc2ccccc2)C1 Amb25167796 [0,0,0,1,0,1|1,0,1]=4 3825 B15R2.283 O=C1CC(C#Cc2ccccc2)CN1 Amb28136628 [0,0,0,1,0,1|1,0,1]=4 3826 B15R2.283 O=C1CC(CCc2ccccc2)CN1 Amb26954493 [0,0,0,1,0,1|1,0,0]=3 3827 B15R2.283 O=C1CC(CCc2ccccc2)NN1 Amb29862137 [0,0,0,1,0,1|2,0,0]=4 3828 B15R2.283 O=C1CC(CNc2ccccn2)CN1 Amb28429975 [0,0,0,1,0,1|2,0,0]=4 3829 B15R2.283 O=C1CC(CNc2ccncc2)CN1 Amb28429974 [0,0,0,1,0,1|2,0,0]=4 3830 B15R2.283 O=C1CC(COc2ccccn2)CN1 Amb31193664 [0,0,0,1,0,1|2,0,0]=4 3831 B15R2.283 O=C1CC(COc2cccnc2)CN1 Amb27786079 [0,0,0,1,0,1|2,0,0]=4 3832 B15R2.283 O=C1CC(NCc2ccccc2)CN1 Amb27824136 [0,0,0,1,0,1|1,0,0]=3 3833 B15R2.283 O=C1CC(NCc2ccccn2)CN1 Amb28461476 [0,0,0,1,0,1|2,0,0]=4 3834 B15R2.283 O=C1CC(NCc2cccnc2)CN1 Amb27824294 [0,0,0,1,0,1|2,0,0]=4 3835 B15R2.283 O=C1CC(SCc2ccccc2)CN1 Amb28408803 [0,0,0,1,0,1|1,0,0]=3 3836 B15R2.283 O=C1CC(\C=C\c2ccccc2)CN1 Amb33083000 [0,0,0,1,0,1|1,0,1]=4 3837 B15R2.283 O=C1CCC(CCc2ccccc2)C1 Amb28124539 [0,0,0,1,0,1|1,0,0]=3 3838 B15R2.283 O=C1CCC(CCc2ccccc2)N1 Amb27596663 [0,0,0,1,0,1|1,0,0]=3 3839 B15R2.283 O=C1CCC(OCc2ccccc2)C1 Amb27465409 [0,0,0,1,0,1|1,0,0]=3 3840 B15R2.283 O=C1CCN(CCc2ccccc2)C1 Amb8947966 [0,0,0,1,0,1|1,0,0]=3 3841 B15R2.283 O=C1CC[C@@H](COc2ccccc2)N1 Amb27960874 [0,0,0,1,0,1|2,0,0]=4 3842 B15R2.283 O=C1COC(CCc2ccccc2)C1 Amb35722230 [0,0,0,1,0,1|2,0,0]=4 3843 B15R2.283 O=C1NC(CCc2ccccc2)CO1 Amb25217512 [0,0,0,1,0,1|0,0,0]=2 3844 B15R2.283 O=C1NC(\C=C\c2ccccc2)CO1 Amb33081796 [0,0,0,1,0,1|0,0,2]=4 3845 B15R2.283 O=C1NCC(CCc2ccccc2)O1 Amb27662552 [0,0,0,1,0,1|1,0,0]=3 3846 B15R2.283 O=C1NCC(CNc2ccccc2)O1 Amb25082861 [0,0,0,1,0,1|2,0,0]=4 3847 B15R2.283 O=C1NCC(COc2ccccc2)O1 Amb25861694 [0,0,0,1,0,1|2,0,0]=4 3848 B15R2.283 O=C1NCC(CSc2ccccc2)O1 Amb25756159 [0,0,0,1,0,1|2,0,0]=4 3849 B15R2.283 O=C1N[C@@H](C#Cc2ccccc2)CO1 Amb27849997 [0,0,0,1,0,1|0,0,2]=4 3850 B15R2.283 O=C1OCC(CNc2ccccc2)O1 Amb28137905 [0,0,0,1,0,1|1,0,0]=3 3851 B15R2.283 O=S1OCC(COc2ccccc2)O1 Amb3483030 [0,0,0,1,0,1|2,0,0]=4 3852 B15R2.283 S=C1NC(CCc2ccccc2)CO1 Amb28241411 [0,0,0,1,0,1|0,1,0]=3 3853 B15R2.283 S=C1NCC(CCc2ccccc2)O1 Amb28046293 [0,0,0,1,0,1|1,1,0]=4 3854 B15R2.342 O=C1CCC1COCc2ccccc2 Amb25316137 [0,0,0,1,0,1|1,0,0]=3 3855 B15R2.548 N=C1CCC(c2ccccc2)CCN1 Amb27228838 [0,0,0,1,0,1|2,0,0]=4 3856 B15R2.548 O=C1CCC(c2ccccc2)CCN1 Amb9316852 [0,0,0,1,0,1|1,0,0]=3 3857 B15R2.548 O=C1CCC(c2ccccc2)CCO1 Amb22337540 [0,0,0,1,0,1|1,0,0]=3 3858 B15R2.548 O=C1CCCC(c2ccccc2)CC1 Amb26602313 [0,0,0,1,0,1|1,0,0]=3 3859 B15R2.548 O=C1CCCC(c2ccccc2)CN1 Amb22642248 [0,0,0,1,0,1|1,0,0]=3 3860 B15R2.548 O=C1CCNC(c2ccccc2)CN1 Amb27847304 [0,0,0,1,0,1|1,0,0]=3 3861 B15R2.597 CC1C(=O)NC1SCc2ccccc2 Amb27783354 [0,0,0,1,0,1|2,0,0]=4 3862 B15R2.597 N[C@H]1C(=O)N[C@H]1CCc2ccccc2 Amb27441068 [0,0,0,1,0,1|2,0,0]=4 3863 B15R2.597 O=C1CC(OCc2ccccc2)C1Cl Amb28247084 [0,0,0,1,0,1|2,0,0]=4 3864 B15R2.1561 COC(=O)C1CN1Cc2ccccc2 Amb22504624 [0,0,0,1,0,1|0,0,0]=2 3865 B15R2.1561 NNC(=O)[C@H]1C[C@H]1Oc2ccccc2 Amb27985141 [0,0,0,1,0,1|2,0,0]=4 3866 B15R2.1600 COC(=O)C1CCC1c2ccccc2 Amb23453479 [0,0,0,1,0,1|0,0,0]=2 3867 B15R2.1600 COC(=O)C1CCN1c2cccnc2 Amb27479994 [0,0,0,1,0,1|1,0,0]=3 3868 B15R2.1600 COC(=O)C1CCN1c2cncnc2 Amb27649544 [0,0,0,1,0,1|2,0,0]=4 3869 B15R2.1600 COC(=O)[C@@H]1NC[C@H]1c2ccccc2 Amb33737661 [0,0,0,1,0,1|0,0,0]=2 3870 B15R2.1600 COC(C)C1NCC1c2ccccc2 Amb27841568 [0,0,0,1,0,1|1,0,1]=4 3871 B15R2.1600 NCC(=O)N1CCC1c2ccccc2 Amb27451524 [0,0,0,1,0,1|2,0,0]=4 3872 B15R2.1621 C#CC(=O)NC1CC1c2ccccc2 Amb35694350 [0,0,0,1,0,1|1,0,1]=4 3873 B15R2.1621 C=CC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb28285550 [0,0,0,1,0,1|1,0,1]=4 3874 B15R2.1621 CCC(=N)NC1CC1c2ccccc2 Amb28350684 [0,0,0,1,0,1|2,0,0]=4 3875 B15R2.1621 CCC(=O)NC1CC1c2ccccc2 Amb25141389 [0,0,0,1,0,1|1,0,0]=3 3876 B15R2.1621 CNC(=N)NC1CC1c2ccccc2 Amb19072436 [0,0,0,1,0,1|2,0,0]=4 3877 B15R2.1621 CNC(=O)NC1CC1c2ccccc2 Amb27589565 [0,0,0,1,0,1|1,0,0]=3 3878 B15R2.1621 COC(=O)NC1CC1c2ccccc2 Amb27982550 [0,0,0,1,0,1|0,0,0]=2 3879 B15R2.1621 CO\C(C)=N/C1CC1c2ccccc2 Amb22356821 [0,0,0,1,0,1|1,0,0]=3 3880 B15R2.1621 NNC(=O)NC1CC1c2ccccc2 Amb19078521 [0,0,0,1,0,1|2,0,0]=4 3881 B15R2.1621 O=C(CS)NC1CC1c2ccccc2 Amb27594562 [0,0,0,1,0,1|2,0,0]=4 3882 B15R2.1995 CO[C@H]1C[C@@H](NCc2ccccc2)C1 Amb27419226 [0,0,0,1,0,1|1,0,1]=4 3883 B15R2.1995 CO[C@H]1C[C@@H](OCc2ccccc2)C1 Amb33715167 [0,0,0,1,0,1|1,0,1]=4 3884 B15R2.4083 CC1C(=O)CCC1Sc2ccccc2 Amb27181526 [0,0,0,1,0,1|1,0,0]=3 3885 B15R2.4083 CC1C(=O)CCN1Cc2ccccc2 Amb17609111 [0,0,0,1,0,1|1,0,0]=3 3886 B15R2.4083 CC1C(=O)NCC1Cc2ccccc2 Amb28056220 [0,0,0,1,0,1|1,0,0]=3 3887 B15R2.4083 CC1C(=O)NNC1Cc2ccccc2 Amb35686089 [0,0,0,1,0,1|2,0,0]=4 3888 B15R2.4083 CC1C(=O)OCC1Nc2ccccc2 Amb27813303 [0,0,0,1,0,1|2,0,0]=4 3889 B15R2.4083 CN1C(=O)CN[C@@H]1Cc2ccccc2 Amb28458338 [0,0,0,1,0,1|1,0,0]=3 3890 B15R2.4083 CN1C(=O)NCC1Cc2ccccc2 Amb18061674 [0,0,0,1,0,1|1,0,0]=3 3891 B15R2.4083 CN1C(=O)OCC1Cc2ccccc2 Amb18559293 [0,0,0,1,0,1|1,0,0]=3 3892 B15R2.4083 O=C1CCN(Cc2ccccc2)C1=O Amb19060341 [0,0,0,1,0,1|2,0,0]=4 3893 B15R2.4083 O=C1OC[C@@H](Cc2ccccc2)[C@H]1O Amb27184414 [0,0,0,1,0,1|2,0,0]=4 3894 B15R2.79185 C#CC(=O)NCC1Cc2ccccc21 Amb35735590 [0,0,0,1,0,1|1,0,1]=4 3895 B15R2.79185 CNC(=O)NCC1Cc2ccccc21 Amb28191259 [0,0,0,1,0,1|1,0,0]=3 3896 B15R2.79765 C#CC(=O)C1CCCc2ccccc21 Amb27747141 [0,0,0,1,0,1|1,0,1]=4 3897 B15R2.79765 C#CC(=O)C1CCOc2ccccc21 Amb27252693 [0,0,0,1,0,1|1,0,1]=4 3898 B15R2.79765 C#CC(=O)N1CCCc2ccccc21 Amb35713464 [0,0,0,1,0,1|1,0,1]=4 3899 B15R2.79765 C=CC(=O)C1CCCc2ccccc21 Amb27655141 [0,0,0,1,0,1|1,0,1]=4 3900 B15R2.79765 C=CC(=O)C1CCNc2ccccc21 Amb27866586 [0,0,0,1,0,1|1,0,1]=4 3901 B15R2.79765 C=CC(=O)C1CCOc2ccccc21 Amb28313863 [0,0,0,1,0,1|1,0,1]=4 3902 B15R2.79765 C=CC(=O)C1NCCc2ccccc21 Amb28248459 [0,0,0,1,0,1|1,0,1]=4 3903 B15R2.79765 C=CC(=O)C1OCCc2ccccc21 Amb28062562 [0,0,0,1,0,1|1,0,1]=4 3904 B15R2.79765 C=CC(=O)N1CCCc2ccccc21 Amb9480424 [0,0,0,1,0,1|1,0,1]=4 3905 B15R2.79765 CCC(=O)C1COCc2ccccc21 Amb28119530 [0,0,0,1,0,1|1,0,0]=3 3906 B15R2.79765 CCC(=O)N1CCCc2ccccc21 Amb2754748 [0,0,0,1,0,1|1,0,0]=3 3907 B15R2.79765 CCC(=O)N1CCOc2ccccc21 Amb18400325 [0,0,0,1,0,1|2,0,0]=4 3908 B15R2.79765 CNC(=N)C1CCOc2ccccc21 Amb27647143 [0,0,0,1,0,1|2,0,0]=4 3909 B15R2.79765 CNC(=O)C1CCCc2ccccc21 Amb8332110 [0,0,0,1,0,1|1,0,0]=3 3910 B15R2.79765 CNC(=O)C1CCNc2ccccc21 Amb23586317 [0,0,0,1,0,1|1,0,0]=3 3911 B15R2.79765 CNC(=O)C1CNCc2ccccc21 Amb18356848 [0,0,0,1,0,1|1,0,0]=3 3912 B15R2.79765 CNC(=O)C1NCCc2ccccc21 Amb18946032 [0,0,0,1,0,1|1,0,0]=3 3913 B15R2.79765 CNC(=O)C1OCCc2ccccc21 Amb4420659 [0,0,0,1,0,1|1,0,0]=3 3914 B15R2.79765 CNC(=O)N1CCNc2ccccc21 Amb27591461 [0,0,0,1,0,1|2,0,0]=4 3915 B15R2.79765 CNC(=O)N1CCSc2ccccc21 Amb24392178 [0,0,0,1,0,1|2,0,0]=4 3916 B15R2.79765 CNC(=S)N1CCCc2ccccc21 Amb6516090 [0,0,0,1,0,1|1,1,0]=4 3917 B15R2.79765 COC(=N)C1CCCc2ccccc21 Amb27647437 [0,0,0,1,0,1|1,0,0]=3 3918 B15R2.79765 COC(=O)C1CCCc2ccccc21 Amb8331050 [0,0,0,1,0,1|0,0,0]=2 3919 B15R2.79765 COC(=O)C1CCCc2cccnc21 Amb26914216 [0,0,0,1,0,1|1,0,0]=3 3920 B15R2.79765 COC(=O)C1CCCc2cnccc21 Amb27270838 [0,0,0,1,0,1|1,0,0]=3 3921 B15R2.79765 COC(=O)C1CCCc2ncccc21 Amb28041481 [0,0,0,1,0,1|1,0,0]=3 3922 B15R2.79765 COC(=O)C1CCNc2ccccc21 Amb10603355 [0,0,0,1,0,1|0,0,0]=2 3923 B15R2.79765 COC(=O)C1CCNc2ccccc21 Amb33329033 [0,0,0,1,0,1|0,0,0]=2 3924 B15R2.79765 COC(=O)C1CNCc2ccccc21 Amb10067661 [0,0,0,1,0,1|0,0,0]=2 3925 B15R2.79765 COC(=O)C1CNCc2ccccc21 Amb15691942 [0,0,0,1,0,1|0,0,0]=2 3926 B15R2.79765 COC(=O)C1NCCc2ccccc21 Amb18956496 [0,0,0,1,0,1|0,0,0]=2 3927 B15R2.79765 COC(=O)C1NCCc2ccccc21 Amb19375544 [0,0,0,1,0,1|0,0,0]=2 3928 B15R2.79765 COC(=O)C1OCCc2ccccc21 Amb1102553 [0,0,0,1,0,1|0,0,0]=2 3929 B15R2.79765 COC(=O)C1SCCc2ccccc21 Amb27172818 [0,0,0,1,0,1|0,0,0]=2 3930 B15R2.79765 COC(=O)[C@H]1CCCc2ccccc21 Amb28192440 [0,0,0,1,0,1|0,0,0]=2 3931 B15R2.79765 COC(=O)[C@H]1NCCc2ccccc21 Amb33803190 [0,0,0,1,0,1|0,0,0]=2 3932 B15R2.79765 NCC(=O)C1CCCc2ccccc21 Amb33380020 [0,0,0,1,0,1|2,0,0]=4 3933 B15R2.79765 NCC(=O)N1CCCc2ccccc21 Amb10610219 [0,0,0,1,0,1|2,0,0]=4 3934 B15R2.79765 NCC(=O)N1CCCc2ccccc21 Amb5783075 [0,0,0,1,0,1|2,0,0]=4 3935 B15R2.79765 NNC(=O)C1CCCc2ccccc21 Amb8999064 [0,0,0,1,0,1|2,0,0]=4 3936 B15R2.79765 NNC(=O)C1NCCc2ccccc21 Amb27417217 [0,0,0,1,0,1|2,0,0]=4 3937 B15R2.79765 O=C(CBr)C1CCCc2ccccc21 Amb27438359 [0,0,0,1,0,1|2,0,0]=4 3938 B15R2.79765 O=C(CBr)C1CCOc2ccccc21 Amb24559718 [0,0,0,1,0,1|2,0,0]=4 3939 B15R2.79765 O=C(CBr)N1CCCc2ccccc21 Amb17325849 [0,0,0,1,0,1|2,0,0]=4 3940 B15R2.79765 O=C(CCl)C1CCCc2ccccc21 Amb27828432 [0,0,0,1,0,1|2,0,0]=4 3941 B15R2.79765 O=C(CCl)N1CCCc2ccccc21 Amb6336213 [0,0,0,1,0,1|2,0,0]=4 3942 B15R2.79765 O=C(CI)N1CCCc2ccccc21 Amb27263362 [0,0,0,1,0,1|2,0,0]=4 3943 B15R2.79765 O=C(CO)N1CCCc2ccccc21 Amb1110643 [0,0,0,1,0,1|2,0,0]=4 3944 B15R2.79765 O=C(CS)N1CCCc2ccccc21 Amb20413874 [0,0,0,1,0,1|2,0,0]=4 3945 B15R2.79765 O=C(NO)C1CCNc2ccccc21 Amb27418137 [0,0,0,1,0,1|2,0,0]=4 3946 B15R2.79765 O=C(NO)C1OCCc2ccccc21 Amb19050925 [0,0,0,1,0,1|2,0,0]=4 3947 B15R2.3 Cc1ccc(C2CCC(=O)CC2)cc1 Amb18066221 [0,1,0,1,0,0|1,0,0]=3 3948 B15R2.3 Cc1ccc(C2CCC(=O)NC2)cc1 Amb17401310 [0,1,0,1,0,0|1,0,0]=3 3949 B15R2.3 Cc1ccc(C2CNC(=O)CN2)cc1 Amb24345915 [0,1,0,1,0,0|2,0,0]=4 3950 B15R2.3 Cc1ccc(C2CNC(=O)CO2)cc1 Amb22643223 [0,1,0,1,0,0|2,0,0]=4 3951 B15R2.3 Cc1ccc(C2CNC(=O)NC2)cc1 Amb27495724 [0,1,0,1,0,0|2,0,0]=4 3952 B15R2.3 Cc1ccc(N2CCC(=O)CC2)cc1 Amb3941168 [0,1,0,1,0,0|2,0,0]=4 3953 B15R2.3 Cc1ccc([C@@H]2CCC(=O)NC2)cc1 Amb27387660 [0,1,0,1,0,0|1,0,0]=3 3954 B15R2.3 Cc1ccc([C@H]2CCC(=O)NC2)cc1 Amb27387661 [0,1,0,1,0,0|1,0,0]=3 3955 B15R2.3 Nc1ccc(C2CNC(=O)CO2)cc1 Amb18863707 [0,1,0,1,0,0|2,0,0]=4 3956 B15R2.3 Nc1ccc(C2CNC(=O)OC2)cc1 Amb18863710 [0,1,0,1,0,0|1,0,0]=3 3957 B15R2.3 Nc1ccc(N2CCC(=O)CC2)cc1 Amb17506931 [0,1,0,1,0,0|2,0,0]=4 3958 B15R2.3 O=C1CCC(c2ccc(Br)cc2)CC1 Amb18584294 [0,1,0,1,0,0|1,0,0]=3 3959 B15R2.3 O=C1CCC(c2ccc(Br)cc2)CN1 Amb17414216 [0,1,0,1,0,0|1,0,0]=3 3960 B15R2.3 O=C1CCC(c2ccc(Cl)cc2)CC1 Amb15690968 [0,1,0,1,0,0|1,0,0]=3 3961 B15R2.3 O=C1CCC(c2ccc(Cl)cc2)CN1 Amb17403929 [0,1,0,1,0,0|1,0,0]=3 3962 B15R2.3 O=C1CCC(c2ccc(F)cc2)CC1 Amb18565089 [0,1,0,1,0,0|1,0,0]=3 3963 B15R2.3 O=C1CCC(c2ccc(F)cc2)CN1 Amb17401718 [0,1,0,1,0,0|1,0,0]=3 3964 B15R2.3 O=C1CCC(c2ccc(F)cc2)NN1 Amb27405374 [0,1,0,1,0,0|2,0,0]=4 3965 B15R2.3 O=C1CCC(c2ccc(O)cc2)CC1 Amb9786651 [0,1,0,1,0,0|1,0,0]=3 3966 B15R2.3 O=C1CCN(c2ccc(Br)cc2)CC1 Amb6259298 [0,1,0,1,0,0|2,0,0]=4 3967 B15R2.3 O=C1CCN(c2ccc(Cl)cc2)CC1 Amb3941166 [0,1,0,1,0,0|2,0,0]=4 3968 B15R2.3 O=C1CCN(c2ccc(F)cc2)CC1 Amb3941165 [0,1,0,1,0,0|2,0,0]=4 3969 B15R2.3 O=C1CNC(c2ccc(Br)cc2)CN1 Amb26039850 [0,1,0,1,0,0|2,0,0]=4 3970 B15R2.3 O=C1CNC(c2ccc(Cl)cc2)CN1 Amb26514102 [0,1,0,1,0,0|2,0,0]=4 3971 B15R2.3 O=C1CNC(c2ccc(F)cc2)CN1 Amb8010281 [0,1,0,1,0,0|2,0,0]=4 3972 B15R2.3 O=C1COC(c2ccc(Br)cc2)CN1 Amb18878768 [0,1,0,1,0,0|2,0,0]=4 3973 B15R2.3 O=C1COC(c2ccc(Cl)cc2)CN1 Amb5380885 [0,1,0,1,0,0|2,0,0]=4 3974 B15R2.3 O=C1COC(c2ccc(F)cc2)CN1 Amb24088726 [0,1,0,1,0,0|2,0,0]=4 3975 B15R2.3 O=C1CO[C@@H](c2ccc(F)cc2)CN1 Amb27406790 [0,1,0,1,0,0|2,0,0]=4 3976 B15R2.3 O=C1CO[C@H](c2ccc(F)cc2)CN1 Amb28139743 [0,1,0,1,0,0|2,0,0]=4 3977 B15R2.3 O=C1NCC(c2ccc(Br)cc2)CN1 Amb25056731 [0,1,0,1,0,0|2,0,0]=4 3978 B15R2.3 O=C1NCC(c2ccc(Cl)cc2)CN1 Amb25029055 [0,1,0,1,0,0|2,0,0]=4 3979 B15R2.3 O=C1NCC(c2ccc(F)cc2)CN1 Amb25048451 [0,1,0,1,0,0|2,0,0]=4 3980 B15R2.98 Cc1ccc(CC2CCC(=O)O2)cc1 Amb27170785 [0,1,0,1,0,0|2,0,0]=4 3981 B15R2.98 Cc1ccc(CC2COC(N)=N2)cc1 Amb27413652 [0,1,0,1,0,0|2,0,0]=4 3982 B15R2.98 Cc1ccc(CN2CCC(=O)C2)cc1 Amb8947965 [0,1,0,1,0,0|2,0,0]=4 3983 B15R2.98 Cc1ccc(NC2CCC(=O)C2)cc1 Amb27471997 [0,1,0,1,0,0|2,0,0]=4 3984 B15R2.98 Cc1ccc(OC2CCC(=O)C2)cc1 Amb27425444 [0,1,0,1,0,0|2,0,0]=4 3985 B15R2.98 NC1=NC(Cc2ccc(F)cc2)CO1 Amb27169139 [0,1,0,1,0,0|2,0,0]=4 3986 B15R2.98 NC1=N[C@@H](Cc2ccc(F)cc2)CO1 Amb28204006 [0,1,0,1,0,0|2,0,0]=4 3987 B15R2.98 Nc1ccc(CC2=CC(=O)OC2)cc1 Amb27240034 [0,1,0,1,0,0|0,0,2]=4 3988 B15R2.98 Nc1ccc(CC2CCC(=O)N2)cc1 Amb18819188 [0,1,0,1,0,0|2,0,0]=4 3989 B15R2.98 Nc1ccc(CC2CNC(=O)O2)cc1 Amb18559562 [0,1,0,1,0,0|2,0,0]=4 3990 B15R2.98 Nc1ccc(CC2CNC(=O)O2)cc1 Amb32662972 [0,1,0,1,0,0|2,0,0]=4 3991 B15R2.98 Nc1ccc(CC2COC(=O)N2)cc1 Amb2613740 [0,1,0,1,0,0|1,0,0]=3 3992 B15R2.98 Nc1ccc(C[C@@H]2COC(=O)N2)cc1 Amb19130394 [0,1,0,1,0,0|1,0,0]=3 3993 B15R2.98 Nc1ccc(C[C@H]2COC(=O)N2)cc1 Amb8392894 [0,1,0,1,0,0|1,0,0]=3 3994 B15R2.98 O=C1CC(Cc2ccc(F)cc2)CN1 Amb27948094 [0,1,0,1,0,0|1,0,0]=3 3995 B15R2.98 O=C1CCC(Cc2ccc(Br)cc2)N1 Amb27632179 [0,1,0,1,0,0|2,0,0]=4 3996 B15R2.98 O=C1CCC(Cc2ccc(Br)cn2)C1 Amb27950480 [0,1,0,1,0,0|2,0,0]=4 3997 B15R2.98 O=C1CCC(Cc2ccc(O)cc2)O1 Amb20668221 [0,1,0,1,0,0|2,0,0]=4 3998 B15R2.98 O=C1CCC(Oc2ccc(Br)cc2)C1 Amb27773903 [0,1,0,1,0,0|2,0,0]=4 3999 B15R2.98 O=C1CCC(Oc2ccc(F)cc2)C1 Amb27474463 [0,1,0,1,0,0|2,0,0]=4 4000 B15R2.98 O=C1CCN(Cc2ccc(Cl)cc2)C1 Amb8948002 [0,1,0,1,0,0|2,0,0]=4 4001 B15R2.98 O=C1CC[C@@H](Cc2ccc(F)cc2)N1 Amb27867363 [0,1,0,1,0,0|2,0,0]=4 4002 B15R2.98 O=C1NC(Cc2ccc(Cl)cc2)CO1 Amb27166135 [0,1,0,1,0,0|1,0,0]=3 4003 B15R2.98 O=C1NC(Cc2ccc(O)cc2)CO1 Amb28399035 [0,1,0,1,0,0|1,0,0]=3 4004 B15R2.98 O=C1NCC(Cc2ccc(Cl)cc2)O1 Amb27487314 [0,1,0,1,0,0|2,0,0]=4 4005 B15R2.98 O=C1NCC(Cc2ccc(F)cc2)O1 Amb27590243 [0,1,0,1,0,0|2,0,0]=4 4006 B15R2.98 O=C1N[C@@H](Cc2ccc(O)cc2)CO1 Amb27760747 [0,1,0,1,0,0|1,0,0]=3 4007 B15R2.1552 Nc1ccc(CCN2CCC2=O)cc1 Amb27250318 [0,1,0,1,0,0|2,0,0]=4 4008 B15R2.1559 COC(=O)C1CC1c2ccc(Cl)cc2 Amb26365721 [0,1,0,1,0,0|0,0,0]=2 4009 B15R2.1559 COC(=O)C1CC1c2ccc(F)cc2 Amb21926928 [0,1,0,1,0,0|0,0,0]=2 4010 B15R2.1559 COC(=O)C1CC1c2ccc(I)cc2 Amb28192446 [0,1,0,1,0,0|0,0,0]=2 4011 B15R2.1559 COC(=O)C1CC1c2ccc(N)cc2 Amb26330059 [0,1,0,1,0,0|0,0,0]=2 4012 B15R2.1559 COC(=O)C1CC1c2ccc(O)cc2 Amb25913526 [0,1,0,1,0,0|0,0,0]=2 4013 B15R2.1559 COC(=O)C1OC1c2ccc(Br)cc2 Amb19930047 [0,1,0,1,0,0|1,0,0]=3 4014 B15R2.1559 COC(=O)C1OC1c2ccc(Cl)cc2 Amb19930052 [0,1,0,1,0,0|1,0,0]=3 4015 B15R2.1559 COC(=O)C1OC1c2ccc(F)cc2 Amb19930055 [0,1,0,1,0,0|1,0,0]=3 4016 B15R2.1559 COC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb25286593 [0,1,0,1,0,0|0,0,0]=2 4017 B15R2.1559 COC(=O)[C@@H]1C[C@H]1c2ccc(N)cc2 Amb26461720 [0,1,0,1,0,0|0,0,0]=2 4018 B15R2.1559 COC(=O)[C@H]1C[C@@H]1c2ccc(N)cc2 Amb27203404 [0,1,0,1,0,0|0,0,0]=2 4019 B15R2.1559 Cc1ccc(C2CC2C(=O)NN)cc1 Amb1935117 [0,1,0,1,0,0|2,0,0]=4 4020 B15R2.1559 Cc1ccc([C@@H]2C[C@H]2C(=O)NN)cc1 Amb32757463 [0,1,0,1,0,0|2,0,0]=4 4021 B15R2.1559 Cc1ccc([C@@H]2C[C@H]2C(=O)NN)cc1 Amb33078443 [0,1,0,1,0,0|2,0,0]=4 4022 B15R2.1559 NNC(=O)C1CC1c2ccc(Cl)cc2 Amb1935066 [0,1,0,1,0,0|2,0,0]=4 4023 B15R2.1559 NNC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb33309612 [0,1,0,1,0,0|2,0,0]=4 4024 B15R2.18933 CC1C(=O)CCC1c2ccc(Br)cc2 Amb30021782 [0,1,0,1,0,0|1,0,0]=3 4025 B15R2.18933 CN1C(=O)CCC1c2ccc(N)nc2 Amb27249615 [0,1,0,1,0,0|2,0,0]=4 4026 B15R2.18933 CN1C(=O)CC[C@H]1C2=CNC(=O)C=C2 Amb27832021 [0,1,0,1,0,0|2,0,0]=4 4027 B15R2.18933 CN1C(=O)NCC1c2ccc(Br)cc2 Amb27953100 [0,1,0,1,0,0|2,0,0]=4 4028 B15R2.18933 CN1C(=O)NCC1c2ccc(Cl)cc2 Amb27466242 [0,1,0,1,0,0|2,0,0]=4 4029 B15R2.18933 CN1C(=O)NCC1c2ccc(F)cc2 Amb26383906 [0,1,0,1,0,0|2,0,0]=4 4030 B15R2.18933 Cc1ccc(C2CNC(=O)C2C)cc1 Amb27646546 [0,1,0,1,0,0|2,0,0]=4 4031 B15R2.18933 Cc1ccc(C2CNC(=O)N2C)cc1 Amb26465169 [0,1,0,1,0,0|2,0,0]=4 4032 B15R2.50022 CC1C(=O)NCCc2ccc(F)cc21 Amb28040970 [0,1,0,1,0,0|2,0,0]=4 4033 B15R2.50022 CN1C(=O)CCCC2=CNC(=O)C=C21 Amb33715291 [0,1,0,1,0,0|2,0,0]=4 4034 B15R2.50022 CN1C(=O)CCCc2ccc(N)cc21 Amb26847073 [0,1,0,1,0,0|1,0,0]=3 4035 B15R2.50022 CN1C(=O)CCNc2ccc(F)cc21 Amb19337048 [0,1,0,1,0,0|2,0,0]=4 4036 B15R2.50022 CN1C(=O)CCOc2ccc(Br)cc21 Amb17573804 [0,1,0,1,0,0|2,0,0]=4 4037 B15R2.50022 CN1C(=O)CCOc2ccc(Cl)cc21 Amb17571354 [0,1,0,1,0,0|2,0,0]=4 4038 B15R2.50022 CN1C(=O)CCOc2ccc(F)cc21 Amb17570727 [0,1,0,1,0,0|2,0,0]=4 4039 B15R2.50022 CN1C(=O)CCOc2ccc(N)cc21 Amb17570650 [0,1,0,1,0,0|2,0,0]=4 4040 B15R2.50022 CN1C(=O)CCOc2ccc(O)cc21 Amb18894292 [0,1,0,1,0,0|2,0,0]=4 4041 B15R2.50022 CN1C(=O)CCOc2ccc(S)cc21 Amb25320526 [0,1,0,1,0,0|2,0,0]=4 4042 B15R2.50022 Cc1ccc2c(c1)N(C)C(=O)CCO2 Amb17570550 [0,1,0,1,0,0|2,0,0]=4 4043 B15R2.79417 CCC(=O)N1CCc2ccc(N)cc21 Amb6683061 [0,1,0,1,0,0|2,0,0]=4 4044 B15R2.79417 CNC(=O)N1CCc2ccc(N)cc21 Amb25044621 [0,1,0,1,0,0|2,0,0]=4 4045 B15R2.79417 COC(=O)C1C=Nc2ccc(Br)cc21 Amb24053157 [0,1,0,1,0,0|1,0,1]=4 4046 B15R2.79417 COC(=O)C1CCc2ccc(Cl)cc21 Amb22501000 [0,1,0,1,0,0|0,0,0]=2 4047 B15R2.79417 COC(=O)C1CCc2ccc(Cl)nc21 Amb27495698 [0,1,0,1,0,0|1,0,0]=3 4048 B15R2.79417 COC(=O)C1CCc2ncc(Cl)cc21 Amb27640366 [0,1,0,1,0,0|1,0,0]=3 4049 B15R2.79417 COC(=O)C1CNc2ccc(Br)cc21 Amb35747821 [0,1,0,1,0,0|1,0,0]=3 4050 B15R2.79417 COC(=O)C1CNc2ccc(Br)cc21 Amb35749605 [0,1,0,1,0,0|1,0,0]=3 4051 B15R2.79417 COC(=O)C1COc2ccc(Br)cc21 Amb28565787 [0,1,0,1,0,0|1,0,0]=3 4052 B15R2.79417 COC(=O)C1COc2ccc(C)cc21 Amb26481867 [0,1,0,1,0,0|1,0,0]=3 4053 B15R2.79417 COC(=O)C1COc2ccc(Cl)cc21 Amb26040041 [0,1,0,1,0,0|1,0,0]=3 4054 B15R2.79417 COC(=O)C1COc2ccc(F)cc21 Amb25884670 [0,1,0,1,0,0|1,0,0]=3 4055 B15R2.79417 COC(=O)C1CSc2ccc(Cl)cc21 Amb27826300 [0,1,0,1,0,0|1,0,0]=3 4056 B15R2.81086 COC(=O)CC1Cc2ccc(O)cc21 Amb28409124 [0,1,0,1,0,0|0,0,0]=2 4057 B15R2.81086 COC(=O)C[C@H]1Cc2ccc(O)cc21 Amb27749788 [0,1,0,1,0,0|0,0,0]=2 4058 B15R2.1 COC1CCC(c2ccccc2)NC1 Amb27451501 [0,1,0,1,0,0|1,0,1]=4 4059 B15R2.1 N#CC1=CCC(c2ccccc2)CC1 Amb26353139 [0,1,0,1,0,0|2,0,0]=4 4060 B15R2.1 O=CC1CCC(c2ccccc2)CC1 Amb8385979 [0,1,0,1,0,0|1,0,1]=4 4061 B15R2.1 O=NN1CCC(c2ccccc2)CC1 Amb25663908 [0,1,0,1,0,0|2,0,0]=4 4062 B15R2.1 OCC1CCC(c2ccccc2)CO1 Amb28190338 [0,1,0,1,0,0|0,0,2]=4 4063 B15R2.1 ON=C1CCC(c2ccccc2)CC1 Amb3862148 [0,1,0,1,0,0|1,0,1]=4 4064 B15R2.1 [C-]#[N+]C1=CCC(c2ccccc2)CC1 Amb22265799 [0,1,0,1,0,0|2,0,0]=4 4065 B15R2.94 CC1CN(c2ccccc2)CCC1=O Amb19060570 [0,1,0,1,0,0|2,0,0]=4 4066 B15R2.94 CC1NC(c2ccccc2)COC1=O Amb27816287 [0,1,0,1,0,0|1,0,0]=3 4067 B15R2.94 CC1N[C@H](c2ccccc2)COC1=O Amb28340764 [0,1,0,1,0,0|1,0,0]=3 4068 B15R2.94 CN1CC(c2ccccc2)NCC1=O Amb24397048 [0,1,0,1,0,0|2,0,0]=4 4069 B15R2.94 NC1CC(c2ccccc2)CCC1=O Amb18279407 [0,1,0,1,0,0|1,0,0]=3 4070 B15R2.94 NC1CC(c2ccccc2)CNC1=O Amb27166973 [0,1,0,1,0,0|1,0,0]=3 4071 B15R2.94 O=C1CCC(c2ccccc2)CC1=O Amb27971467 [0,1,0,1,0,0|1,0,0]=3 4072 B15R2.94 O=C1CCC(c2ccccc2)CC1Br Amb22263458 [0,1,0,1,0,0|1,0,0]=3 4073 B15R2.94 O=C1CCC(c2ccccc2)CC1F Amb32656343 [0,1,0,1,0,0|1,0,0]=3 4074 B15R2.94 O=C1CCC(c2ccccc2)CC1O Amb28288866 [0,1,0,1,0,0|1,0,0]=3 4075 B15R2.94 O=C1CC[C@@H](c2ccccc2)C[C@@H]1Cl Amb28401413 [0,1,0,1,0,0|1,0,0]=3 4076 B15R2.94 O=C1CC[C@H](c2ccccc2)C[C@@H]1Cl Amb27782396 [0,1,0,1,0,0|1,0,0]=3 4077 B15R2.94 O=C1NNC(c2ccccc2)CC1Cl Amb27836744 [0,1,0,1,0,0|2,0,0]=4 4078 B15R2.94 O=C1OCC(c2ccccc2)NC1=S Amb27666377 [0,1,0,1,0,0|1,0,1]=4 4079 B15R2.96 CC1(c2ccccc2)C=CC(=O)CC1 Amb4019944 [0,1,0,1,0,0|1,0,1]=4 4080 B15R2.96 CC1(c2ccccc2)CCC(=O)CC1 Amb22229848 [0,1,0,1,0,0|1,0,0]=3 4081 B15R2.96 CC1(c2ccccc2)CCC(=O)NC1 Amb4010694 [0,1,0,1,0,0|1,0,0]=3 4082 B15R2.96 CC1(c2ccccc2)CNC(=O)CN1 Amb27782081 [0,1,0,1,0,0|2,0,0]=4 4083 B15R2.96 CC1CCC(O)(c2ccccc2)CO1 Amb30011456 [0,1,0,1,0,0|1,0,1]=4 4084 B15R2.96 NC1(c2ccccc2)CCC(=O)CC1 Amb23589797 [0,1,0,1,0,0|1,0,0]=3 4085 B15R2.96 O=C1CCC(F)(c2ccccn2)CC1 Amb27390568 [0,1,0,1,0,0|2,0,0]=4 4086 B15R2.96 O=C1CCC(F)(c2ccncc2)CC1 Amb28437189 [0,1,0,1,0,0|2,0,0]=4 4087 B15R2.96 O=C1CCC(O)(c2ccccc2)CC1 Amb20248191 [0,1,0,1,0,0|1,0,0]=3 4088 B15R2.96 O=C1CCC(O)(c2cccnc2)CC1 Amb26483929 [0,1,0,1,0,0|2,0,0]=4 4089 B15R2.297 CC(c1ccccc1)C2CC(=O)CO2 Amb35693012 [0,1,0,1,0,0|2,0,0]=4 4090 B15R2.297 CC(c1ccccc1)C2CC(=O)NN2 Amb35701214 [0,1,0,1,0,0|2,0,0]=4 4091 B15R2.297 CC(c1ccccc1)C2CNC(=O)C2 Amb25067874 [0,1,0,1,0,0|1,0,0]=3 4092 B15R2.297 CC(c1ccccc1)C2CNC(=O)O2 Amb25037772 [0,1,0,1,0,0|2,0,0]=4 4093 B15R2.297 CC(c1ccccc1)C2COC(=O)N2 Amb26311941 [0,1,0,1,0,0|1,0,0]=3 4094 B15R2.297 CC(c1ccccc1)C2COC(N)=N2 Amb27747068 [0,1,0,1,0,0|2,0,0]=4 4095 B15R2.297 CC(c1ccccc1)N2CCC(=O)C2 Amb8947951 [0,1,0,1,0,0|2,0,0]=4 4096 B15R2.297 CC1CC(C(O)c2ccccc2)CO1 Amb27595702 [0,1,0,1,0,0|1,0,1]=4 4097 B15R2.297 C[C@@H](c1ccccc1)N2CCC(=O)C2 Amb8386518 [0,1,0,1,0,0|2,0,0]=4 4098 B15R2.297 NC(C1=NOC(=O)C1)c2ccccc2 Amb27495694 [0,1,0,1,0,0|1,0,1]=4 4099 B15R2.297 N[C@@H](c1ccccc1)[C@@H]2COC(=O)N2 Amb27419865 [0,1,0,1,0,0|1,0,0]=3 4100 B15R2.297 N[C@@H](c1ccccc1)[C@H]2CCC(=O)O2 Amb27635861 [0,1,0,1,0,0|2,0,0]=4 4101 B15R2.297 N[C@H](c1ccccc1)[C@@H]2COC(=O)N2 Amb27419863 [0,1,0,1,0,0|1,0,0]=3 4102 B15R2.297 O=C1CC(C(=O)c2ccccc2)CN1 Amb27439611 [0,1,0,1,0,0|1,0,1]=4 4103 B15R2.297 O=C1CC(C(=O)c2ccccc2)CO1 Amb2730333 [0,1,0,1,0,0|0,0,1]=3 4104 B15R2.297 O=C1CCC(C(O)c2ccccc2)O1 Amb26050077 [0,1,0,1,0,0|2,0,0]=4 4105 B15R2.297 O=C1CC[C@@H]([C@@H](O)c2ccccc2)N1 Amb27797355 [0,1,0,1,0,0|2,0,0]=4 4106 B15R2.297 O=C1CC[C@@H]([C@@H](O)c2ccccc2)O1 Amb28053803 [0,1,0,1,0,0|2,0,0]=4 4107 B15R2.297 O=C1CC[C@H]([C@@H](O)c2ccccc2)O1 Amb27849013 [0,1,0,1,0,0|2,0,0]=4 4108 B15R2.297 O=C1NC(C(=O)c2ccccc2)CO1 Amb27831242 [0,1,0,1,0,0|1,0,1]=4 4109 B15R2.297 O=C1NC(C(Cl)c2ccccc2)CO1 Amb28068885 [0,1,0,1,0,0|1,0,0]=3 4110 B15R2.297 O=C1N[C@H](C(O)c2ccccc2)CO1 Amb28408797 [0,1,0,1,0,0|1,0,0]=3 4111 B15R2.297 O=C1N[C@H]([C@@H](Cl)c2ccccc2)CO1 Amb27636941 [0,1,0,1,0,0|1,0,0]=3 4112 B15R2.297 O=C1N[C@H]([C@H](Cl)c2ccccc2)CO1 Amb28053687 [0,1,0,1,0,0|1,0,0]=3 4113 B15R2.1130 O=C(N[C@H]1COC1=O)c2ccccc2 Amb28251179 [0,1,0,1,0,0|1,0,1]=4 4114 B15R2.1596 CCC(=O)C1CC(c2ccccc2)C1 Amb35733978 [0,1,0,1,0,0|1,0,0]=3 4115 B15R2.6783 COC1=NC(C)(c2ccccc2)CN1 Amb27588055 [0,1,0,1,0,0|2,0,0]=4 4116 B15R2.7221 CN1C(=O)CCC1(O)c2ccccc2 Amb2424191 [0,1,0,1,0,0|1,0,0]=3 4117 B15R2.7221 CN1C(=O)CCC1(O)c2cccnc2 Amb27235340 [0,1,0,1,0,0|2,0,0]=4 4118 B15R2.7340 CC1NCC(=O)N(C)c2ccccc21 Amb25801815 [0,1,0,1,0,0|2,0,0]=4 4119 B15R2.7343 O=C1CCc2ccccc2C(O)CC1 Amb28453464 [0,1,0,1,0,0|1,0,0]=3 4120 B15R2.19346 COC(=O)C1OC1(C)c2ccccc2 Amb24066728 [0,1,0,1,0,0|1,0,0]=3 4121 B15R2.23388 CNC(=O)C1CC(=O)c2ccccc21 Amb17470705 [0,1,0,1,0,0|1,0,1]=4 4122 B15R2.23388 CNC(=O)C1CN(C)c2ccccc21 Amb27873409 [0,1,0,1,0,0|2,0,0]=4 4123 B15R2.23388 CNC(=O)N1CC(C)c2ccccc21 Amb27455577 [0,1,0,1,0,0|2,0,0]=4 4124 B15R2.23388 COC(=O)C1CC(=O)c2ccccc21 Amb17755304 [0,1,0,1,0,0|0,0,1]=3 4125 B15R2.23388 COC(=O)C1CC(N)c2ccccc21 Amb18650818 [0,1,0,1,0,0|0,0,0]=2 4126 B15R2.23388 COC(=O)C1CC(N)c2ccccc21 Amb32409868 [0,1,0,1,0,0|0,0,0]=2 4127 B15R2.23388 COC(=O)C1NC(=O)c2ccccc21 Amb26495102 [0,1,0,1,0,0|1,0,1]=4 4128 B15R2.23388 COC(=O)N1CC(=O)c2ccccc21 Amb27417365 [0,1,0,1,0,0|1,0,1]=4 4129 B15R2.23388 COC(=O)N1CC(C)c2ccccc21 Amb28343916 [0,1,0,1,0,0|1,0,0]=3 4130 B15R2.23388 COC(=O)[C@@H]1C[C@H](N)c2ccccc21 Amb24512057 [0,1,0,1,0,0|0,0,0]=2 4131 B15R2.23388 COC(=O)[C@@H]1C[C@H](N)c2ccccc21 Amb2696642 [0,1,0,1,0,0|0,0,0]=2 4132 B15R2.23388 COC(=O)[C@@H]1O[C@@H](O)c2ccccc21 Amb27230496 [0,1,0,1,0,0|1,0,0]=3 4133 B15R2.23388 COC(=O)[C@@H]1O[C@H](O)c2ccccc21 Amb27194346 [0,1,0,1,0,0|1,0,0]=3 4134 B15R2.23388 COC(=O)[C@H]1C[C@H](N)c2ccccc21 Amb27492924 [0,1,0,1,0,0|0,0,0]=2 4135 B15R2.467 O=S1(=O)CCC(c2ccccc2)CN1 Amb27783062 [0,1,0,1,0,0|2,0,0]=4 4136 B15R2.2291 CNS(=O)(=O)C1CCc2ccccc21 Amb32692002 [0,1,0,1,0,0|2,0,0]=4 4137 B15R2.5228 O=C[C@]1(COCc2ccccc2)CO1 Amb27182451 [0,1,0,1,0,0|1,0,1]=4 4138 B15R2.31 C=C1CCNC(Cc2ccccc2)C1 Amb18649678 [0,1,0,1,0,0|2,0,0]=4 4139 B15R2.31 O=C1C=CCN(Cc2ccccc2)C1 Amb27611795 [0,1,0,1,0,0|2,0,0]=4 4140 B15R2.31 O=C1C=CNC(Cc2ccccc2)C1 Amb27866268 [0,1,0,1,0,0|1,0,1]=4 4141 B15R2.31 O=C1CC(Cc2ccccc2)CCN1 Amb25835625 [0,1,0,1,0,0|1,0,0]=3 4142 B15R2.31 O=C1CC(Cc2ccccc2)CCO1 Amb27963030 [0,1,0,1,0,0|0,0,0]=2 4143 B15R2.31 O=C1CCCC(Nc2ccccc2)C1 Amb27791842 [0,1,0,1,0,0|2,0,0]=4 4144 B15R2.31 O=C1CCCC(Sc2ccccc2)C1 Amb25123623 [0,1,0,1,0,0|2,0,0]=4 4145 B15R2.31 O=C1CCCN(Cc2ccccc2)C1 Amb2691209 [0,1,0,1,0,0|2,0,0]=4 4146 B15R2.31 O=C1CCCN(Cc2ccccc2)C1 Amb2695152 [0,1,0,1,0,0|2,0,0]=4 4147 B15R2.31 O=C1CCCN(Cc2ccccc2)C1 Amb6365418 [0,1,0,1,0,0|2,0,0]=4 4148 B15R2.31 O=C1CCNC(Cc2ccccc2)C1 Amb28457239 [0,1,0,1,0,0|1,0,0]=3 4149 B15R2.31 O=C1CCOC(Cc2ccccc2)C1 Amb27746791 [0,1,0,1,0,0|1,0,0]=3 4150 B15R2.31 O=C1CN(Cc2ccccc2)CCN1 Amb8630718 [0,1,0,1,0,0|2,0,0]=4 4151 B15R2.31 O=C1CN(Cc2ccccc2)CCO1 Amb22490281 [0,1,0,1,0,0|1,0,0]=3 4152 B15R2.31 O=C1CNCC(Cc2ccccc2)N1 Amb27748147 [0,1,0,1,0,0|2,0,0]=4 4153 B15R2.31 O=C1CNC[C@@H](Cc2ccccc2)N1 Amb26019569 [0,1,0,1,0,0|2,0,0]=4 4154 B15R2.31 O=C1CNC[C@@H](Cc2ccccc2)N1 Amb32434776 [0,1,0,1,0,0|2,0,0]=4 4155 B15R2.31 O=C1CNC[C@H](Cc2ccccc2)N1 Amb25791537 [0,1,0,1,0,0|2,0,0]=4 4156 B15R2.31 O=C1CNC[C@H](Cc2ccccc2)N1 Amb32434778 [0,1,0,1,0,0|2,0,0]=4 4157 B15R2.31 O=C1CNC[C@H](Cc2ccccc2)O1 Amb27387011 [0,1,0,1,0,0|2,0,0]=4 4158 B15R2.31 O=C1COCC(Cc2ccccc2)N1 Amb21864802 [0,1,0,1,0,0|1,0,0]=3 4159 B15R2.31 O=C1COC[C@@H](Cc2ccccc2)N1 Amb25082881 [0,1,0,1,0,0|1,0,0]=3 4160 B15R2.31 O=C1COC[C@H](Cc2ccccc2)N1 Amb25725966 [0,1,0,1,0,0|1,0,0]=3 4161 B15R2.31 O=C1NC(Cc2ccccc2)CCO1 Amb8392176 [0,1,0,1,0,0|1,0,0]=3 4162 B15R2.31 O=C1NNCC(Cc2ccccc2)N1 Amb28203971 [0,1,0,1,0,0|2,0,0]=4 4163 B15R2.31 OC1CC(Cc2ccccc2)CCO1 Amb28350051 [0,1,0,1,0,0|0,0,2]=4 4164 B15R2.55 BrC1COCC1CCc2ccccc2 Amb35590030 [0,1,0,1,0,0|1,0,1]=4 4165 B15R2.55 ClC1COCC1CCc2ccccc2 Amb35589945 [0,1,0,1,0,0|1,0,1]=4 4166 B15R2.55 NC1COCC1CCc2ccccc2 Amb29882724 [0,1,0,1,0,0|1,0,1]=4 4167 B15R2.55 O=C1CCCC1CCc2ccccc2 Amb4358591 [0,1,0,1,0,0|1,0,0]=3 4168 B15R2.55 O=C1CCCC1NCc2ccccc2 Amb28252302 [0,1,0,1,0,0|2,0,0]=4 4169 B15R2.55 O=C1CCCC1OCc2ccccc2 Amb28072515 [0,1,0,1,0,0|2,0,0]=4 4170 B15R2.55 O=C1CCCC1SCc2ccccc2 Amb9216281 [0,1,0,1,0,0|2,0,0]=4 4171 B15R2.55 O=C1CCCN1CCc2ccccc2 Amb996223 [0,1,0,1,0,0|2,0,0]=4 4172 B15R2.55 O=C1CCC[C@@H]1CNc2ccccc2 Amb27658726 [0,1,0,1,0,0|2,0,0]=4 4173 B15R2.55 O=C1CNCN1CCc2ccccc2 Amb27808698 [0,1,0,1,0,0|2,0,0]=4 4174 B15R2.55 O=C1COCC1CCc2ccccc2 Amb35608085 [0,1,0,1,0,0|0,0,0]=2 4175 B15R2.55 O=C1CSCC1CCc2ccccn2 Amb27753834 [0,1,0,1,0,0|1,1,0]=4 4176 B15R2.55 O=C1CSCC1CCc2cccnc2 Amb27949363 [0,1,0,1,0,0|1,1,0]=4 4177 B15R2.55 O=C1NCCC1CCc2ccccc2 Amb25227286 [0,1,0,1,0,0|1,0,0]=3 4178 B15R2.55 O=C1NCCC1CCc2ccccn2 Amb27811757 [0,1,0,1,0,0|2,0,0]=4 4179 B15R2.55 O=C1NCCC1CCc2cccnc2 Amb27644996 [0,1,0,1,0,0|2,0,0]=4 4180 B15R2.55 O=C1NCCC1CCc2ccncc2 Amb27214041 [0,1,0,1,0,0|2,0,0]=4 4181 B15R2.55 O=C1NCCC1OCc2ccccc2 Amb27850616 [0,1,0,1,0,0|2,0,0]=4 4182 B15R2.55 O=C1NCCN1CCc2ccccc2 Amb27171892 [0,1,0,1,0,0|2,0,0]=4 4183 B15R2.55 O=C1OCC=C1NCc2ccccc2 Amb28193721 [0,1,0,1,0,0|1,0,1]=4 4184 B15R2.55 O=C1OCC[C@@H]1NCc2ccccc2 Amb27256157 [0,1,0,1,0,0|1,0,0]=3 4185 B15R2.55 O=C1SCCC1NCc2ccccc2 Amb27261344 [0,1,0,1,0,0|1,1,0]=4 4186 B15R2.55 OC1COCC1CCc2ccccc2 Amb35646933 [0,1,0,1,0,0|0,0,2]=4 4187 B15R2.73 C=C(CCN)C1CCc2ccccc21 Amb33144616 [0,1,0,1,0,0|2,0,0]=4 4188 B15R2.73 CCCC(=O)C1COc2ccccc21 Amb27882229 [0,1,0,1,0,0|2,0,0]=4 4189 B15R2.73 CCCC(=O)N1CCc2ccccc21 Amb3374200 [0,1,0,1,0,0|2,0,0]=4 4190 B15R2.73 CCNC(=O)C1CSc2ccccc21 Amb27411711 [0,1,0,1,0,0|2,0,0]=4 4191 B15R2.73 CCNC(=O)C1NCc2ccccc21 Amb27749344 [0,1,0,1,0,0|2,0,0]=4 4192 B15R2.73 CCOC(=N)C1COc2ccccc21 Amb28347480 [0,1,0,1,0,0|2,0,0]=4 4193 B15R2.73 CCOC(=O)C1=CCc2ccccc21 Amb28315180 [0,1,0,1,0,0|0,0,2]=4 4194 B15R2.73 CCOC(=O)C1CCc2ccccc21 Amb26864787 [0,1,0,1,0,0|0,0,0]=2 4195 B15R2.73 CCOC(=O)C1CNc2ccccc21 Amb22276114 [0,1,0,1,0,0|1,0,0]=3 4196 B15R2.73 CCOC(=O)C1CNc2ccccc21 Amb25775070 [0,1,0,1,0,0|1,0,0]=3 4197 B15R2.73 CCOC(=O)C1COc2ccccc21 Amb22059418 [0,1,0,1,0,0|1,0,0]=3 4198 B15R2.73 CCOC(=O)C1NCc2ccccc21 Amb27239689 [0,1,0,1,0,0|1,0,0]=3 4199 B15R2.73 CCOC(=O)C1OCc2ccccc21 Amb27200681 [0,1,0,1,0,0|1,0,0]=3 4200 B15R2.73 CCOC(=O)N1CCc2ccccc21 Amb6370493 [0,1,0,1,0,0|1,0,0]=3 4201 B15R2.73 CCSC(=O)N1CCc2ccccc21 Amb28075646 [0,1,0,1,0,0|1,1,0]=4 4202 B15R2.73 CNCC(=O)C1CCc2ccccc21 Amb33146107 [0,1,0,1,0,0|1,0,0]=3 4203 B15R2.73 CNCC(=O)N1CCc2ccccc21 Amb17712322 [0,1,0,1,0,0|2,0,0]=4 4204 B15R2.73 COCC(=O)N1CCc2ccccc21 Amb8326207 [0,1,0,1,0,0|1,0,0]=3 4205 B15R2.73 COCC(N)C1CCc2ccccc21 Amb27747635 [0,1,0,1,0,0|1,0,1]=4 4206 B15R2.73 COCC(O)C1CCc2ccccc21 Amb27747587 [0,1,0,1,0,0|0,0,2]=4 4207 B15R2.73 CONC(=O)C1CNc2ccccc21 Amb28248840 [0,1,0,1,0,0|1,0,0]=3 4208 B15R2.73 CSCC(=O)C1CCc2cccnc21 Amb27436432 [0,1,0,1,0,0|1,1,0]=4 4209 B15R2.73 CSCC(=O)N1CCc2ccccc21 Amb8309669 [0,1,0,1,0,0|1,1,0]=4 4210 B15R2.73 C\C=C\C(=O)N1CCc2ccccc21 Amb27182355 [0,1,0,1,0,0|2,0,0]=4 4211 B15R2.73 NCCC(=O)C1CCc2ccccc21 Amb33146111 [0,1,0,1,0,0|1,0,0]=3 4212 B15R2.73 NCCC(=O)C1CCc2cccnc21 Amb27468319 [0,1,0,1,0,0|2,0,0]=4 4213 B15R2.73 NCCC(=O)N1CCc2ccccc21 Amb1133951 [0,1,0,1,0,0|2,0,0]=4 4214 B15R2.73 NCCC(=O)N1CCc2ccccc21 Amb15741007 [0,1,0,1,0,0|2,0,0]=4 4215 B15R2.73 O=C(CCBr)N1CCc2ccccc21 Amb17332660 [0,1,0,1,0,0|2,0,0]=4 4216 B15R2.73 O=C(CCCl)N1CCc2ccccc21 Amb1106290 [0,1,0,1,0,0|2,0,0]=4 4217 B15R2.73 O=C(CCO)N1CCc2ccccc21 Amb17336306 [0,1,0,1,0,0|2,0,0]=4 4218 B15R2.73 O=C(OCCl)N1CCc2ccccc21 Amb35628897 [0,1,0,1,0,0|1,0,0]=3 4219 B15R2.132 COC1C(=O)NC1Cc2ccccc2 Amb28190634 [0,1,0,1,0,0|1,0,0]=3 4220 B15R2.132 CS[C@@H]1C(=O)N[C@H]1Cc2ccccc2 Amb27784887 [0,1,0,1,0,0|1,1,0]=4 4221 B15R2.236 CCN1C(=O)CCNc2ccccc21 Amb2657810 [0,1,0,1,0,0|2,0,0]=4 4222 B15R2.236 CCN1C(=O)CNCc2ccccc21 Amb28256259 [0,1,0,1,0,0|2,0,0]=4 4223 B15R2.236 COC1c2ccccc2CCCC1O Amb28344885 [0,1,0,1,0,0|0,0,2]=4 4224 B15R2.236 CO[C@H]1c2ccccc2CCC[C@@H]1O Amb27970907 [0,1,0,1,0,0|0,0,2]=4 4225 B15R2.325 C=C1OC(=O)NC1Cc2ccccc2 Amb28074032 [0,1,0,1,0,0|1,0,1]=4 4226 B15R2.325 CC1CC(=O)CN1Cc2ccccc2 Amb20668026 [0,1,0,1,0,0|2,0,0]=4 4227 B15R2.325 CC1OC(N)=NC1Cc2ccccc2 Amb27226049 [0,1,0,1,0,0|2,0,0]=4 4228 B15R2.325 C[C@@H]1OC(=O)N[C@H]1Cc2ccccc2 Amb27970872 [0,1,0,1,0,0|1,0,0]=3 4229 B15R2.325 C[C@H]1OC(=O)N[C@@H]1Cc2ccccc2 Amb27841327 [0,1,0,1,0,0|1,0,0]=3 4230 B15R2.325 C[C@H]1OC(=O)N[C@H]1Cc2ccccc2 Amb27816387 [0,1,0,1,0,0|1,0,0]=3 4231 B15R2.325 O=C1CC(Cc2ccccc2)C(=O)N1 Amb17470703 [0,1,0,1,0,0|1,0,1]=4 4232 B15R2.325 O=C1CC(Cc2ccccc2)C(=O)O1 Amb2775768 [0,1,0,1,0,0|0,0,1]=3 4233 B15R2.325 O=C1CC(Cc2cccnc2)C(=O)O1 Amb19108564 [0,1,0,1,0,0|1,0,1]=4 4234 B15R2.325 O=C1CC(O)C(Cc2ccccc2)N1 Amb28132724 [0,1,0,1,0,0|2,0,0]=4 4235 B15R2.325 O=C1C[C@H](Cc2ccccc2)C(=O)O1 Amb22226487 [0,1,0,1,0,0|0,0,1]=3 4236 B15R2.325 O=C1NC(Cc2ccccc2)C(=O)O1 Amb22496991 [0,1,0,1,0,0|1,0,1]=4 4237 B15R2.325 O=C1N[C@@H](Cc2ccccc2)C(=O)O1 Amb2684643 [0,1,0,1,0,0|1,0,1]=4 4238 B15R2.325 O=C1N[C@H](Cc2ccccc2)C(=O)O1 Amb2684642 [0,1,0,1,0,0|1,0,1]=4 4239 B15R2.389 C=C1CCC(c2ccccc2)C(O)C1 Amb27207421 [0,1,0,1,0,0|2,0,0]=4 4240 B15R2.389 CC1=C[C@@H](O)[C@H](c2ccccc2)CC1 Amb27432095 [0,1,0,1,0,0|2,0,0]=4 4241 B15R2.389 CC1=C[C@H](O)[C@H](c2ccccc2)CC1 Amb28079133 [0,1,0,1,0,0|2,0,0]=4 4242 B15R2.389 CC1CC(=O)NCC1c2ccccc2 Amb27957602 [0,1,0,1,0,0|1,0,0]=3 4243 B15R2.389 CC1NC(=O)COC1c2ccccc2 Amb26415215 [0,1,0,1,0,0|2,0,0]=4 4244 B15R2.389 C[C@@H]1NC(=O)CO[C@H]1c2ccccc2 Amb24356808 [0,1,0,1,0,0|2,0,0]=4 4245 B15R2.389 C[C@H]1NC(=O)CO[C@H]1c2ccccc2 Amb27841325 [0,1,0,1,0,0|2,0,0]=4 4246 B15R2.389 NC1=CC(=O)CCC1c2ccccc2 Amb27386907 [0,1,0,1,0,0|1,0,1]=4 4247 B15R2.389 O=C1CCC(c2ccccc2)C(=O)C1 Amb27862150 [0,1,0,1,0,0|1,0,1]=4 4248 B15R2.389 O=C1CCC(c2ccccc2)C(=O)N1 Amb17470704 [0,1,0,1,0,0|1,0,1]=4 4249 B15R2.389 O=C1CCC(c2ccccc2)C(=O)O1 Amb8513293 [0,1,0,1,0,0|0,0,1]=3 4250 B15R2.389 O=C1CCC(c2ccccn2)C(=O)O1 Amb25997748 [0,1,0,1,0,0|1,0,1]=4 4251 B15R2.389 O=C1CCC(c2cccnc2)C(=O)O1 Amb26876501 [0,1,0,1,0,0|1,0,1]=4 4252 B15R2.389 O=C1CCC(c2ccncc2)C(=O)O1 Amb25850205 [0,1,0,1,0,0|1,0,1]=4 4253 B15R2.389 O=C1CC[C@H](c2ccccc2)C(=O)N1 Amb27200277 [0,1,0,1,0,0|1,0,1]=4 4254 B15R2.1151 C[C@@H]1NC(=O)[C@@H]1OCc2ccccc2 Amb28203988 [0,1,0,1,0,0|2,0,0]=4 4255 B15R2.1291 CO\N=C1\CCSc2ccccc2N1 Amb28185835 [0,1,0,1,0,0|2,0,0]=4 4256 B15R2.1342 CCNC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb27841339 [0,1,0,1,0,0|1,0,0]=3 4257 B15R2.1342 CCNC(=O)[C@H]1C[C@H]1c2ccccc2 Amb28318863 [0,1,0,1,0,0|1,0,0]=3 4258 B15R2.1342 CCOC(=O)C1CC1c2ccccc2 Amb2610679 [0,1,0,1,0,0|0,0,0]=2 4259 B15R2.1342 CCOC(=O)C1CC1c2cccnc2 Amb22000947 [0,1,0,1,0,0|1,0,0]=3 4260 B15R2.1342 CCOC(=O)C1CC1c2ncccn2 Amb35826263 [0,1,0,1,0,0|2,0,0]=4 4261 B15R2.1342 CCOC(=O)C1OC1c2ccccc2 Amb6356367 [0,1,0,1,0,0|1,0,0]=3 4262 B15R2.1342 CCOC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb10075604 [0,1,0,1,0,0|0,0,0]=2 4263 B15R2.1342 CCOC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb33523702 [0,1,0,1,0,0|0,0,0]=2 4264 B15R2.1342 CCOC(=O)[C@@H]1C[C@H]1c2ccncc2 Amb32684556 [0,1,0,1,0,0|1,0,0]=3 4265 B15R2.1342 C\C=C\C(=O)C1CC1c2ccccc2 Amb28367862 [0,1,0,1,0,0|1,0,0]=3 4266 B15R2.1342 O=C(\C=C\Cl)C1CC1c2ccccc2 Amb35628785 [0,1,0,1,0,0|1,0,1]=4 4267 B15R2.1342 [N-]=[N+]=NC(=O)C1CC1c2ccccc2 Amb27873256 [0,1,0,1,0,0|2,0,0]=4 4268 B15R2.1342 [N-]=[N+]=NC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb27640661 [0,1,0,1,0,0|2,0,0]=4 4269 B15R2.2196 c1ccc(CCCC2OCCO2)cc1 Amb27988562 [0,1,0,1,0,0|0,0,2]=4 4270 B15R2.2349 CCN1C(=O)CCC1c2ccccn2 Amb27184585 [0,1,0,1,0,0|2,0,0]=4 4271 B15R2.2349 CCN1C(=O)CCC1c2cccnc2 Amb17614139 [0,1,0,1,0,0|2,0,0]=4 4272 B15R2.2349 CCN1C(=O)CNC1c2ccccc2 Amb27654887 [0,1,0,1,0,0|2,0,0]=4 4273 B15R2.2349 CCN1C(=O)CSC1c2ccccc2 Amb24511052 [0,1,0,1,0,0|2,0,0]=4 4274 B15R2.2349 CN[C@H]1C(=O)NC[C@H]1c2ccccc2 Amb28135455 [0,1,0,1,0,0|2,0,0]=4 4275 B15R2.16438 O=C(CCOc1ccccc1)C2CC2 Amb17139247 [0,1,0,1,0,0|2,0,0]=4 4276 B15R2.16438 O=C(COCc1ccccc1)C2CC2 Amb27417208 [0,1,0,1,0,0|2,0,0]=4 4277 B15R2.16438 O=C(CSCc1ccccc1)C2CC2 Amb32651983 [0,1,0,1,0,0|2,0,0]=4 4278 B15R2.93174 CCOC(=O)NC1Cc2ccccc21 Amb28343266 [0,1,0,1,0,0|1,0,0]=3 4279 B15R2.93174 C\C=C\C(=O)CC1Cc2ccccc21 Amb27623786 [0,1,0,1,0,0|1,0,0]=3 4280 B15R2.1190 CN\C(=N\N)C1CC1c2ccccc2 Amb28325320 [0,1,0,1,0,0|2,0,0]=4 4281 B15R2.1190 C\N=C(\OC)C1CC1c2ccccc2 Amb22356823 [0,1,0,1,0,0|1,0,0]=3 4282 B15R2.1899 C\C=C1/CN(Cc2ccccc2)C1=O Amb26522308 [0,1,0,1,0,0|2,0,0]=4 4283 B15R2.2284 O=CC1=C(Cl)c2ccccc2CCC1 Amb27589213 [0,1,0,1,0,0|2,0,0]=4 4284 B15R2.2285 COC1=NCCc2ccccc2CC1 Amb28422775 [0,1,0,1,0,0|2,0,0]=4 4285 B15R2.33687 COC1(C=O)CCCc2ccccc21 Amb28121362 [0,1,0,1,0,0|0,0,1]=3 4286 B15R2.33687 COC1(CN)CCCc2ccccc21 Amb18910168 [0,1,0,1,0,0|1,0,1]=4 4287 B15R2.33687 COC1(CO)CCCc2ccccc21 Amb27980723 [0,1,0,1,0,0|0,0,2]=4 4288 B15R2.314 CC1=C[C@H](Cc2ccccc2)NC1=O Amb27602226 [0,1,0,1,0,0|2,0,0]=4 4289 B15R2.314 CC1CN(Cc2ccccc2)CC1=O Amb20622818 [0,1,0,1,0,0|2,0,0]=4 4290 B15R2.314 CN1CC(Cc2ccccc2)OC1=O Amb18559294 [0,1,0,1,0,0|2,0,0]=4 4291 B15R2.314 CN1N=C(Cc2ccccc2)CC1=O Amb28411712 [0,1,0,1,0,0|1,0,1]=4 4292 B15R2.314 C[C@H]1C[C@H](Cc2ccccc2)NC1=O Amb27441075 [0,1,0,1,0,0|2,0,0]=4 4293 B15R2.314 O=C1CC(Cc2ccccc2)CC1O Amb27835932 [0,1,0,1,0,0|1,0,0]=3 4294 B15R2.314 O=C1O[C@@H](Cc2ccccc2)C[C@@H]1O Amb27454878 [0,1,0,1,0,0|2,0,0]=4 4295 B15R2.314 O=C1O[C@H](Cc2ccccc2)C[C@H]1O Amb27218508 [0,1,0,1,0,0|2,0,0]=4 4296 B15R2.323 CN1C(=O)CC(N)C1c2ccccc2 Amb17516995 [0,1,0,1,0,0|1,0,0]=3 4297 B15R2.323 CN1C(=O)CC(N)C1c2ccccn2 Amb17517040 [0,1,0,1,0,0|2,0,0]=4 4298 B15R2.323 CN1C(=O)CC(N)C1c2cccnc2 Amb17517041 [0,1,0,1,0,0|2,0,0]=4 4299 B15R2.323 CN1C(=O)CC(N)C1c2cccnc2 Amb32665010 [0,1,0,1,0,0|2,0,0]=4 4300 B15R2.323 CN1C(=O)CC(N)C1c2cccnc2 Amb32665011 [0,1,0,1,0,0|2,0,0]=4 4301 B15R2.323 CN1C(=O)CC(N)C1c2ccncc2 Amb17517042 [0,1,0,1,0,0|2,0,0]=4 4302 B15R2.323 CN1C(=O)C[C@@H](N)[C@@H]1c2cccnc2 Amb35745780 [0,1,0,1,0,0|2,0,0]=4 4303 B15R2.323 CN1C(=O)C[C@@H](N)[C@@H]1c2cccnc2 Amb35746832 [0,1,0,1,0,0|2,0,0]=4 4304 B15R2.323 CN1C(=O)C[C@H](N)[C@H]1c2ccccc2 Amb33212964 [0,1,0,1,0,0|1,0,0]=3 4305 B15R2.323 CN1C(=O)C[C@H](N)[C@H]1c2ccccn2 Amb33213005 [0,1,0,1,0,0|2,0,0]=4 4306 B15R2.323 CN1C(=O)C[C@H](N)[C@H]1c2cccnc2 Amb25957091 [0,1,0,1,0,0|2,0,0]=4 4307 B15R2.323 CN1C(=O)C[C@H](N)[C@H]1c2cccnc2 Amb28721736 [0,1,0,1,0,0|2,0,0]=4 4308 B15R2.323 CN1C(=O)C[C@H](N)[C@H]1c2cccnc2 Amb32661231 [0,1,0,1,0,0|2,0,0]=4 4309 B15R2.323 CN1C(=O)C[C@H](N)[C@H]1c2ccncc2 Amb33212773 [0,1,0,1,0,0|2,0,0]=4 4310 B15R2.323 C[C@H]1NC(=O)[C@H](C)[C@H]1c2ccccc2 Amb27443253 [0,1,0,1,0,0|2,0,0]=4 4311 B15R2.1157 O=C1COc2ccccc2CC(Cl)C1 Amb27751353 [0,1,0,1,0,0|2,0,0]=4 4312 B15R2.1569 C=C(CC)CC1Cc2ccccc2N1 Amb27787624 [0,1,0,1,0,0|2,0,0]=4 4313 B15R2.1569 CCC(=O)NC1Cc2ccccc2C1 Amb2031412 [0,1,0,1,0,0|2,0,0]=4 4314 B15R2.1569 CNC(=O)CN1Cc2ccccc2C1 Amb25982138 [0,1,0,1,0,0|2,0,0]=4 4315 B15R2.1569 CNC(=O)NC1Cc2ccccc2C1 Amb22584235 [0,1,0,1,0,0|2,0,0]=4 4316 B15R2.1569 COC(=O)C=C1Cc2ccccc2C1 Amb25138575 [0,1,0,1,0,0|0,0,2]=4 4317 B15R2.1569 COC(=O)CC1=Cc2ccccc2C1 Amb27468510 [0,1,0,1,0,0|0,0,1]=3 4318 B15R2.1569 COC(=O)CC1Cc2ccccc2N1 Amb26421319 [0,1,0,1,0,0|0,0,0]=2 4319 B15R2.1569 COC(=O)CC1Oc2ccccc2O1 Amb27751873 [0,1,0,1,0,0|1,0,0]=3 4320 B15R2.1569 COC(=O)Cc1nc2ccccc2o1 Amb22755647 [0,1,0,1,0,0|1,0,1]=4 4321 B15R2.1569 COC(=O)Cn1nc2ccccc2n1 Amb10569882 [0,1,0,1,0,0|2,0,0]=4 4322 B15R2.1569 COC(=O)NC1=Cc2ccccc2C1 Amb27788809 [0,1,0,1,0,0|1,0,1]=4 4323 B15R2.1569 COC(=O)NC1Cc2ccccc2C1 Amb27390331 [0,1,0,1,0,0|1,0,0]=3 4324 B15R2.1569 CON(C)CC1Cc2ccccc2N1 Amb27240670 [0,1,0,1,0,0|2,0,0]=4 4325 B15R2.1569 CON(C)CC1Cc2ccccc2S1 Amb27976893 [0,1,0,1,0,0|2,0,0]=4 4326 B15R2.1682 COC1=NC(c2ccccc2)C(C)N1 Amb28409057 [0,1,0,1,0,0|2,0,0]=4 4327 B15R2.1682 COC1=N[C@@H](c2ccccc2)C(C)N1 Amb27873187 [0,1,0,1,0,0|2,0,0]=4 4328 B15R2.4086 CC1(Cc2ccccc2)CC(=O)CO1 Amb35693030 [0,1,0,1,0,0|2,0,0]=4 4329 B15R2.4086 CC1(Cc2ccccc2)CC(=O)NN1 Amb30010409 [0,1,0,1,0,0|2,0,0]=4 4330 B15R2.4086 CC1(Cc2ccccc2)CCC(=O)N1 Amb28183443 [0,1,0,1,0,0|2,0,0]=4 4331 B15R2.4086 CC1(Cc2ccccc2)CNC(=O)C1 Amb26416821 [0,1,0,1,0,0|1,0,0]=3 4332 B15R2.4086 CC1(Cc2ccccc2)CNC(=S)C1 Amb27868403 [0,1,0,1,0,0|1,1,0]=4 4333 B15R2.4086 CC1(Cc2cccnc2)CCC(=O)C1 Amb27626461 [0,1,0,1,0,0|2,0,0]=4 4334 B15R2.4086 CC1=CCC(N)(Cc2ccccc2)C1 Amb25765731 [0,1,0,1,0,0|2,0,0]=4 4335 B15R2.4086 CC1CC(O)(Cc2ccccc2)CO1 Amb29850365 [0,1,0,1,0,0|1,0,1]=4 4336 B15R2.4086 C[C@@]1(Cc2ccccc2)COC(=O)N1 Amb27841747 [0,1,0,1,0,0|1,0,0]=3 4337 B15R2.8448 CC1CC(=O)N(C)c2ccccc2N1 Amb19337762 [0,1,0,1,0,0|2,0,0]=4 4338 B15R2.8448 CC1CC(=O)N(C)c2ccccc2O1 Amb17570542 [0,1,0,1,0,0|2,0,0]=4 4339 B15R2.19393 CCC(=O)N1c2ccccc2CC1C Amb23213532 [0,1,0,1,0,0|2,0,0]=4 4340 B15R2.19393 COC(=O)C1C(=O)Cc2ccccc21 Amb21964401 [0,1,0,1,0,0|0,0,1]=3 4341 B15R2.19393 COC(=O)C1C(=O)Nc2ccccc21 Amb25770602 [0,1,0,1,0,0|1,0,1]=4 4342 B15R2.19393 COC(=O)C1c2ccccc2CC1N Amb26001268 [0,1,0,1,0,0|0,0,0]=2 4343 B15R2.19393 COC(=O)C1c2ccccc2CC1N Amb35788722 [0,1,0,1,0,0|0,0,0]=2 4344 B15R2.19393 COC(=O)C1c2ccccc2CC1O Amb25813762 [0,1,0,1,0,0|0,0,0]=2 4345 B15R2.19393 COC(=O)C1c2ccccc2OC1C Amb27792910 [0,1,0,1,0,0|1,0,0]=3 4346 B15R2.19393 COC(=O)N1c2ccccc2CC1C Amb27603656 [0,1,0,1,0,0|1,0,0]=3 4347 B15R2.19393 COC(=O)N1c2ccccc2CC1O Amb28453520 [0,1,0,1,0,0|1,0,0]=3 4348 B15R2.19393 COC(=O)[C@@H]1c2ccccc2O[C@@H]1C Amb27844222 [0,1,0,1,0,0|1,0,0]=3 4349 B15R2.19393 COC(=O)[C@@H]1c2ncccc2C[C@H]1N Amb28436862 [0,1,0,1,0,0|1,0,0]=3 4350 B15R2.321 CC1=C(c2ccccc2)CC(C)C1=O Amb17594832 [0,1,0,1,0,0|1,0,1]=4 4351 B15R2.321 CC1=C(c2ccccc2)CC(Cl)C1=O Amb28252384 [0,1,0,1,0,0|1,0,1]=4 4352 B15R2.321 CN1C(=O)C(=O)CC1c2ccccc2 Amb27977880 [0,1,0,1,0,0|1,0,1]=4 4353 B15R2.321 CN1C(=O)C(O)CC1c2ccccc2 Amb27835074 [0,1,0,1,0,0|1,0,0]=3 4354 B15R2.321 CN1C(=O)C(O)C[C@H]1c2cccnc2 Amb28315183 [0,1,0,1,0,0|2,0,0]=4 4355 B15R2.321 CN1C(=O)C(O)C[C@H]1c2ccncc2 Amb25917875 [0,1,0,1,0,0|2,0,0]=4 4356 B15R2.321 CN1C(=O)[C@@H](O)C[C@H]1c2cccnc2 Amb17615243 [0,1,0,1,0,0|2,0,0]=4 4357 B15R2.321 CN1C(=O)[C@H](O)C[C@@H]1c2cccnc2 Amb27440458 [0,1,0,1,0,0|2,0,0]=4 4358 B15R2.321 CN1C(=O)[C@H](O)C[C@H]1c2ccccn2 Amb25977025 [0,1,0,1,0,0|2,0,0]=4 4359 B15R2.321 CN1C(=O)[C@H](O)C[C@H]1c2cccnc2 Amb17615241 [0,1,0,1,0,0|2,0,0]=4 4360 B15R2.1601 C#CC(=O)C1CCc2ccccc2C1 Amb27747223 [0,1,0,1,0,0|1,0,1]=4 4361 B15R2.1601 CCC(=O)C1CCc2ncccc2C1 Amb35610792 [0,1,0,1,0,0|2,0,0]=4 4362 B15R2.1601 CCC(=O)C1CNc2ccccc2O1 Amb27873873 [0,1,0,1,0,0|2,0,0]=4 4363 B15R2.1601 CCC(=O)C1COc2ccccc2O1 Amb27624373 [0,1,0,1,0,0|2,0,0]=4 4364 B15R2.1601 CCC(=O)N1CCc2ccccc2C1 Amb5797482 [0,1,0,1,0,0|2,0,0]=4 4365 B15R2.1601 CNC(=N)C1CCc2ccccc2C1 Amb28397695 [0,1,0,1,0,0|2,0,0]=4 4366 B15R2.1601 CNC(=O)C1CCc2ccccc2N1 Amb6280952 [0,1,0,1,0,0|1,0,0]=3 4367 B15R2.1601 CNC(=O)C1CCc2ccccc2O1 Amb33610100 [0,1,0,1,0,0|1,0,0]=3 4368 B15R2.1601 CNC(=O)C1CNc2ccccc2C1 Amb25818635 [0,1,0,1,0,0|2,0,0]=4 4369 B15R2.1601 CNC(=O)C1CNc2ccccc2O1 Amb9703059 [0,1,0,1,0,0|2,0,0]=4 4370 B15R2.1601 CNC(=O)C1CNc2ccccc2S1 Amb27602223 [0,1,0,1,0,0|2,0,0]=4 4371 B15R2.1601 CNC(=O)C1COc2ccccc2O1 Amb1649043 [0,1,0,1,0,0|2,0,0]=4 4372 B15R2.1601 CNC(=O)C1Cc2ccccc2CN1 Amb32664993 [0,1,0,1,0,0|2,0,0]=4 4373 B15R2.1601 CNC(=O)C1Cc2ccccc2CN1 Amb518022 [0,1,0,1,0,0|2,0,0]=4 4374 B15R2.1601 CNC(=O)C1Cc2ccccc2CO1 Amb22643159 [0,1,0,1,0,0|2,0,0]=4 4375 B15R2.1601 CNC(=O)N1CCc2ccccc2C1 Amb1952627 [0,1,0,1,0,0|2,0,0]=4 4376 B15R2.1601 CNC(=O)[C@@H]1CNc2ccccc2S1 Amb28204080 [0,1,0,1,0,0|2,0,0]=4 4377 B15R2.1601 CNC(=O)[C@@H]1Cc2ccccc2CN1 Amb28524834 [0,1,0,1,0,0|2,0,0]=4 4378 B15R2.1601 CNC(=O)[C@@H]1Cc2ccccc2CN1 Amb9753450 [0,1,0,1,0,0|2,0,0]=4 4379 B15R2.1601 COC(=N)C1CCc2ccccc2C1 Amb27946361 [0,1,0,1,0,0|1,0,0]=3 4380 B15R2.1601 COC(=O)C1=Cc2ccccc2CC1 Amb25938484 [0,1,0,1,0,0|0,0,1]=3 4381 B15R2.1601 COC(=O)C1=Cc2ccccc2OC1 Amb2424227 [0,1,0,1,0,0|1,0,1]=4 4382 B15R2.1601 COC(=O)C1=Cc2ccncc2CC1 Amb28324712 [0,1,0,1,0,0|1,0,1]=4 4383 B15R2.1601 COC(=O)C1CCc2ccccc2C1 Amb27419368 [0,1,0,1,0,0|0,0,0]=2 4384 B15R2.1601 COC(=O)C1CCc2ccccc2N1 Amb2449505 [0,1,0,1,0,0|0,0,0]=2 4385 B15R2.1601 COC(=O)C1CCc2ccccc2N1 Amb535534 [0,1,0,1,0,0|0,0,0]=2 4386 B15R2.1601 COC(=O)C1CCc2ccccc2O1 Amb21961803 [0,1,0,1,0,0|0,0,0]=2 4387 B15R2.1601 COC(=O)C1CCc2cnccc2N1 Amb25124044 [0,1,0,1,0,0|1,0,0]=3 4388 B15R2.1601 COC(=O)C1CCc2cnccc2N1 Amb33038467 [0,1,0,1,0,0|1,0,0]=3 4389 B15R2.1601 COC(=O)C1CCc2ncccc2C1 Amb25777758 [0,1,0,1,0,0|1,0,0]=3 4390 B15R2.1601 COC(=O)C1CCc2ncncc2C1 Amb23453252 [0,1,0,1,0,0|2,0,0]=4 4391 B15R2.1601 COC(=O)C1CNc2ccccc2C1 Amb26497689 [0,1,0,1,0,0|1,0,0]=3 4392 B15R2.1601 COC(=O)C1CNc2ccccc2O1 Amb2370905 [0,1,0,1,0,0|1,0,0]=3 4393 B15R2.1601 COC(=O)C1CNc2ccccc2O1 Amb27886 [0,1,0,1,0,0|1,0,0]=3 4394 B15R2.1601 COC(=O)C1COc2ccccc2C1 Amb33530208 [0,1,0,1,0,0|1,0,0]=3 4395 B15R2.1601 COC(=O)C1COc2ccccc2O1 Amb6315728 [0,1,0,1,0,0|1,0,0]=3 4396 B15R2.1601 COC(=O)C1Cc2ccccc2CN1 Amb2693824 [0,1,0,1,0,0|1,0,0]=3 4397 B15R2.1601 COC(=O)C1Cc2ccccc2CN1 Amb9703015 [0,1,0,1,0,0|1,0,0]=3 4398 B15R2.1601 COC(=O)C1Cc2ccccc2CO1 Amb26872649 [0,1,0,1,0,0|1,0,0]=3 4399 B15R2.1601 COC(=O)[C@@H]1CCc2ccccc2N1 Amb23401514 [0,1,0,1,0,0|0,0,0]=2 4400 B15R2.1601 COC(=O)[C@@H]1CCc2ccccc2N1 Amb8390590 [0,1,0,1,0,0|0,0,0]=2 4401 B15R2.1601 COC(=O)[C@@H]1CNc2ccccc2C1 Amb28255600 [0,1,0,1,0,0|1,0,0]=3 4402 B15R2.1601 COC(=O)[C@@H]1Cc2ccccc2CN1 Amb2690549 [0,1,0,1,0,0|1,0,0]=3 4403 B15R2.1601 COC(=O)[C@@H]1Cc2ccccc2CN1 Amb2700192 [0,1,0,1,0,0|1,0,0]=3 4404 B15R2.1601 COC(=O)[C@@H]1Cc2ccccc2CO1 Amb32667889 [0,1,0,1,0,0|1,0,0]=3 4405 B15R2.1601 COC(=O)[C@H]1CCc2ccccc2C1 Amb27669759 [0,1,0,1,0,0|0,0,0]=2 4406 B15R2.1601 COC(=O)[C@H]1CCc2ccccc2N1 Amb27773806 [0,1,0,1,0,0|0,0,0]=2 4407 B15R2.1601 COC(=O)[C@H]1CCc2ccccc2N1 Amb33871575 [0,1,0,1,0,0|0,0,0]=2 4408 B15R2.1601 COC(=O)[C@H]1Cc2ccccc2CN1 Amb22225138 [0,1,0,1,0,0|1,0,0]=3 4409 B15R2.1601 COC(=O)[C@H]1Cc2ccccc2CN1 Amb33757892 [0,1,0,1,0,0|1,0,0]=3 4410 B15R2.1601 NNC(=O)C1CCc2ccccc2C1 Amb25330918 [0,1,0,1,0,0|2,0,0]=4 4411 B15R2.1601 NOC(=O)C1CCc2ccccc2C1 Amb27242385 [0,1,0,1,0,0|1,0,0]=3 4412 B15R2.1601 O=C(CBr)C1CCc2ccccc2O1 Amb27229962 [0,1,0,1,0,0|2,0,0]=4 4413 B15R2.1601 O=C(CCl)C1CCc2ccccc2C1 Amb27863939 [0,1,0,1,0,0|2,0,0]=4 4414 B15R2.1601 O=C(NO)C1CCc2ccccc2C1 Amb27245692 [0,1,0,1,0,0|2,0,0]=4 4415 B15R2.1611 CNC(=O)C1(C)OC1c2ccccc2 Amb27879595 [0,1,0,1,0,0|2,0,0]=4 4416 B15R2.1611 COC(=O)C1(N)CC1c2ccccc2 Amb24697540 [0,1,0,1,0,0|0,0,0]=2 4417 B15R2.1611 COC(=O)[C@@]1(N)C[C@@H]1c2ccccc2 Amb23453230 [0,1,0,1,0,0|0,0,0]=2 4418 B15R2.1611 COC(=O)[C@@]1(N)C[C@H]1c2ccccc2 Amb23453211 [0,1,0,1,0,0|0,0,0]=2 4419 B15R2.15770 CC1CNc2ccccc2N(C)C1=O Amb18863554 [0,1,0,1,0,0|2,0,0]=4 4420 B15R2.15770 CC1COc2ccccc2N(C)C1=O Amb17570541 [0,1,0,1,0,0|2,0,0]=4 4421 B15R2.15770 CC1NCc2ccccc2N(C)C1=O Amb27217739 [0,1,0,1,0,0|2,0,0]=4 4422 B15R2.15770 CN1C(=O)C(Br)CCc2ccccc21 Amb28252960 [0,1,0,1,0,0|1,0,0]=3 4423 B15R2.15770 CN1C(=O)C(N)CCc2ccccc21 Amb25070832 [0,1,0,1,0,0|1,0,0]=3 4424 B15R2.15770 CN1C(=O)C(N)CNc2ccccc21 Amb27409204 [0,1,0,1,0,0|2,0,0]=4 4425 B15R2.15770 CN1C(=O)C(N)COc2ccccc21 Amb27391100 [0,1,0,1,0,0|2,0,0]=4 4426 B15R2.15770 CN1C(=O)C(N)CSc2ccccc21 Amb27758105 [0,1,0,1,0,0|2,0,0]=4 4427 B15R2.15770 CN1C(=O)[C@@H](N)CCc2ccccc21 Amb33715240 [0,1,0,1,0,0|1,0,0]=3 4428 B15R2.15770 CN1C(=O)[C@@H](N)CNc2ccccc21 Amb25689857 [0,1,0,1,0,0|2,0,0]=4 4429 B15R2.15770 CN1C(=O)[C@@H](N)COc2ccccc21 Amb27749433 [0,1,0,1,0,0|2,0,0]=4 4430 B15R2.15770 CN1C(=O)[C@@H](N)COc2ccccc21 Amb33484328 [0,1,0,1,0,0|2,0,0]=4 4431 B15R2.15770 CN1C(=O)[C@@H](N)CSc2ccccc21 Amb33715266 [0,1,0,1,0,0|2,0,0]=4 4432 B15R2.15770 CN1C(=O)[C@H](N)COc2ccccc21 Amb33484073 [0,1,0,1,0,0|2,0,0]=4 4433 B15R2.15770 CN1C(=O)[C@H](N)COc2ccccc21 Amb33484074 [0,1,0,1,0,0|2,0,0]=4 4434 B15R2.15770 NC1CCc2ccccc2C(F)C1=O Amb28068711 [0,1,0,1,0,0|2,0,0]=4 4435 B15R2.19402 COC(=O)C1(C)C=Cc2ccccc21 Amb17778896 [0,1,0,1,0,0|0,0,2]=4 4436 B15R2.19402 COC(=O)C1(C)CCc2ccccc21 Amb28194334 [0,1,0,1,0,0|0,0,0]=2 4437 B15R2.19402 COC(=O)C1(N)CCc2ccccc21 Amb18949640 [0,1,0,1,0,0|0,0,0]=2 4438 B15R2.19402 COC(=O)C1(N)CCc2ccccc21 Amb33801462 [0,1,0,1,0,0|0,0,0]=2 4439 B15R2.19402 COC(=O)C1(O)CCc2ccccc21 Amb19078825 [0,1,0,1,0,0|0,0,0]=2 4440 B15R2.19402 COC(=O)[C@@]1(N)CCc2ccccc21 Amb24564762 [0,1,0,1,0,0|0,0,0]=2 4441 B15R2.19402 COC(=O)[C@]1(N)CCc2ccccc21 Amb26994935 [0,1,0,1,0,0|0,0,0]=2 4442 B15R2.19402 O=C(CO)C1(O)CCc2ccccc21 Amb28409923 [0,1,0,1,0,0|2,0,0]=4 4443 B15R2.305 Cc1ccccc1CC2CCC(=O)N2 Amb27979116 [0,1,0,1,0,0|2,0,0]=4 4444 B15R2.305 Cc1ccccc1CC2CCC(=O)O2 Amb27235204 [0,1,0,1,0,0|2,0,0]=4 4445 B15R2.305 Cc1ccccc1CC2CNC(=O)C2 Amb27493006 [0,1,0,1,0,0|1,0,0]=3 4446 B15R2.305 Cc1ccccc1CC2CNC(=O)O2 Amb25035880 [0,1,0,1,0,0|2,0,0]=4 4447 B15R2.305 Cc1ccccc1CN2CCC(=O)C2 Amb19060551 [0,1,0,1,0,0|2,0,0]=4 4448 B15R2.305 Cc1ccccc1NC2CCC(=O)C2 Amb27614219 [0,1,0,1,0,0|2,0,0]=4 4449 B15R2.305 NC1=N[C@@H](Cc2ccccc2Cl)CO1 Amb27464390 [0,1,0,1,0,0|2,0,0]=4 4450 B15R2.305 O=C1CCC(Cc2ccccc2Br)N1 Amb27858199 [0,1,0,1,0,0|2,0,0]=4 4451 B15R2.305 O=C1CCC(Cc2ncccc2Br)C1 Amb28059961 [0,1,0,1,0,0|2,0,0]=4 4452 B15R2.305 O=C1CCC(Oc2ccccc2F)C1 Amb27656595 [0,1,0,1,0,0|2,0,0]=4 4453 B15R2.305 O=C1CCN(Cc2ccccc2F)C1 Amb8947957 [0,1,0,1,0,0|2,0,0]=4 4454 B15R2.305 O=C1NCC(Cc2ccccc2Cl)O1 Amb26938771 [0,1,0,1,0,0|2,0,0]=4 4455 B15R2.305 O=C1NCC(Cc2ccccc2F)O1 Amb28291470 [0,1,0,1,0,0|2,0,0]=4 4456 B15R2.305 O=C1NCC(Cc2ccccc2O)O1 Amb18651410 [0,1,0,1,0,0|2,0,0]=4 4457 B15R2.308 Cc1ccccc1C2CCC(=O)CC2 Amb18564515 [0,1,0,1,0,0|1,0,0]=3 4458 B15R2.308 Cc1ccccc1C2CCC(=O)NC2 Amb17401304 [0,1,0,1,0,0|1,0,0]=3 4459 B15R2.308 Cc1ccccc1C2CNC(=O)CN2 Amb25028930 [0,1,0,1,0,0|2,0,0]=4 4460 B15R2.308 Cc1ccccc1C2CNC(=O)CO2 Amb27831882 [0,1,0,1,0,0|2,0,0]=4 4461 B15R2.308 Cc1ccccc1C2CNC(=O)NC2 Amb26895919 [0,1,0,1,0,0|2,0,0]=4 4462 B15R2.308 Cc1ccccc1N2CCC(=O)CC2 Amb6260019 [0,1,0,1,0,0|2,0,0]=4 4463 B15R2.308 Nc1ccccc1C2CNC(=O)CO2 Amb18863709 [0,1,0,1,0,0|2,0,0]=4 4464 B15R2.308 Nc1ccccc1N2CCC(=O)CC2 Amb17506932 [0,1,0,1,0,0|2,0,0]=4 4465 B15R2.308 O=C1CCC(c2ccccc2Br)CC1 Amb18584295 [0,1,0,1,0,0|1,0,0]=3 4466 B15R2.308 O=C1CCC(c2ccccc2Br)CN1 Amb28075264 [0,1,0,1,0,0|1,0,0]=3 4467 B15R2.308 O=C1CCC(c2ccccc2Cl)CC1 Amb18568605 [0,1,0,1,0,0|1,0,0]=3 4468 B15R2.308 O=C1CCC(c2ccccc2Cl)CN1 Amb17403923 [0,1,0,1,0,0|1,0,0]=3 4469 B15R2.308 O=C1CCC(c2ccccc2F)CC1 Amb18565088 [0,1,0,1,0,0|1,0,0]=3 4470 B15R2.308 O=C1CCC(c2ccccc2F)CN1 Amb17401715 [0,1,0,1,0,0|1,0,0]=3 4471 B15R2.308 O=C1CCC(c2ccccc2O)CC1 Amb27591569 [0,1,0,1,0,0|1,0,0]=3 4472 B15R2.308 O=C1CCC(c2ncccc2O)CC1 Amb27752369 [0,1,0,1,0,0|2,0,0]=4 4473 B15R2.308 O=C1CCN(c2ccccc2Br)CC1 Amb6272459 [0,1,0,1,0,0|2,0,0]=4 4474 B15R2.308 O=C1CCN(c2ccccc2Cl)CC1 Amb6269945 [0,1,0,1,0,0|2,0,0]=4 4475 B15R2.308 O=C1CCN(c2ccccc2F)CC1 Amb3941328 [0,1,0,1,0,0|2,0,0]=4 4476 B15R2.308 O=C1CCN(c2ccccc2O)CC1 Amb27612624 [0,1,0,1,0,0|2,0,0]=4 4477 B15R2.308 O=C1CNC(c2ccccc2F)CN1 Amb8010280 [0,1,0,1,0,0|2,0,0]=4 4478 B15R2.308 O=C1COC(c2ccccc2Br)CN1 Amb18878317 [0,1,0,1,0,0|2,0,0]=4 4479 B15R2.308 O=C1COC(c2ccccc2Cl)CN1 Amb27790827 [0,1,0,1,0,0|2,0,0]=4 4480 B15R2.308 O=C1COC(c2ccccc2F)CN1 Amb24444029 [0,1,0,1,0,0|2,0,0]=4 4481 B15R2.308 O=C1NCC(c2ccccc2Br)CN1 Amb24439894 [0,1,0,1,0,0|2,0,0]=4 4482 B15R2.308 O=C1NCC(c2ccccc2Cl)CN1 Amb25913570 [0,1,0,1,0,0|2,0,0]=4 4483 B15R2.308 O=C1NCC(c2ccccc2F)CN1 Amb25856369 [0,1,0,1,0,0|2,0,0]=4 4484 B15R2.2170 CCC(=O)C1CCc2c(F)cccc21 Amb27783939 [0,1,0,1,0,0|1,0,0]=3 4485 B15R2.2170 CCC(=O)N1CCc2c(N)cccc21 Amb18669657 [0,1,0,1,0,0|2,0,0]=4 4486 B15R2.2170 COC(=O)C1COc2c(Br)cccc21 Amb33166962 [0,1,0,1,0,0|1,0,0]=3 4487 B15R2.2170 COC(=O)C1COc2c(C)cccc21 Amb33166958 [0,1,0,1,0,0|1,0,0]=3 4488 B15R2.2170 COC(=O)C1COc2c(Cl)cccc21 Amb33166964 [0,1,0,1,0,0|1,0,0]=3 4489 B15R2.2170 COC(=O)C1COc2c(F)cccc21 Amb33166953 [0,1,0,1,0,0|1,0,0]=3 4490 B15R2.2170 COC(=O)N1CCc2c(C)cccc21 Amb25064253 [0,1,0,1,0,0|1,0,0]=3 4491 B15R2.2170 COC(=O)N1CCc2c(N)cccc21 Amb18669655 [0,1,0,1,0,0|1,0,0]=3 4492 B15R2.7473 CC1C(=O)CCC1c2cccnc2N Amb27164756 [0,1,0,1,0,0|2,0,0]=4 4493 B15R2.7473 CC1C(=O)CCC1c2cnccc2N Amb28324719 [0,1,0,1,0,0|2,0,0]=4 4494 B15R2.7473 CC1C(=O)NCC1c2ccccc2Cl Amb28142503 [0,1,0,1,0,0|2,0,0]=4 4495 B15R2.7473 CN1C(=O)CCC1c2cccnc2N Amb27658774 [0,1,0,1,0,0|2,0,0]=4 4496 B15R2.7473 CN1C(=O)CCC1c2cnccc2N Amb18650871 [0,1,0,1,0,0|2,0,0]=4 4497 B15R2.7473 CN1C(=O)CCN1c2ccccc2Br Amb28255826 [0,1,0,1,0,0|2,0,0]=4 4498 B15R2.7473 CN1C(=O)CCN1c2ccccc2N Amb27667182 [0,1,0,1,0,0|2,0,0]=4 4499 B15R2.7473 CN1C(=O)CC[C@H]1c2cccc[n+]2[O-] Amb27265850 [0,1,0,1,0,0|2,0,0]=4 4500 B15R2.7473 CN1C(=O)CSC1c2ccccc2O Amb27227219 [0,1,0,1,0,0|2,0,0]=4 4501 B15R2.7473 CN1C(=O)NCC1c2ccccc2Br Amb25282910 [0,1,0,1,0,0|2,0,0]=4 4502 B15R2.7473 CN1C(=O)NCC1c2ccccc2Cl Amb25869287 [0,1,0,1,0,0|2,0,0]=4 4503 B15R2.7473 CN1C(=O)NCC1c2ccccc2F Amb24359132 [0,1,0,1,0,0|2,0,0]=4 4504 B15R2.7473 CN1C(=O)OCC1c2ccccc2Br Amb28051736 [0,1,0,1,0,0|2,0,0]=4 4505 B15R2.7473 Cc1ccccc1C2CCC(=O)C2C Amb28461485 [0,1,0,1,0,0|1,0,0]=3 4506 B15R2.7473 Cc1ccccc1C2CNC(=O)N2C Amb24385318 [0,1,0,1,0,0|2,0,0]=4 4507 B15R2.19074 COC(=O)C1OC1c2ccccc2Cl Amb19930050 [0,1,0,1,0,0|1,0,0]=3 4508 B15R2.42442 CN1C(=O)CCOc2c(Br)cccc21 Amb17573811 [0,1,0,1,0,0|2,0,0]=4 4509 B15R2.42442 CN1C(=O)CCOc2c(Cl)cccc21 Amb17571355 [0,1,0,1,0,0|2,0,0]=4 4510 B15R2.42442 CN1C(=O)CCOc2c(F)cccc21 Amb17570728 [0,1,0,1,0,0|2,0,0]=4 4511 B15R2.42442 CN1C(=O)CCOc2c(N)cccc21 Amb17570657 [0,1,0,1,0,0|2,0,0]=4 4512 B15R2.42442 Cc1cccc2c1OCCC(=O)N2C Amb17570551 [0,1,0,1,0,0|2,0,0]=4 4513 B15R2.28 Cc1cccc(C2CCC(=O)CC2)c1 Amb18066220 [0,1,0,1,0,0|1,0,0]=3 4514 B15R2.28 Cc1cccc(C2CCC(=O)NC2)c1 Amb17401307 [0,1,0,1,0,0|1,0,0]=3 4515 B15R2.28 Cc1cccc(C2CNC(=O)CN2)c1 Amb26489153 [0,1,0,1,0,0|2,0,0]=4 4516 B15R2.28 Cc1cccc(C2CNC(=O)CO2)c1 Amb27817887 [0,1,0,1,0,0|2,0,0]=4 4517 B15R2.28 Cc1cccc(C2CNC(=O)NC2)c1 Amb26514140 [0,1,0,1,0,0|2,0,0]=4 4518 B15R2.28 Cc1cccc(N2CCC(=O)CC2)c1 Amb3941348 [0,1,0,1,0,0|2,0,0]=4 4519 B15R2.28 Nc1cccc(C2CCC(=O)NC2)c1 Amb27445151 [0,1,0,1,0,0|1,0,0]=3 4520 B15R2.28 Nc1cccc(C2CNC(=O)CO2)c1 Amb18863708 [0,1,0,1,0,0|2,0,0]=4 4521 B15R2.28 Nc1cccc(C2CNC(=O)OC2)c1 Amb18863711 [0,1,0,1,0,0|1,0,0]=3 4522 B15R2.28 O=C1CCC(c2cc(O)ccn2)CC1 Amb27810344 [0,1,0,1,0,0|2,0,0]=4 4523 B15R2.28 O=C1CCC(c2cccc(Br)c2)CC1 Amb18584293 [0,1,0,1,0,0|1,0,0]=3 4524 B15R2.28 O=C1CCC(c2cccc(Br)c2)CN1 Amb17414213 [0,1,0,1,0,0|1,0,0]=3 4525 B15R2.28 O=C1CCC(c2cccc(Cl)c2)CC1 Amb18568606 [0,1,0,1,0,0|1,0,0]=3 4526 B15R2.28 O=C1CCC(c2cccc(Cl)c2)CN1 Amb17403926 [0,1,0,1,0,0|1,0,0]=3 4527 B15R2.28 O=C1CCC(c2cccc(F)c2)CC1 Amb18565090 [0,1,0,1,0,0|1,0,0]=3 4528 B15R2.28 O=C1CCN(c2cccc(Br)c2)CC1 Amb6262003 [0,1,0,1,0,0|2,0,0]=4 4529 B15R2.28 O=C1CCN(c2cccc(Cl)c2)CC1 Amb3941327 [0,1,0,1,0,0|2,0,0]=4 4530 B15R2.28 O=C1CCN(c2cccc(F)c2)CC1 Amb6259494 [0,1,0,1,0,0|2,0,0]=4 4531 B15R2.28 O=C1CCN(c2cccc(I)c2)CC1 Amb7785473 [0,1,0,1,0,0|2,0,0]=4 4532 B15R2.28 O=C1CCN(c2cccc(O)c2)CC1 Amb27388065 [0,1,0,1,0,0|2,0,0]=4 4533 B15R2.28 O=C1CNC(c2cccc(Br)c2)CN1 Amb24685332 [0,1,0,1,0,0|2,0,0]=4 4534 B15R2.28 O=C1CNC(c2cccc(F)c2)CN1 Amb8010282 [0,1,0,1,0,0|2,0,0]=4 4535 B15R2.28 O=C1COC(c2cccc(Br)c2)CN1 Amb18229978 [0,1,0,1,0,0|2,0,0]=4 4536 B15R2.28 O=C1COC(c2cccc(Cl)c2)CN1 Amb25145017 [0,1,0,1,0,0|2,0,0]=4 4537 B15R2.28 O=C1COC(c2cccc(F)c2)CN1 Amb28322939 [0,1,0,1,0,0|2,0,0]=4 4538 B15R2.28 O=C1NCC(c2cccc(Br)c2)CN1 Amb28139731 [0,1,0,1,0,0|2,0,0]=4 4539 B15R2.28 O=C1NCC(c2cccc(Cl)c2)CN1 Amb26481850 [0,1,0,1,0,0|2,0,0]=4 4540 B15R2.28 O=C1NCC(c2cccc(F)c2)CN1 Amb24733528 [0,1,0,1,0,0|2,0,0]=4 4541 B15R2.28 O=C1NCC(c2cccc(F)c2)CO1 Amb27186717 [0,1,0,1,0,0|1,0,0]=3 4542 B15R2.1115 Cc1cccc(CC2CCC(=O)C2)c1 Amb27867267 [0,1,0,1,0,0|1,0,0]=3 4543 B15R2.1115 Cc1cccc(CC2CCC(=O)O2)c1 Amb27850937 [0,1,0,1,0,0|2,0,0]=4 4544 B15R2.1115 Cc1cccc(CC2CNC(=O)O2)c1 Amb27798346 [0,1,0,1,0,0|2,0,0]=4 4545 B15R2.1115 Cc1cccc(CN2CCC(=O)C2)c1 Amb19060552 [0,1,0,1,0,0|2,0,0]=4 4546 B15R2.1115 NC1=NC(Cc2cccc(Cl)c2)CO1 Amb27856140 [0,1,0,1,0,0|2,0,0]=4 4547 B15R2.1115 NC1=NC(Cc2cccc(F)c2)CO1 Amb27174275 [0,1,0,1,0,0|2,0,0]=4 4548 B15R2.1115 Nc1cccc(CC2CCC(=O)N2)c1 Amb18819187 [0,1,0,1,0,0|2,0,0]=4 4549 B15R2.1115 Nc1cccc(NC2CNC(=O)C2)c1 Amb27824242 [0,1,0,1,0,0|2,0,0]=4 4550 B15R2.1115 O=C1CC(Cc2cccc(Cl)c2)CN1 Amb28131641 [0,1,0,1,0,0|1,0,0]=3 4551 B15R2.1115 O=C1CC(Cc2cccc(F)c2)CN1 Amb28400177 [0,1,0,1,0,0|1,0,0]=3 4552 B15R2.1115 O=C1CCC(Cc2cccc(Cl)c2)N1 Amb27457427 [0,1,0,1,0,0|2,0,0]=4 4553 B15R2.1115 O=C1CCC(Cc2cccc(I)c2)N1 Amb27476906 [0,1,0,1,0,0|2,0,0]=4 4554 B15R2.1115 O=C1CCC(Cc2cccc(O)c2)O1 Amb20668453 [0,1,0,1,0,0|2,0,0]=4 4555 B15R2.1115 O=C1CCC(Cc2cncc(Br)c2)C1 Amb27204407 [0,1,0,1,0,0|2,0,0]=4 4556 B15R2.1115 O=C1CCC(Nc2cccc(Cl)c2)C1 Amb28121847 [0,1,0,1,0,0|2,0,0]=4 4557 B15R2.1115 O=C1CCC(Oc2cccc(F)c2)C1 Amb28289054 [0,1,0,1,0,0|2,0,0]=4 4558 B15R2.1115 O=C1CCC(Sc2cccc(F)c2)C1 Amb28045100 [0,1,0,1,0,0|2,0,0]=4 4559 B15R2.1115 O=C1CCN(Cc2cccc(Br)c2)C1 Amb27756755 [0,1,0,1,0,0|2,0,0]=4 4560 B15R2.1115 O=C1CCN(Cc2cccc(Cl)c2)C1 Amb27272883 [0,1,0,1,0,0|2,0,0]=4 4561 B15R2.1115 O=C1CC[C@@H](Cc2cccc(O)c2)O1 Amb24506328 [0,1,0,1,0,0|2,0,0]=4 4562 B15R2.1115 O=C1CC[C@H](Cc2cccc(O)c2)O1 Amb25073401 [0,1,0,1,0,0|2,0,0]=4 4563 B15R2.1115 O=C1NCC(Cc2cccc(Br)c2)O1 Amb27200725 [0,1,0,1,0,0|2,0,0]=4 4564 B15R2.1115 O=C1NCC(Cc2cccc(F)c2)O1 Amb24506386 [0,1,0,1,0,0|2,0,0]=4 4565 B15R2.3809 CCC(=O)C1CC1c2cccc(F)c2 Amb27848649 [0,1,0,1,0,0|1,0,0]=3 4566 B15R2.3809 COC(=O)C1CC1c2cccc(F)c2 Amb26569121 [0,1,0,1,0,0|0,0,0]=2 4567 B15R2.3809 COC(=O)C1CC1c2cccc(N)c2 Amb33231429 [0,1,0,1,0,0|0,0,0]=2 4568 B15R2.3809 COC(=O)C1OC1c2cccc(Br)c2 Amb19930049 [0,1,0,1,0,0|1,0,0]=3 4569 B15R2.3809 COC(=O)C1OC1c2cccc(F)c2 Amb19930054 [0,1,0,1,0,0|1,0,0]=3 4570 B15R2.7137 CC1C(=O)CCC1c2cccc(Br)c2 Amb30021787 [0,1,0,1,0,0|1,0,0]=3 4571 B15R2.7137 CC1C(=O)NCC1c2cccc(F)c2 Amb28056404 [0,1,0,1,0,0|2,0,0]=4 4572 B15R2.7137 CN1C(=O)CCC1c2ccc[n+]([O-])c2 Amb24355974 [0,1,0,1,0,0|2,0,0]=4 4573 B15R2.7137 CN1C(=O)CC[C@H]1c2ccc[n+]([O-])c2 Amb17671977 [0,1,0,1,0,0|2,0,0]=4 4574 B15R2.7137 CN1C(=O)CNC1c2cccc(Cl)c2 Amb27779596 [0,1,0,1,0,0|2,0,0]=4 4575 B15R2.7137 CN1C(=O)CNC1c2cccc(I)c2 Amb28063454 [0,1,0,1,0,0|2,0,0]=4 4576 B15R2.7137 CN1C(=O)NCC1c2cccc(Br)c2 Amb26961731 [0,1,0,1,0,0|2,0,0]=4 4577 B15R2.7137 CN1C(=O)NCC1c2cccc(Cl)c2 Amb28066523 [0,1,0,1,0,0|2,0,0]=4 4578 B15R2.7137 CN1C(=O)NCC1c2cccc(F)c2 Amb26862250 [0,1,0,1,0,0|2,0,0]=4 4579 B15R2.7137 CN1C(=O)OCC1c2cccc(N)c2 Amb27413683 [0,1,0,1,0,0|2,0,0]=4 4580 B15R2.7137 Cc1cccc(C2CNC(=O)C2C)c1 Amb28056403 [0,1,0,1,0,0|2,0,0]=4 4581 B15R2.7137 Cc1cccc(C2CNC(=O)N2C)c1 Amb28061554 [0,1,0,1,0,0|2,0,0]=4 4582 B15R2.7137 Cc1cncc(C2CCC(=O)C2C)c1 Amb27412066 [0,1,0,1,0,0|2,0,0]=4 4583 B15R2.7137 Cc1cncc(C2CCC(=O)N2C)c1 Amb17617285 [0,1,0,1,0,0|2,0,0]=4 4584 B15R2.19094 CCC(=O)N1CCc2cc(Br)ccc21 Amb10074096 [0,1,0,1,0,0|2,0,0]=4 4585 B15R2.19094 CCC(=O)N1CCc2cc(Cl)ccc21 Amb18866070 [0,1,0,1,0,0|2,0,0]=4 4586 B15R2.19094 CCC(=O)N1CCc2cc(N)ccc21 Amb6682948 [0,1,0,1,0,0|2,0,0]=4 4587 B15R2.19094 CNC(=O)N1CCc2cc(Br)ccc21 Amb28144690 [0,1,0,1,0,0|2,0,0]=4 4588 B15R2.19094 CNC(=O)N1CCc2cc(N)ccc21 Amb28384489 [0,1,0,1,0,0|2,0,0]=4 4589 B15R2.19094 COC(=O)C1CCc2cc(Br)ccc21 Amb25819071 [0,1,0,1,0,0|0,0,0]=2 4590 B15R2.19094 COC(=O)C1CCc2cc(N)ccc21 Amb22002308 [0,1,0,1,0,0|0,0,0]=2 4591 B15R2.19094 COC(=O)C1CCc2cc(N)ccc21 Amb22234408 [0,1,0,1,0,0|0,0,0]=2 4592 B15R2.19094 COC(=O)C1CCc2cc(N)ncc21 Amb28280898 [0,1,0,1,0,0|1,0,0]=3 4593 B15R2.19094 COC(=O)C1CCc2nc(C)ncc21 Amb23596895 [0,1,0,1,0,0|2,0,0]=4 4594 B15R2.19094 COC(=O)C1CCc2nc(N)ccc21 Amb27150040 [0,1,0,1,0,0|1,0,0]=3 4595 B15R2.19094 COC(=O)C1CCc2nc(N)ncc21 Amb23596894 [0,1,0,1,0,0|2,0,0]=4 4596 B15R2.19094 COC(=O)C1CCc2nc(S)ncc21 Amb23596898 [0,1,0,1,0,0|2,0,0]=4 4597 B15R2.19094 COC(=O)C1COc2cc(Br)ccc21 Amb33166965 [0,1,0,1,0,0|1,0,0]=3 4598 B15R2.19094 COC(=O)C1COc2cc(C)ccc21 Amb33166969 [0,1,0,1,0,0|1,0,0]=3 4599 B15R2.19094 COC(=O)C1COc2cc(F)ccc21 Amb33166959 [0,1,0,1,0,0|1,0,0]=3 4600 B15R2.19094 COC(=O)C1COc2cc(N)ccc21 Amb26895903 [0,1,0,1,0,0|1,0,0]=3 4601 B15R2.19094 COC(=O)C1N=Nc2cc(N)ccc21 Amb25301332 [0,1,0,1,0,0|2,0,0]=4 4602 B15R2.19094 COC(=O)C1NCc2cc(Br)cnc21 Amb27835119 [0,1,0,1,0,0|2,0,0]=4 4603 B15R2.19094 COC(=O)N1CCc2cc(Br)ccc21 Amb18229904 [0,1,0,1,0,0|1,0,0]=3 4604 B15R2.19094 COC(=O)N1CCc2cc(C)ccc21 Amb27419382 [0,1,0,1,0,0|1,0,0]=3 4605 B15R2.19094 COC(=O)N1CCc2cc(Cl)ccc21 Amb18866288 [0,1,0,1,0,0|1,0,0]=3 4606 B15R2.19094 COC(=O)N1CCc2cc(N)ccc21 Amb6683198 [0,1,0,1,0,0|1,0,0]=3 4607 B15R2.20829 COC1=Nc2ccc(Cl)cc2CCC1 Amb33295114 [0,1,0,1,0,0|1,0,0]=3 4608 B15R2.63978 CC1C(=O)NCCc2cc(Cl)ccc21 Amb28068796 [0,1,0,1,0,0|2,0,0]=4 4609 B15R2.63978 CC1C(=O)NCCc2cc(O)ccc21 Amb27454979 [0,1,0,1,0,0|2,0,0]=4 4610 B15R2.63978 CN1C(=O)CCCC2=C1C=CC(=O)N2 Amb33715272 [0,1,0,1,0,0|2,0,0]=4 4611 B15R2.63978 CN1C(=O)CCCC2=CC(=O)NC=C21 Amb33715287 [0,1,0,1,0,0|2,0,0]=4 4612 B15R2.63978 CN1C(=O)CCCc2cc(N)ccc21 Amb9305851 [0,1,0,1,0,0|1,0,0]=3 4613 B15R2.63978 CN1C(=O)CCOc2cc(Br)ccc21 Amb17573807 [0,1,0,1,0,0|2,0,0]=4 4614 B15R2.63978 CN1C(=O)CCOc2cc(N)ccc21 Amb17570654 [0,1,0,1,0,0|2,0,0]=4 4615 B15R2.79451 COC(=O)C1COc2cccc(Br)c21 Amb28044937 [0,1,0,1,0,0|1,0,0]=3 4616 B15R2.79451 COC(=O)C1COc2cccc(C)c21 Amb33166976 [0,1,0,1,0,0|1,0,0]=3 4617 B15R2.79451 COC(=O)C1COc2cccc(Cl)c21 Amb33166963 [0,1,0,1,0,0|1,0,0]=3 4618 B15R2.79451 COC(=O)C1COc2cccc(F)c21 Amb28400748 [0,1,0,1,0,0|1,0,0]=3 4619 B15R2.79451 COC(=O)C1NCc2cccc(Br)c21 Amb27419656 [0,1,0,1,0,0|1,0,0]=3 4620 B15R2.81051 COC(=O)CC1Cc2cccc(O)c21 Amb27613003 [0,1,0,1,0,0|0,0,0]=2 4621 B15R2.616 CC1(C)C(=O)CC1Oc2ccccc2 Amb25708803 [0,1,0,1,0,0|2,0,0]=4 4622 B15R2.616 C[C@]1(O)C(=O)N[C@@H]1Cc2ccccc2 Amb27868446 [0,1,0,1,0,0|2,0,0]=4 4623 B15R2.1255 C=C(C)C(=O)C1CCc2cccnc21 Amb28461007 [0,1,0,1,0,0|2,0,0]=4 4624 B15R2.1255 CC(=O)C(=O)N1CCc2ccccc21 Amb17401264 [0,1,0,1,0,0|2,0,0]=4 4625 B15R2.1255 CC(Br)C(=O)N1CCc2ccccc21 Amb10767357 [0,1,0,1,0,0|2,0,0]=4 4626 B15R2.1255 CC(C)C(=O)C1CCc2ccccc21 Amb28043631 [0,1,0,1,0,0|1,0,0]=3 4627 B15R2.1255 CC(C)C(=O)C1CCc2cccnc21 Amb27600548 [0,1,0,1,0,0|2,0,0]=4 4628 B15R2.1255 CC(C)C(=O)C1CSc2ccccc21 Amb28061218 [0,1,0,1,0,0|2,0,0]=4 4629 B15R2.1255 CC(C)C(=O)N1CCc2ccccc21 Amb3361452 [0,1,0,1,0,0|2,0,0]=4 4630 B15R2.1255 CC(Cl)C(=O)C1CNc2ccccc21 Amb28388601 [0,1,0,1,0,0|2,0,0]=4 4631 B15R2.1255 CC(Cl)C(=O)N1CCc2ccccc21 Amb9746417 [0,1,0,1,0,0|2,0,0]=4 4632 B15R2.1255 CC(N)C(=O)C1CCc2ccccc21 Amb33146122 [0,1,0,1,0,0|1,0,0]=3 4633 B15R2.1255 CC(N)C(=O)N1CCc2ccccc21 Amb13952625 [0,1,0,1,0,0|2,0,0]=4 4634 B15R2.1255 CC(N)C(=O)N1CCc2ccccc21 Amb6275073 [0,1,0,1,0,0|2,0,0]=4 4635 B15R2.1255 CC(O)C(=O)C1CCc2cccnc21 Amb27183724 [0,1,0,1,0,0|2,0,0]=4 4636 B15R2.1255 CC(O)C(=O)N1CCc2ccccc21 Amb17401511 [0,1,0,1,0,0|2,0,0]=4 4637 B15R2.1255 CN(C)C(=O)C1CSc2ccccc21 Amb24271509 [0,1,0,1,0,0|2,0,0]=4 4638 B15R2.1255 CN(C)C(=O)C1NCc2ccccc21 Amb27642755 [0,1,0,1,0,0|2,0,0]=4 4639 B15R2.1255 CN(C)C(=O)N1CCc2ccccc21 Amb3918409 [0,1,0,1,0,0|2,0,0]=4 4640 B15R2.1255 C[C@@H](N)C(=O)C1CCc2cccnc21 Amb35618247 [0,1,0,1,0,0|2,0,0]=4 4641 B15R2.1255 C[C@@H](N)C(=O)N1CCc2ccccc21 Amb18014672 [0,1,0,1,0,0|2,0,0]=4 4642 B15R2.1255 C[C@H](Cl)C(=O)N1CCc2ccccc21 Amb28287703 [0,1,0,1,0,0|2,0,0]=4 4643 B15R2.1255 C[C@H](N)C(=O)C1CCc2cccnc21 Amb35737872 [0,1,0,1,0,0|2,0,0]=4 4644 B15R2.1255 C[C@H](N)C(=O)N1CCc2ccccc21 Amb5783247 [0,1,0,1,0,0|2,0,0]=4 4645 B15R2.1255 O=C(C(F)F)C1CCc2ccccc21 Amb32743575 [0,1,0,1,0,0|2,0,0]=4 4646 B15R2.1255 O=C(O)C(=O)C1CCc2ccccc21 Amb33146105 [0,1,0,1,0,0|2,0,0]=4 4647 B15R2.4092 C[C@]1(O)C(=O)NCC1c2ccccc2 Amb27868579 [0,1,0,1,0,0|2,0,0]=4 4648 B15R2.4092 C[N+]1([O-])C(=O)CCC1c2cccnc2 Amb27237659 [0,1,0,1,0,0|2,0,0]=4 4649 B15R2.4092 C[N+]1([O-])C(=O)CC[C@H]1c2cccnc2 Amb27265832 [0,1,0,1,0,0|2,0,0]=4 4650 B15R2.4092 O=C1CCC(c2ccccc2)C1(Cl)Cl Amb17596284 [0,1,0,1,0,0|2,0,0]=4 4651 B15R2.4232 CN(C)C(=O)C1OC1c2ccccc2 Amb27597040 [0,1,0,1,0,0|2,0,0]=4 4652 B15R2.4232 CN(C)C(=O)[C@H]1O[C@@H]1c2ccccc2 Amb28385477 [0,1,0,1,0,0|2,0,0]=4 4653 B15R2.4232 C[C@@H](N)C(=O)C1CC1c2ccccc2 Amb35618244 [0,1,0,1,0,0|1,0,0]=3 4654 B15R2.4232 C[C@H](N)C(=O)C1CC1c2ccccc2 Amb35737869 [0,1,0,1,0,0|1,0,0]=3 4655 B15R2.4232 O=C(C(F)F)C1CC1c2ccccc2 Amb27166993 [0,1,0,1,0,0|2,0,0]=4 4656 B15R2.107888 CC(C)C(=O)CC1Cc2ccccc21 Amb28288263 [0,1,0,1,0,0|1,0,0]=3 4657 B15R2.107888 C[C@@H](N)C(=O)CC1Cc2ccccc21 Amb35618245 [0,1,0,1,0,0|1,0,0]=3 4658 B15R2.107888 C[C@H](N)C(=O)CC1Cc2ccccc21 Amb35737870 [0,1,0,1,0,0|1,0,0]=3 4659 B15R3.1248 COC1=CC2NC1c3ccccc32 Amb27829990 [0,0,0,2,0,0|2,0,0]=4 4660 B15R3.514 O=C1C[C@@H]2C(c3ccccc3)[C@@H]2C1 Amb27802567 [0,0,0,2,0,0|1,0,0]=3 4661 B15R3.514 O=C1C[C@@H]2[C@H](c3ccccc3)[C@@H]2C1 Amb27861275 [0,0,0,2,0,0|1,0,0]=3 4662 B15R3.2009 NC1=NC2Cc3ccccc3C2O1 Amb28396548 [0,0,0,2,0,0|2,0,0]=4 4663 B15R3.2009 O=C1CC2Cc3ccccc3C2O1 Amb7090692 [0,0,0,2,0,0|0,0,0]=2 4664 B15R3.2009 O=C1CC2c3ccccc3CC2N1 Amb27754100 [0,0,0,2,0,0|2,0,0]=4 4665 B15R3.2009 O=C1C[C@H]2c3ccccc3C[C@H]2O1 Amb27471814 [0,0,0,2,0,0|2,0,0]=4 4666 B15R3.2009 O=C1NC2c3ccccc3CC2O1 Amb26904587 [0,0,0,2,0,0|2,0,0]=4 4667 B15R3.2009 O=C1N[C@H]2c3ccccc3C[C@H]2O1 Amb22336679 [0,0,0,2,0,0|2,0,0]=4 4668 B15R3.10083 O=C1CC[C@@H]2Cc3ccccc3[C@H]12 Amb28324331 [0,0,0,2,0,0|1,0,0]=3 4669 B15R3.10083 O=C1NNC2Cc3ccccc3C12 Amb4560415 [0,0,0,2,0,0|2,0,0]=4 4670 B15R3.485 O=C1CC2c3ccccc3CCC12 Amb26413742 [0,0,0,2,0,0|1,0,0]=3 4671 B15R3.485 O=C1CC2c3ccccc3OCC12 Amb27608700 [0,0,0,2,0,0|2,0,0]=4 4672 B15R3.485 O=C1C[C@H]2c3ccccc3CC[C@@H]12 Amb24629252 [0,0,0,2,0,0|1,0,0]=3 4673 B15R3.485 O=C1C[C@H]2c3ccccc3OC[C@@H]12 Amb33069637 [0,0,0,2,0,0|2,0,0]=4 4674 B15R3.485 O=C1NC2c3ccccc3CCC12 Amb25926830 [0,0,0,2,0,0|1,0,0]=3 4675 B15R3.485 O=C1NC2c3ccccc3OCC12 Amb26008723 [0,0,0,2,0,0|2,0,0]=4 4676 B15R3.485 O=C1N[C@@H]2c3ccccc3CC[C@H]12 Amb1994021 [0,0,0,2,0,0|1,0,0]=3 4677 B15R3.485 O=C1N[C@H]2c3ccccc3CC[C@@H]12 Amb1994019 [0,0,0,2,0,0|1,0,0]=3 4678 B15R3.76 O=C1CCC2CC1c3ccccc32 Amb27212445 [0,0,0,2,0,0|1,0,0]=3 4679 B15R3.794 O=C1CCc2cccc3c2N1CC3 Amb3430755 [0,0,0,2,0,0|2,0,0]=4 4680 B15R3.1917 CC1(C2CCc3ccccc32)CO1 Amb33145101 [0,0,0,2,0,0|1,0,1]=4 4681 B15R3.9094 CC1C(=O)C2CC1c3ccccc32 Amb28324401 [0,0,0,2,0,0|1,0,0]=3 4682 B15R3.10713 O=C1CCC2c3ccccc3C12O Amb27750298 [0,0,0,2,0,0|2,0,0]=4 4683 B15R3.988 O=C1C=Cc2ccccc2C3CC13 Amb6359953 [0,0,0,2,0,0|1,0,1]=4 4684 B15R3.15145 O=C1C[C@@H]2Cc3ccccc3C[C@H]12 Amb27267060 [0,0,0,2,0,0|1,0,0]=3 4685 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [1,0,0,0,1,0|1,0,0]=3 4686 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [1,0,0,0,1,0|2,0,0]=4 4687 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [1,0,0,0,1,0|2,0,0]=4 4688 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [1,0,0,0,1,0|2,0,0]=4 4689 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [1,0,0,0,1,0|2,0,0]=4 4690 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [1,0,0,0,1,0|2,0,0]=4 4691 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [1,0,0,0,1,0|2,0,0]=4 4692 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,0,0,0,1,0|2,0,0]=4 4693 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,0,0,0,1,0|2,0,0]=4 4694 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [1,0,0,0,1,0|0,0,2]=4 4695 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [1,0,0,0,1,0|0,0,0]=2 4696 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,0,0,0,1,0|1,0,0]=3 4697 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,0,0,0,1,0|1,0,0]=3 4698 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,0,0,0,1,0|1,0,0]=3 4699 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [1,0,0,0,1,0|1,0,0]=3 4700 B11R1.91 CC(=O)CCc1ccncn1 Amb27399166 [1,0,0,0,1,0|2,0,0]=4 4701 B11R1.91 CC(=O)CCc1cnccn1 Amb25307907 [1,0,0,0,1,0|2,0,0]=4 4702 B11R1.91 CC(=O)CCc1cncnc1 Amb28285350 [1,0,0,0,1,0|2,0,0]=4 4703 B11R1.91 CC(=O)CCc1ncccn1 Amb24726140 [1,0,0,0,1,0|2,0,0]=4 4704 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,0,0,0,1,0|1,0,0]=3 4705 B11R1.91 CC(=O)CNc1ccccn1 Amb26542003 [1,0,0,0,1,0|2,0,0]=4 4706 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [1,0,0,0,1,0|1,0,0]=3 4707 B11R1.91 CC(=O)COc1ccccn1 Amb26557634 [1,0,0,0,1,0|2,0,0]=4 4708 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [1,0,0,0,1,0|1,0,0]=3 4709 B11R1.91 CC(=O)CSc1ccccn1 Amb9215975 [1,0,0,0,1,0|2,0,0]=4 4710 B11R1.91 CC(=O)CSc1cccnc1 Amb28351579 [1,0,0,0,1,0|2,0,0]=4 4711 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,0,0,0,1,0|1,0,0]=3 4712 B11R1.91 CC(=O)NCc1ccccn1 Amb3358089 [1,0,0,0,1,0|2,0,0]=4 4713 B11R1.91 CC(=O)NCc1ccccn1 Amb6892496 [1,0,0,0,1,0|2,0,0]=4 4714 B11R1.91 CC(=O)NCc1ccncc1 Amb2694533 [1,0,0,0,1,0|2,0,0]=4 4715 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [1,0,0,0,1,0|2,0,0]=4 4716 B11R1.91 CC(=O)OC[n+]1ccccc1 Amb27259021 [1,0,0,0,1,0|2,0,0]=4 4717 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [1,0,0,0,1,0|1,0,0]=3 4718 B11R1.91 CC(=O)OCc1ccccn1 Amb9780355 [1,0,0,0,1,0|2,0,0]=4 4719 B11R1.91 CC(=O)OCc1cccnc1 Amb8388631 [1,0,0,0,1,0|2,0,0]=4 4720 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [1,0,0,0,1,0|2,0,0]=4 4721 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [1,0,0,0,1,0|1,0,0]=3 4722 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,0,0,1,0|0,0,2]=4 4723 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [1,0,0,0,1,0|0,0,2]=4 4724 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [1,0,0,0,1,0|2,0,0]=4 4725 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,0,0,0,1,0|1,1,0]=4 4726 B11R1.91 CC(Br)CCc1ccccc1 Amb8835399 [1,0,0,0,1,0|1,0,1]=4 4727 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [1,0,0,0,1,0|1,0,1]=4 4728 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [1,0,0,0,1,0|2,0,0]=4 4729 B11R1.91 CC(C)CCc1ccccc1 Amb4477358 [1,0,0,0,1,0|1,0,1]=4 4730 B11R1.91 CC(Cl)CCc1ccccc1 Amb9205035 [1,0,0,0,1,0|1,0,1]=4 4731 B11R1.91 CC(N)CCc1ccccc1 Amb5740105 [1,0,0,0,1,0|1,0,1]=4 4732 B11R1.91 CC(N)CCc1ccccc1 Amb6383144 [1,0,0,0,1,0|1,0,1]=4 4733 B11R1.91 CC(O)CCc1ccccc1 Amb4009672 [1,0,0,0,1,0|0,0,2]=4 4734 B11R1.91 CC(S)CCc1ccccc1 Amb7784713 [1,0,0,0,1,0|0,1,1]=4 4735 B11R1.91 CN(C)CCc1ccccc1 Amb3428717 [1,0,0,0,1,0|2,0,0]=4 4736 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,0,0,0,1,0|2,0,0]=4 4737 B11R1.91 CN(O)CCc1ccccc1 Amb32953149 [1,0,0,0,1,0|1,0,1]=4 4738 B11R1.91 C[C@@H](N)CCc1ccccc1 Amb8516709 [1,0,0,0,1,0|1,0,1]=4 4739 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,0,0,0,1,0|0,0,2]=4 4740 B11R1.91 C[C@H](Br)CCc1ccccc1 Amb27592949 [1,0,0,0,1,0|1,0,1]=4 4741 B11R1.91 C[C@H](N)CCc1ccccc1 Amb8516076 [1,0,0,0,1,0|1,0,1]=4 4742 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,0,0,0,1,0|0,0,2]=4 4743 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [1,0,0,0,1,0|2,0,0]=4 4744 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [1,0,0,0,1,0|2,0,0]=4 4745 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [1,0,0,0,1,0|2,0,0]=4 4746 B11R1.91 NC(=O)CC[n+]1ccccc1 Amb4010710 [1,0,0,0,1,0|2,0,0]=4 4747 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [1,0,0,0,1,0|1,0,0]=3 4748 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [1,0,0,0,1,0|2,0,0]=4 4749 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [1,0,0,0,1,0|2,0,0]=4 4750 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [1,0,0,0,1,0|2,0,0]=4 4751 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [1,0,0,0,1,0|2,0,0]=4 4752 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [1,0,0,0,1,0|2,0,0]=4 4753 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [1,0,0,0,1,0|2,0,0]=4 4754 B11R1.91 NC(=O)OCc1ccccc1 Amb4404204 [1,0,0,0,1,0|2,0,0]=4 4755 B11R1.91 NC(=O)SCc1ccccc1 Amb28342215 [1,0,0,0,1,0|2,0,0]=4 4756 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,0,0,0,1,0|1,1,0]=4 4757 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [1,0,0,0,1,0|1,0,0]=3 4758 B11R1.91 O=C(Cl)CCc1ccccn1 Amb2696649 [1,0,0,0,1,0|2,0,0]=4 4759 B11R1.91 O=C(Cl)CCc1cccnc1 Amb24077445 [1,0,0,0,1,0|2,0,0]=4 4760 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [1,0,0,0,1,0|2,0,0]=4 4761 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [1,0,0,0,1,0|2,0,0]=4 4762 B11R1.91 O=C(Cl)OCc1ccccc1 Amb6296595 [1,0,0,0,1,0|2,0,0]=4 4763 B11R1.91 O=C(F)OCc1ccccc1 Amb27879062 [1,0,0,0,1,0|2,0,0]=4 4764 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [1,0,0,0,1,0|0,0,2]=4 4765 B11R1.91 O=C(O)CC[n+]1ccccc1 Amb31127608 [1,0,0,0,1,0|1,0,0]=3 4766 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [1,0,0,0,1,0|0,0,0]=2 4767 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [1,0,0,0,1,0|1,0,0]=3 4768 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [1,0,0,0,1,0|1,0,0]=3 4769 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [1,0,0,0,1,0|1,0,0]=3 4770 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [1,0,0,0,1,0|1,0,0]=3 4771 B11R1.91 O=C(O)CCc1cccnn1 Amb23592184 [1,0,0,0,1,0|2,0,0]=4 4772 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [1,0,0,0,1,0|1,0,0]=3 4773 B11R1.91 O=C(O)CCc1ccncn1 Amb33545203 [1,0,0,0,1,0|2,0,0]=4 4774 B11R1.91 O=C(O)CCc1ccnnc1 Amb22499259 [1,0,0,0,1,0|2,0,0]=4 4775 B11R1.91 O=C(O)CCc1cnccn1 Amb5846608 [1,0,0,0,1,0|2,0,0]=4 4776 B11R1.91 O=C(O)CCc1cncnc1 Amb18201449 [1,0,0,0,1,0|2,0,0]=4 4777 B11R1.91 O=C(O)CCc1ncccn1 Amb3997808 [1,0,0,0,1,0|2,0,0]=4 4778 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [1,0,0,0,1,0|1,0,0]=3 4779 B11R1.91 O=C(O)CNc1ccccn1 Amb33549202 [1,0,0,0,1,0|2,0,0]=4 4780 B11R1.91 O=C(O)CNc1ccccn1 Amb4025757 [1,0,0,0,1,0|2,0,0]=4 4781 B11R1.91 O=C(O)CNc1cccnc1 Amb17593781 [1,0,0,0,1,0|2,0,0]=4 4782 B11R1.91 O=C(O)CNc1cccnc1 Amb22035240 [1,0,0,0,1,0|2,0,0]=4 4783 B11R1.91 O=C(O)CNc1ccncc1 Amb33549238 [1,0,0,0,1,0|2,0,0]=4 4784 B11R1.91 O=C(O)CNc1ccncc1 Amb6271127 [1,0,0,0,1,0|2,0,0]=4 4785 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [1,0,0,0,1,0|1,0,0]=3 4786 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [1,0,0,0,1,0|1,0,0]=3 4787 B11R1.91 O=C(O)COc1ccccn1 Amb2610077 [1,0,0,0,1,0|2,0,0]=4 4788 B11R1.91 O=C(O)COc1ccccn1 Amb34912615 [1,0,0,0,1,0|2,0,0]=4 4789 B11R1.91 O=C(O)COc1cccnc1 Amb22738612 [1,0,0,0,1,0|2,0,0]=4 4790 B11R1.91 O=C(O)COc1cccnc1 Amb33552775 [1,0,0,0,1,0|2,0,0]=4 4791 B11R1.91 O=C(O)COc1cccnc1 Amb836933 [1,0,0,0,1,0|2,0,0]=4 4792 B11R1.91 O=C(O)COc1ccncc1 Amb18125520 [1,0,0,0,1,0|2,0,0]=4 4793 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [1,0,0,0,1,0|1,0,0]=3 4794 B11R1.91 O=C(O)CSc1ccccn1 Amb1130490 [1,0,0,0,1,0|2,0,0]=4 4795 B11R1.91 O=C(O)CSc1ccncc1 Amb24053001 [1,0,0,0,1,0|2,0,0]=4 4796 B11R1.91 O=C(O)CSc1ccncc1 Amb3940121 [1,0,0,0,1,0|2,0,0]=4 4797 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [1,0,0,0,1,0|0,0,2]=4 4798 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [1,0,0,0,1,0|0,0,2]=4 4799 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [1,0,0,0,1,0|0,0,2]=4 4800 B11R1.91 O=C([O-])CCc1ccccn1 Amb32882485 [1,0,0,0,1,0|1,0,1]=4 4801 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [1,0,0,0,1,0|1,0,1]=4 4802 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [1,0,0,0,1,0|1,0,1]=4 4803 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [1,0,0,0,1,0|1,0,1]=4 4804 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [1,0,0,0,1,0|1,0,0]=3 4805 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [1,0,0,0,1,0|1,0,1]=4 4806 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [1,0,0,0,1,0|1,0,1]=4 4807 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [1,0,0,0,1,0|1,0,0]=3 4808 B11R1.91 OB(O)CCc1ccccc1 Amb2456045 [1,0,0,0,1,0|1,0,1]=4 4809 B11R1.172 CC(=O)CCCc1ccco1 Amb17232099 [1,0,0,0,1,0|1,0,0]=3 4810 B11R1.172 CC(=O)CCCc1cccs1 Amb17232678 [1,0,0,0,1,0|1,0,0]=3 4811 B11R1.172 CC(=O)CCCc1ccoc1 Amb28080133 [1,0,0,0,1,0|1,0,0]=3 4812 B11R1.172 CC(=O)CCCc1ccsc1 Amb27492050 [1,0,0,0,1,0|1,0,0]=3 4813 B11R1.172 CC(=O)CCCc1nccs1 Amb27492117 [1,0,0,0,1,0|2,0,0]=4 4814 B11R1.172 CC(=O)CCCn1cccn1 Amb9659583 [1,0,0,0,1,0|2,0,0]=4 4815 B11R1.172 CC(=O)CCNc1ccsc1 Amb32675826 [1,0,0,0,1,0|2,0,0]=4 4816 B11R1.172 CC(=O)CCSc1ccco1 Amb27672627 [1,0,0,0,1,0|2,0,0]=4 4817 B11R1.172 CC(=O)CSCc1ccco1 Amb6357577 [1,0,0,0,1,0|2,0,0]=4 4818 B11R1.172 CC(=O)CSCc1ccoc1 Amb27672517 [1,0,0,0,1,0|2,0,0]=4 4819 B11R1.172 CC(=O)NCCc1ccco1 Amb8336373 [1,0,0,0,1,0|2,0,0]=4 4820 B11R1.172 CC(=O)NCCc1ccoc1 Amb22643451 [1,0,0,0,1,0|2,0,0]=4 4821 B11R1.172 CC(=O)NCCn1cccc1 Amb2409180 [1,0,0,0,1,0|2,0,0]=4 4822 B11R1.172 CC(=O)OCCc1ccco1 Amb27272289 [1,0,0,0,1,0|2,0,0]=4 4823 B11R1.172 CC(=O)OCCc1cccs1 Amb24756179 [1,0,0,0,1,0|2,0,0]=4 4824 B11R1.172 NC(=O)CCCc1cccs1 Amb8858354 [1,0,0,0,1,0|2,0,0]=4 4825 B11R1.172 NC(=O)CCCn1cccc1 Amb13865744 [1,0,0,0,1,0|2,0,0]=4 4826 B11R1.172 O=C(O)CCCc1ccco1 Amb18125675 [1,0,0,0,1,0|1,0,0]=3 4827 B11R1.172 O=C(O)CCCc1cccs1 Amb1152340 [1,0,0,0,1,0|1,0,0]=3 4828 B11R1.172 O=C(O)CCCc1ccno1 Amb18200545 [1,0,0,0,1,0|2,0,0]=4 4829 B11R1.172 O=C(O)CCCc1ccoc1 Amb25385034 [1,0,0,0,1,0|1,0,0]=3 4830 B11R1.172 O=C(O)CCCc1ccon1 Amb24062140 [1,0,0,0,1,0|2,0,0]=4 4831 B11R1.172 O=C(O)CCCc1ccsc1 Amb22000608 [1,0,0,0,1,0|1,0,0]=3 4832 B11R1.172 O=C(O)CCCc1ccsn1 Amb18198614 [1,0,0,0,1,0|2,0,0]=4 4833 B11R1.172 O=C(O)CCCc1cnco1 Amb18200538 [1,0,0,0,1,0|2,0,0]=4 4834 B11R1.172 O=C(O)CCCc1cncs1 Amb18198607 [1,0,0,0,1,0|2,0,0]=4 4835 B11R1.172 O=C(O)CCCc1cocn1 Amb18200521 [1,0,0,0,1,0|2,0,0]=4 4836 B11R1.172 O=C(O)CCCc1cscn1 Amb18062607 [1,0,0,0,1,0|2,0,0]=4 4837 B11R1.172 O=C(O)CCCc1ncco1 Amb18559420 [1,0,0,0,1,0|2,0,0]=4 4838 B11R1.172 O=C(O)CCCc1nccs1 Amb18198612 [1,0,0,0,1,0|2,0,0]=4 4839 B11R1.172 O=C(O)CCCn1cccc1 Amb1130872 [1,0,0,0,1,0|1,0,0]=3 4840 B11R1.172 O=C(O)CCCn1cccn1 Amb6251039 [1,0,0,0,1,0|2,0,0]=4 4841 B11R1.172 O=C(O)CCCn1ccnc1 Amb13949166 [1,0,0,0,1,0|2,0,0]=4 4842 B11R1.172 O=C(O)CCCn1ccnc1 Amb2721839 [1,0,0,0,1,0|2,0,0]=4 4843 B11R1.172 O=C(O)CCSc1cccs1 Amb6717244 [1,0,0,0,1,0|2,0,0]=4 4844 B11R1.172 O=C(O)CCSc1ccoc1 Amb27988487 [1,0,0,0,1,0|2,0,0]=4 4845 B11R1.172 O=C(O)CNCc1ccco1 Amb2592332 [1,0,0,0,1,0|2,0,0]=4 4846 B11R1.172 O=C(O)CNCc1cccs1 Amb8827556 [1,0,0,0,1,0|2,0,0]=4 4847 B11R1.172 O=C(O)CNCc1ccsc1 Amb8827740 [1,0,0,0,1,0|2,0,0]=4 4848 B11R1.172 O=C(O)COCc1cccs1 Amb19015456 [1,0,0,0,1,0|2,0,0]=4 4849 B11R1.172 O=C(O)COCc1ccsc1 Amb27271137 [1,0,0,0,1,0|2,0,0]=4 4850 B11R1.172 O=C(O)CSCc1ccco1 Amb2721897 [1,0,0,0,1,0|2,0,0]=4 4851 B11R1.172 O=C(O)CSCc1cccs1 Amb423757 [1,0,0,0,1,0|2,0,0]=4 4852 B11R1.172 O=C(O)CSCc1ccsc1 Amb446162 [1,0,0,0,1,0|2,0,0]=4 4853 B11R1.172 O=C([O-])CCCc1cccs1 Amb33513078 [1,0,0,0,1,0|1,0,1]=4 4854 B11R1.25 CCC(=O)CCc1ccco1 Amb18177203 [0,0,0,0,2,0|2,0,0]=4 4855 B11R1.25 CNC(=O)CCc1ccco1 Amb8328018 [0,0,0,0,2,0|2,0,0]=4 4856 B11R1.25 CNC(=O)CCc1cccs1 Amb27464851 [0,0,0,0,2,0|2,0,0]=4 4857 B11R1.25 CNC(=O)CCc1ccsc1 Amb8331157 [0,0,0,0,2,0|2,0,0]=4 4858 B11R1.25 CNC(=O)CCn1cccc1 Amb18182791 [0,0,0,0,2,0|2,0,0]=4 4859 B11R1.25 COC(=N)CCc1ccco1 Amb18065394 [0,0,0,0,2,0|2,0,0]=4 4860 B11R1.25 COC(=N)CCc1cccs1 Amb18563908 [0,0,0,0,2,0|2,0,0]=4 4861 B11R1.25 COC(=O)CCc1ccno1 Amb24762935 [0,0,0,0,2,0|2,0,0]=4 4862 B11R1.25 COC(=O)CCc1ccoc1 Amb27272302 [0,0,0,0,2,0|1,0,0]=3 4863 B11R1.25 COC(=O)CCc1ccsc1 Amb27491907 [0,0,0,0,2,0|1,0,0]=3 4864 B11R1.25 COC(=O)CCc1cncs1 Amb28387274 [0,0,0,0,2,0|2,0,0]=4 4865 B11R1.25 COC(=O)CCc1cnoc1 Amb25382987 [0,0,0,0,2,0|2,0,0]=4 4866 B11R1.25 COC(=O)CCc1nccs1 Amb17334847 [0,0,0,0,2,0|2,0,0]=4 4867 B11R1.25 COC(=O)CCn1cccc1 Amb18799453 [0,0,0,0,2,0|1,0,0]=3 4868 B11R1.25 COC(=O)CCn1cccn1 Amb535322 [0,0,0,0,2,0|2,0,0]=4 4869 B11R1.25 COC(=O)CCn1ccnc1 Amb2794109 [0,0,0,0,2,0|2,0,0]=4 4870 B11R1.25 COC(=O)COc1ccsc1 Amb27988863 [0,0,0,0,2,0|2,0,0]=4 4871 B11R1.25 COC(=O)NCc1ccco1 Amb3363702 [0,0,0,0,2,0|2,0,0]=4 4872 B11R1.25 COC(=O)NCc1ccoc1 Amb27485865 [0,0,0,0,2,0|2,0,0]=4 4873 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,0,0,0,2,0|1,0,1]=4 4874 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,0,0,0,2,0|1,0,1]=4 4875 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [0,0,0,0,2,0|1,0,0]=3 4876 B11R1.40 CCC(=O)Cc1ccccn1 Amb9205933 [0,0,0,0,2,0|2,0,0]=4 4877 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [0,0,0,0,2,0|2,0,0]=4 4878 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [0,0,0,0,2,0|2,0,0]=4 4879 B11R1.40 CCC(=O)Oc1ccccc1 Amb2842289 [0,0,0,0,2,0|2,0,0]=4 4880 B11R1.40 CCC(=O)Sc1ccccc1 Amb26857967 [0,0,0,0,2,0|2,0,0]=4 4881 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [0,0,0,0,2,0|2,0,0]=4 4882 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [0,0,0,0,2,0|1,0,0]=3 4883 B11R1.40 CNC(=O)Cc1ccccn1 Amb28365941 [0,0,0,0,2,0|2,0,0]=4 4884 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [0,0,0,0,2,0|2,0,0]=4 4885 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [0,0,0,0,2,0|2,0,0]=4 4886 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [0,0,0,0,2,0|2,0,0]=4 4887 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [0,0,0,0,2,0|2,0,0]=4 4888 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,0,0,0,2,0|1,0,0]=3 4889 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,0,0,0,2,0|1,0,0]=3 4890 B11R1.40 COC(=N)Cc1ccncc1 Amb18182737 [0,0,0,0,2,0|2,0,0]=4 4891 B11R1.40 COC(=O)C[n+]1ccccc1 Amb26880684 [0,0,0,0,2,0|1,0,0]=3 4892 B11R1.40 COC(=O)C[n+]1ccccc1 Amb3433634 [0,0,0,0,2,0|1,0,0]=3 4893 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [0,0,0,0,2,0|0,0,0]=2 4894 B11R1.40 COC(=O)Cc1ccccn1 Amb1223230 [0,0,0,0,2,0|1,0,0]=3 4895 B11R1.40 COC(=O)Cc1cccnc1 Amb22497118 [0,0,0,0,2,0|1,0,0]=3 4896 B11R1.40 COC(=O)Cc1cccnc1 Amb4017567 [0,0,0,0,2,0|1,0,0]=3 4897 B11R1.40 COC(=O)Cc1cccnn1 Amb4296987 [0,0,0,0,2,0|2,0,0]=4 4898 B11R1.40 COC(=O)Cc1ccncc1 Amb20240688 [0,0,0,0,2,0|1,0,0]=3 4899 B11R1.40 COC(=O)Cc1ccncc1 Amb6892645 [0,0,0,0,2,0|1,0,0]=3 4900 B11R1.40 COC(=O)Cc1ccncn1 Amb22500240 [0,0,0,0,2,0|2,0,0]=4 4901 B11R1.40 COC(=O)Cc1ccnnc1 Amb22405879 [0,0,0,0,2,0|2,0,0]=4 4902 B11R1.40 COC(=O)Cc1cnccn1 Amb2695469 [0,0,0,0,2,0|2,0,0]=4 4903 B11R1.40 COC(=O)Cc1cncnc1 Amb25763089 [0,0,0,0,2,0|2,0,0]=4 4904 B11R1.40 COC(=O)Cc1ncccn1 Amb17912090 [0,0,0,0,2,0|2,0,0]=4 4905 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,0,0,0,2,0|1,0,0]=3 4906 B11R1.40 COC(=O)Nc1cccnc1 Amb2222993 [0,0,0,0,2,0|2,0,0]=4 4907 B11R1.40 COC(=O)Nc1ccncc1 Amb8439516 [0,0,0,0,2,0|2,0,0]=4 4908 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,0,0,0,2,0|1,0,0]=3 4909 B11R1.40 COC(=S)Nc1ccccc1 Amb2731871 [0,0,0,0,2,0|1,1,0]=4 4910 B11R1.40 CO\C(C)=C\c1ccccc1 Amb4020305 [0,0,0,0,2,0|1,0,1]=4 4911 B11R1.40 CO\C([O-])=N\c1ccccc1 Amb8488213 [0,0,0,0,2,0|1,0,1]=4 4912 B11R1.40 CSC(=O)Nc1ccccc1 Amb26618613 [0,0,0,0,2,0|1,1,0]=4 4913 B11R1.40 C\N=C(\N)Cc1ccccc1 Amb23569051 [0,0,0,0,2,0|2,0,0]=4 4914 B11R1.40 N#CC(=O)Cc1ccccc1 Amb26498532 [0,0,0,0,2,0|2,0,0]=4 4915 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,0,0,0,2,0|2,0,0]=4 4916 B11R1.40 NCC(=O)Cc1ccccc1 Amb33548503 [0,0,0,0,2,0|2,0,0]=4 4917 B11R1.40 NNC(=O)Cc1ccccc1 Amb6355837 [0,0,0,0,2,0|2,0,0]=4 4918 B11R1.40 NOC(=O)Oc1ccccc1 Amb27967373 [0,0,0,0,2,0|2,0,0]=4 4919 B11R1.40 O=C(CBr)Cc1ccccc1 Amb17569850 [0,0,0,0,2,0|2,0,0]=4 4920 B11R1.40 O=C(CCl)Cc1ccccc1 Amb2371529 [0,0,0,0,2,0|2,0,0]=4 4921 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,0,0,0,2,0|2,0,0]=4 4922 B15R1.962 C=CC(=O)NCCOCc1ccccc1 Amb28292743 [0,0,0,0,0,2|1,0,1]=4 4923 B15R1.962 CCC(=O)CCCSCc1ccccc1 Amb32682994 [0,0,0,0,0,2|1,0,0]=3 4924 B15R1.962 CCC(=O)OCCNCc1ccccc1 Amb18266491 [0,0,0,0,0,2|1,0,0]=3 4925 B15R1.962 CNC(=N)NCCOCc1ccccc1 Amb27200914 [0,0,0,0,0,2|2,0,0]=4 4926 B15R1.962 CNC(=O)NCCNCc1ccccc1 Amb28067934 [0,0,0,0,0,2|1,0,0]=3 4927 B15R1.962 CNC(=O)NCCOCc1ccccc1 Amb27435823 [0,0,0,0,0,2|1,0,0]=3 4928 B15R1.962 COC(=O)CCCNCc1ccccc1 Amb33549509 [0,0,0,0,0,2|0,0,0]=2 4929 B15R1.962 COC(=O)CCCNCc1ccccc1 Amb8951848 [0,0,0,0,0,2|0,0,0]=2 4930 B15R1.962 COC(=O)CCCOCc1ccccc1 Amb8961276 [0,0,0,0,0,2|0,0,0]=2 4931 B15R1.962 COC(=O)CCNOCc1ccccc1 Amb28118387 [0,0,0,0,0,2|0,0,0]=2 4932 B15R1.962 COC(=O)CCO\N=C\c1ccccc1 Amb32434936 [0,0,0,0,0,2|0,0,1]=3 4933 B15R1.962 COC(=O)COCCOc1ccccc1 Amb9206367 [0,0,0,0,0,2|0,0,0]=2 4934 B15R1.962 COC(=O)\C=C\COCc1ccccc1 Amb2697688 [0,0,0,0,0,2|0,0,1]=3 4935 B15R1.962 COC(C)CCCNCc1ccccc1 Amb24715257 [0,0,0,0,0,2|1,0,1]=4 4936 B15R1.962 NCC(=O)CCCOCc1ccccc1 Amb25854482 [0,0,0,0,0,2|2,0,0]=4 4937 B15R1.962 O=C(CCl)NCCCCc1ccccc1 Amb7969392 [0,0,0,0,0,2|2,0,0]=4 4938 B15R1.962 O=C(CCl)NCCCSc1ccccc1 Amb1672011 [0,0,0,0,0,2|2,0,0]=4 4939 B15R1.962 O=C(CCl)NCCSCc1ccccc1 Amb1656481 [0,0,0,0,0,2|2,0,0]=4 4940 B15R1.962 O=C(CS)NCCOCc1ccccc1 Amb27781246 [0,0,0,0,0,2|2,0,0]=4