0 B13R1.337 C=C(C)CCOCc1ccccc1 Amb27609705 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.337 C=C(C)\C=C\CCc1ccccc1 Amb22546754 [0,0,0,0,0,0|2,0,1]=3 2 B13R1.337 CC(=N)NC\C=C\c1ccccc1 Amb24366027 [0,0,0,0,0,0|2,0,2]=4 3 B13R1.337 CC(=O)C#CC#Cc1ccccc1 Amb17594204 [0,0,0,0,0,0|1,0,3]=4 4 B13R1.337 CC(=O)CCCCc1ccccc1 Amb8392140 [0,0,0,0,0,0|1,0,0]=1 5 B13R1.337 CC(=O)CCCSc1ccccc1 Amb9283938 [0,0,0,0,0,0|2,0,0]=2 6 B13R1.337 CC(=O)CCNCc1ccccc1 Amb23399608 [0,0,0,0,0,0|2,0,0]=2 7 B13R1.337 CC(=O)CCNCc1ccccc1 Amb8388282 [0,0,0,0,0,0|2,0,0]=2 8 B13R1.337 CC(=O)CCOCc1ccccc1 Amb16233219 [0,0,0,0,0,0|2,0,0]=2 9 B13R1.337 CC(=O)CCSCc1ccccc1 Amb9224165 [0,0,0,0,0,0|2,0,0]=2 10 B13R1.337 CC(=O)CC\C=C\c1ccccc1 Amb32952075 [0,0,0,0,0,0|1,0,2]=3 11 B13R1.337 CC(=O)NCC#Cc1ccccc1 Amb25119168 [0,0,0,0,0,0|1,0,2]=3 12 B13R1.337 CC(=O)NCC#Cc1ccccn1 Amb28454138 [0,0,0,0,0,0|2,0,2]=4 13 B13R1.337 CC(=O)NCCNc1ccccc1 Amb18933018 [0,0,0,0,0,0|2,0,0]=2 14 B13R1.337 CC(=O)NCCNc1cncnc1 Amb18932964 [0,0,0,0,0,0|4,0,0]=4 15 B13R1.337 CC(=O)NCCOc1ccccc1 Amb22524794 [0,0,0,0,0,0|2,0,0]=2 16 B13R1.337 CC(=O)NCCOc1cccnc1 Amb16229587 [0,0,0,0,0,0|3,0,0]=3 17 B13R1.337 CC(=O)NCCSc1ccccn1 Amb6840550 [0,0,0,0,0,0|3,0,0]=3 18 B13R1.337 CC(=O)NCCSc1ccncc1 Amb24073078 [0,0,0,0,0,0|3,0,0]=3 19 B13R1.337 CC(=O)NC\C=C\c1ccccc1 Amb24452225 [0,0,0,0,0,0|1,0,2]=3 20 B13R1.337 CC(=O)OCCOc1ccccc1 Amb10560141 [0,0,0,0,0,0|1,0,0]=1 21 B13R1.337 CC(=O)OCOCc1ccccc1 Amb27879863 [0,0,0,0,0,0|1,0,0]=1 22 B13R1.337 CC(=O)OC\C=C\c1ccccc1 Amb30640111 [0,0,0,0,0,0|0,0,2]=2 23 B13R1.337 CC(=O)OC\C=C\c1cccnc1 Amb9804427 [0,0,0,0,0,0|1,0,2]=3 24 B13R1.337 CC(=O)O\N=C\Nc1ccccn1 Amb27415765 [0,0,0,0,0,0|3,0,1]=4 25 B13R1.337 CC(=O)\C=C/C#Cc1ccccc1 Amb28122355 [0,0,0,0,0,0|1,0,3]=4 26 B13R1.337 CC(=O)\C=C/NCc1ccccc1 Amb17778144 [0,0,0,0,0,0|2,0,1]=3 27 B13R1.337 CC(=O)\C=C\C#Cc1ccccc1 Amb17594260 [0,0,0,0,0,0|1,0,3]=4 28 B13R1.337 CC(=O)\C=C\C=C\c1ccccc1 Amb27605732 [0,0,0,0,0,0|1,0,3]=4 29 B13R1.337 CC(=O)\C=C\CCc1ccccc1 Amb33083001 [0,0,0,0,0,0|1,0,1]=2 30 B13R1.337 CC(=O)\C=C\NCc1ccccc1 Amb25303594 [0,0,0,0,0,0|2,0,1]=3 31 B13R1.337 CC(=O)\C=N\NCc1ccccc1 Amb25767927 [0,0,0,0,0,0|3,0,0]=3 32 B13R1.337 CC(=O)\C=N\OCc1ccccc1 Amb25735259 [0,0,0,0,0,0|3,0,0]=3 33 B13R1.337 CC(C)=CCCNc1ccccc1 Amb29869593 [0,0,0,0,0,0|3,0,0]=3 34 B13R1.337 CC(C)=CCCNc1ccccn1 Amb28205694 [0,0,0,0,0,0|4,0,0]=4 35 B13R1.337 CC(C)CCNCc1ccccc1 Amb875690 [0,0,0,0,0,0|3,0,1]=4 36 B13R1.337 CC(C)CCOCc1ccccc1 Amb22230283 [0,0,0,0,0,0|3,0,1]=4 37 B13R1.337 CC(C)CNCCc1ccccc1 Amb2119559 [0,0,0,0,0,0|3,0,1]=4 38 B13R1.337 CC(C)CNCCc1ccccc1 Amb6695471 [0,0,0,0,0,0|3,0,1]=4 39 B13R1.337 CC(C)NCCCc1ccccc1 Amb2097980 [0,0,0,0,0,0|2,0,1]=3 40 B13R1.337 CC(C)NCCCc1ccccc1 Amb6242639 [0,0,0,0,0,0|2,0,1]=3 41 B13R1.337 CC(C)NCCOc1ccccc1 Amb13949173 [0,0,0,0,0,0|3,0,1]=4 42 B13R1.337 CC(C)NCCOc1ccccc1 Amb7759554 [0,0,0,0,0,0|3,0,1]=4 43 B13R1.337 CC(C)NCCSc1ccccc1 Amb10608751 [0,0,0,0,0,0|3,0,1]=4 44 B13R1.337 CC(C)SCCNc1ccccc1 Amb17307514 [0,0,0,0,0,0|2,1,1]=4 45 B13R1.337 CC(Cl)CCOCc1ccccc1 Amb27179202 [0,0,0,0,0,0|3,0,1]=4 46 B13R1.337 CC(N)CCOCc1ccccc1 Amb18180974 [0,0,0,0,0,0|3,0,1]=4 47 B13R1.337 CC(N)\C=C\CCc1ccccc1 Amb33082113 [0,0,0,0,0,0|2,0,2]=4 48 B13R1.337 CC(O)CCOCc1ccccc1 Amb18809337 [0,0,0,0,0,0|2,0,2]=4 49 B13R1.337 CC(O)CNCCc1ccccc1 Amb6888028 [0,0,0,0,0,0|2,0,2]=4 50 B13R1.337 CN(C)CCNCc1ccccc1 Amb3938959 [0,0,0,0,0,0|4,0,0]=4 51 B13R1.337 CS(=O)CCNCc1ccccc1 Amb27249261 [0,0,0,0,0,0|3,0,0]=3 52 B13R1.337 CS(=O)\C=C/NCc1ccccc1 Amb27876609 [0,0,0,0,0,0|3,0,1]=4 53 B13R1.337 CS(=O)\C=C\NCc1ccccc1 Amb27229970 [0,0,0,0,0,0|3,0,1]=4 54 B13R1.337 C\C(Cl)=C/CNCc1ccccc1 Amb1811425 [0,0,0,0,0,0|3,0,0]=3 55 B13R1.337 C\C(Cl)=C\CNCc1ccccc1 Amb4303980 [0,0,0,0,0,0|3,0,0]=3 56 B13R1.337 N=C(N)CCCOc1ccccc1 Amb6281567 [0,0,0,0,0,0|4,0,0]=4 57 B13R1.337 N=C(N)CCCOc1ccccc1 Amb8630657 [0,0,0,0,0,0|4,0,0]=4 58 B13R1.337 N=C(N)CCOCc1ccccc1 Amb8630423 [0,0,0,0,0,0|4,0,0]=4 59 B13R1.337 N=C(N)NCCCc1ccccc1 Amb838721 [0,0,0,0,0,0|3,0,0]=3 60 B13R1.337 N=C(N)SCCCc1ccccc1 Amb20676023 [0,0,0,0,0,0|2,1,0]=3 61 B13R1.337 N=C(N)SCCOc1ccccc1 Amb20676015 [0,0,0,0,0,0|3,1,0]=4 62 B13R1.337 NC(=O)CCC#Cc1ccccc1 Amb27179535 [0,0,0,0,0,0|2,0,2]=4 63 B13R1.337 NC(=O)CCCSc1ccccc1 Amb8997736 [0,0,0,0,0,0|3,0,0]=3 64 B13R1.337 NC(=O)CCNCc1ccccc1 Amb1223227 [0,0,0,0,0,0|3,0,0]=3 65 B13R1.337 NC(=O)CCNCc1ccccc1 Amb7077033 [0,0,0,0,0,0|3,0,0]=3 66 B13R1.337 NC(=O)CCNCc1cccnc1 Amb8841108 [0,0,0,0,0,0|4,0,0]=4 67 B13R1.337 NC(=O)CCOCc1ccccc1 Amb18796124 [0,0,0,0,0,0|3,0,0]=3 68 B13R1.337 NC(=O)NCC#Cc1ccccc1 Amb27479249 [0,0,0,0,0,0|2,0,2]=4 69 B13R1.337 NC(=O)NCCCc1ccccc1 Amb19514748 [0,0,0,0,0,0|2,0,0]=2 70 B13R1.337 NC(=O)NCCNc1ccccn1 Amb27763333 [0,0,0,0,0,0|4,0,0]=4 71 B13R1.337 NC(=O)NCCOc1ccccc1 Amb6328297 [0,0,0,0,0,0|3,0,0]=3 72 B13R1.337 NC(=O)NC\C=C\c1ccccc1 Amb24407866 [0,0,0,0,0,0|2,0,2]=4 73 B13R1.337 NC(=O)N\N=C\Cc1ccccc1 Amb17673737 [0,0,0,0,0,0|3,0,1]=4 74 B13R1.337 NC(=O)OCCCc1ccccc1 Amb8629108 [0,0,0,0,0,0|1,0,0]=1 75 B13R1.337 NC(=S)CCCOc1ccccc1 Amb6274847 [0,0,0,0,0,0|3,1,0]=4 76 B13R1.337 NC(=S)COCCc1ccccc1 Amb9208588 [0,0,0,0,0,0|3,1,0]=4 77 B13R1.337 NC(=S)NCCCc1ccccc1 Amb2690319 [0,0,0,0,0,0|2,1,0]=3 78 B13R1.337 NC(=S)NCCNc1ccccc1 Amb28398144 [0,0,0,0,0,0|3,1,0]=4 79 B13R1.337 O=C(Cl)CCCCc1ccccc1 Amb5739990 [0,0,0,0,0,0|2,0,0]=2 80 B13R1.337 O=C(Cl)CCCOc1ccccc1 Amb3939585 [0,0,0,0,0,0|3,0,0]=3 81 B13R1.337 O=C(Cl)CCCSc1ccccc1 Amb17143638 [0,0,0,0,0,0|3,0,0]=3 82 B13R1.337 O=C(Cl)CCOCc1ccccc1 Amb27146810 [0,0,0,0,0,0|3,0,0]=3 83 B13R1.337 O=C(Cl)OCC#Cc1ccccc1 Amb33297045 [0,0,0,0,0,0|1,0,2]=3 84 B13R1.337 O=C(Cl)OCCOc1ccccc1 Amb4135975 [0,0,0,0,0,0|2,0,0]=2 85 B13R1.337 O=C(O)C#CCCc1ccccc1 Amb25674935 [0,0,0,0,0,0|2,0,1]=3 86 B13R1.337 O=C(O)C#CCOc1ccccc1 Amb25897592 [0,0,0,0,0,0|3,0,1]=4 87 B13R1.337 O=C(O)CC#CCc1ccccc1 Amb28325663 [0,0,0,0,0,0|2,0,2]=4 88 B13R1.337 O=C(O)CCC#Cc1ccccc1 Amb26874532 [0,0,0,0,0,0|2,0,2]=4 89 B13R1.337 O=C(O)CCCC[n+]1ccccc1 Amb17098179 [0,0,0,0,0,0|3,0,0]=3 90 B13R1.337 O=C(O)CCCCc1ccccc1 Amb3940028 [0,0,0,0,0,0|2,0,0]=2 91 B13R1.337 O=C(O)CCCCc1cccnc1 Amb18128434 [0,0,0,0,0,0|3,0,0]=3 92 B13R1.337 O=C(O)CCCNc1ccccc1 Amb10189157 [0,0,0,0,0,0|3,0,0]=3 93 B13R1.337 O=C(O)CCCNc1ccccc1 Amb6260555 [0,0,0,0,0,0|3,0,0]=3 94 B13R1.337 O=C(O)CCCNc1ccccn1 Amb6257146 [0,0,0,0,0,0|4,0,0]=4 95 B13R1.337 O=C(O)CCCOc1ccccc1 Amb1233059 [0,0,0,0,0,0|3,0,0]=3 96 B13R1.337 O=C(O)CCCOc1cccnc1 Amb18809466 [0,0,0,0,0,0|4,0,0]=4 97 B13R1.337 O=C(O)CCCSc1ccccc1 Amb1105630 [0,0,0,0,0,0|3,0,0]=3 98 B13R1.337 O=C(O)CCNCc1ccccc1 Amb1207218 [0,0,0,0,0,0|3,0,0]=3 99 B13R1.337 O=C(O)CCNCc1ccccc1 Amb6892614 [0,0,0,0,0,0|3,0,0]=3 100 B13R1.337 O=C(O)CCNCc1ccccn1 Amb10187384 [0,0,0,0,0,0|4,0,0]=4 101 B13R1.337 O=C(O)CCNCc1ccccn1 Amb1111102 [0,0,0,0,0,0|4,0,0]=4 102 B13R1.337 O=C(O)CCNCc1cccnc1 Amb1110655 [0,0,0,0,0,0|4,0,0]=4 103 B13R1.337 O=C(O)CCNCc1cccnc1 Amb19373040 [0,0,0,0,0,0|4,0,0]=4 104 B13R1.337 O=C(O)CCNCc1ccncc1 Amb10187385 [0,0,0,0,0,0|4,0,0]=4 105 B13R1.337 O=C(O)CCNCc1ccncc1 Amb1109839 [0,0,0,0,0,0|4,0,0]=4 106 B13R1.337 O=C(O)CCOCc1ccccc1 Amb6281734 [0,0,0,0,0,0|3,0,0]=3 107 B13R1.337 O=C(O)CCSCc1ccccc1 Amb1132307 [0,0,0,0,0,0|3,0,0]=3 108 B13R1.337 O=C(O)CCSCc1ccccn1 Amb6268444 [0,0,0,0,0,0|4,0,0]=4 109 B13R1.337 O=C(O)CC\C=C\c1ccccc1 Amb17233184 [0,0,0,0,0,0|2,0,2]=4 110 B13R1.337 O=C(O)CNCCc1ccccc1 Amb19373721 [0,0,0,0,0,0|3,0,0]=3 111 B13R1.337 O=C(O)CNCCc1ccccc1 Amb7766521 [0,0,0,0,0,0|3,0,0]=3 112 B13R1.337 O=C(O)COCCc1ccccc1 Amb7790056 [0,0,0,0,0,0|3,0,0]=3 113 B13R1.337 O=C(O)CSCCc1ccccc1 Amb1244212 [0,0,0,0,0,0|3,0,0]=3 114 B13R1.337 O=C(O)CSCCc1ccccn1 Amb1798760 [0,0,0,0,0,0|4,0,0]=4 115 B13R1.337 O=C(O)C\C=C\Cc1ccccc1 Amb32667086 [0,0,0,0,0,0|2,0,2]=4 116 B13R1.337 O=C(O)\C=C\CCc1ccccc1 Amb17477496 [0,0,0,0,0,0|2,0,1]=3 117 B13R1.337 O=C(O)\C=C\CNc1ccccc1 Amb28041741 [0,0,0,0,0,0|3,0,1]=4 118 B13R1.337 O=C(O)\C=C\COc1ccccc1 Amb32652756 [0,0,0,0,0,0|3,0,1]=4 119 B13R1.337 O=C(O)\C=C\NCc1ccccc1 Amb28288822 [0,0,0,0,0,0|3,0,1]=4 120 B13R1.337 O=C(O)\C=C\OCc1ccccc1 Amb26376781 [0,0,0,0,0,0|3,0,1]=4 121 B13R1.337 O=C(O)\C=N\OCc1ccccc1 Amb10976080 [0,0,0,0,0,0|4,0,0]=4 122 B13R1.337 O=S([O-])CCOCc1ccccc1 Amb32755085 [0,0,0,0,0,0|4,0,0]=4 123 B13R1.337 O=[N+]([O-])\C=C\CCc1ccccc1 Amb32954288 [0,0,0,0,0,0|3,0,1]=4 124 B13R1.337 O=[PH](O)CCCCc1ccccc1 Amb24063702 [0,0,0,0,0,0|3,0,0]=3 125 B13R1.337 OB(O)CCCCc1ccccc1 Amb34174888 [0,0,0,0,0,0|3,0,1]=4 126 B13R1.337 OP(O)CCCCc1ccccc1 Amb24101082 [0,0,0,0,0,0|3,0,1]=4 127 B12R1.8 BrCCCCCc1ccccc1 Amb2685449 [1,0,0,0,0,0|2,0,1]=4 128 B12R1.8 C#CCCCCc1ccccc1 Amb18116407 [1,0,0,0,0,0|1,0,2]=4 129 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [1,0,0,0,0,0|1,0,1]=3 130 B12R1.8 C=CCCNCc1ccccc1 Amb6384625 [1,0,0,0,0,0|2,0,1]=4 131 B12R1.8 C=CCCOCc1ccccc1 Amb26862285 [1,0,0,0,0,0|2,0,1]=4 132 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [1,0,0,0,0,0|2,0,1]=4 133 B12R1.8 C=CCNCCc1ccccc1 Amb6683808 [1,0,0,0,0,0|2,0,1]=4 134 B12R1.8 CC#CCCCc1ccccc1 Amb4035132 [1,0,0,0,0,0|1,0,1]=3 135 B12R1.8 CC#CCCOc1ccccc1 Amb28319686 [1,0,0,0,0,0|2,0,1]=4 136 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [1,0,0,0,0,0|2,0,1]=4 137 B12R1.8 CC#CCNCc1ccccc1 Amb4084953 [1,0,0,0,0,0|2,0,1]=4 138 B12R1.8 CCCCCCc1ccccc1 Amb6613187 [1,0,0,0,0,0|1,0,1]=3 139 B12R1.8 CCCCCCc1ccccn1 Amb6357996 [1,0,0,0,0,0|2,0,1]=4 140 B12R1.8 CCCCCCc1cccnc1 Amb10807465 [1,0,0,0,0,0|2,0,1]=4 141 B12R1.8 CCCCCCc1ccncc1 Amb22235257 [1,0,0,0,0,0|2,0,1]=4 142 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [1,0,0,0,0,0|2,0,1]=4 143 B12R1.8 CCCCNCc1ccccc1 Amb2684625 [1,0,0,0,0,0|2,0,1]=4 144 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [1,0,0,0,0,0|2,0,1]=4 145 B12R1.8 CCCNCCc1ccccc1 Amb4358610 [1,0,0,0,0,0|2,0,1]=4 146 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [1,0,0,0,0,0|1,0,1]=3 147 B12R1.8 CCNCCCc1ccccc1 Amb6247947 [1,0,0,0,0,0|1,0,1]=3 148 B12R1.8 CCNCCOc1ccccc1 Amb2099717 [1,0,0,0,0,0|2,0,1]=4 149 B12R1.8 CCNCCOc1ccccc1 Amb6374462 [1,0,0,0,0,0|2,0,1]=4 150 B12R1.8 CCNCCSc1ccccc1 Amb10608724 [1,0,0,0,0,0|2,0,1]=4 151 B12R1.8 CCOCOCc1ccccc1 Amb27830530 [1,0,0,0,0,0|1,0,1]=3 152 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [1,0,0,0,0,0|1,1,1]=4 153 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [1,0,0,0,0,0|2,0,0]=3 154 B12R1.8 CNCCCCc1ccccc1 Amb8841760 [1,0,0,0,0,0|2,0,0]=3 155 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [1,0,0,0,0,0|3,0,0]=4 156 B12R1.8 CNCCCOc1ccccc1 Amb30982582 [1,0,0,0,0,0|3,0,0]=4 157 B12R1.8 CNCCCOc1ccccc1 Amb6893131 [1,0,0,0,0,0|3,0,0]=4 158 B12R1.8 CNCCCSc1ccccc1 Amb10608730 [1,0,0,0,0,0|3,0,0]=4 159 B12R1.8 CNCCCSc1ccccc1 Amb22588097 [1,0,0,0,0,0|3,0,0]=4 160 B12R1.8 CNCCNCc1ccccc1 Amb9200691 [1,0,0,0,0,0|3,0,0]=4 161 B12R1.8 CNCCOCc1ccccc1 Amb20668782 [1,0,0,0,0,0|3,0,0]=4 162 B12R1.8 CNCCOCc1ccccc1 Amb6374318 [1,0,0,0,0,0|3,0,0]=4 163 B12R1.8 CNCCSCc1ccccc1 Amb18809641 [1,0,0,0,0,0|3,0,0]=4 164 B12R1.8 COCCCNc1ccccc1 Amb17232551 [1,0,0,0,0,0|3,0,0]=4 165 B12R1.8 COCCNCc1ccccc1 Amb33387674 [1,0,0,0,0,0|3,0,0]=4 166 B12R1.8 COCCNCc1ccccc1 Amb6410960 [1,0,0,0,0,0|3,0,0]=4 167 B12R1.8 COCCOCc1ccccc1 Amb27467682 [1,0,0,0,0,0|3,0,0]=4 168 B12R1.8 CONCCCc1ccccc1 Amb32411014 [1,0,0,0,0,0|2,0,0]=3 169 B12R1.8 C\C=C\CCNc1ccccc1 Amb28119164 [1,0,0,0,0,0|2,0,0]=3 170 B12R1.8 C\C=C\CCNc1ccncc1 Amb27831175 [1,0,0,0,0,0|3,0,0]=4 171 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [1,0,0,0,0,0|2,0,1]=4 172 B12R1.8 ClCOCOCc1ccccc1 Amb27444693 [1,0,0,0,0,0|2,0,1]=4 173 B12R1.8 ICCCCCc1ccccc1 Amb32411025 [1,0,0,0,0,0|2,0,1]=4 174 B12R1.8 N#CCCCCc1ccccc1 Amb8392139 [1,0,0,0,0,0|2,0,1]=4 175 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [1,0,0,0,0,0|2,0,1]=4 176 B12R1.8 O=C=NCCCc1ccccc1 Amb5750728 [1,0,0,0,0,0|1,0,1]=3 177 B12R1.8 O=C=NCCCc1cccnc1 Amb31094170 [1,0,0,0,0,0|2,0,1]=4 178 B12R1.8 O=C=NCCCc1ccncc1 Amb31094171 [1,0,0,0,0,0|2,0,1]=4 179 B12R1.8 O=C=NCCOc1ccccc1 Amb13783673 [1,0,0,0,0,0|2,0,1]=4 180 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [1,0,0,0,0,0|1,0,0]=2 181 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [1,0,0,0,0,0|2,0,0]=3 182 B12R1.8 O=CCCOCc1ccccc1 Amb8394259 [1,0,0,0,0,0|2,0,0]=3 183 B12R1.8 O=CCCSCc1ccccc1 Amb18791178 [1,0,0,0,0,0|2,0,0]=3 184 B12R1.8 O=CCC\C=C\c1ccccc1 Amb18645368 [1,0,0,0,0,0|1,0,2]=4 185 B12R1.8 O=COC\C=C\c1ccccc1 Amb6357969 [1,0,0,0,0,0|0,0,2]=3 186 B12R1.8 O=C\C=C/NCc1ccccc1 Amb28054344 [1,0,0,0,0,0|2,0,1]=4 187 B12R1.8 O=C\C=C\CCc1ccccc1 Amb32954855 [1,0,0,0,0,0|1,0,1]=3 188 B12R1.8 O=C\C=C\NCc1ccccc1 Amb18645517 [1,0,0,0,0,0|2,0,1]=4 189 B12R1.8 OCOCOCc1ccccc1 Amb25803238 [1,0,0,0,0,0|1,0,2]=4 190 B12R1.8 ONCCCCc1ccccc1 Amb32679349 [1,0,0,0,0,0|2,0,1]=4 191 B12R1.8 ONCCCCc1ccccc1 Amb32679459 [1,0,0,0,0,0|2,0,1]=4 192 B12R1.8 O\C=C/NCCc1ccccc1 Amb27975397 [1,0,0,0,0,0|2,0,1]=4 193 B12R1.8 S=C=NCCCc1ccccc1 Amb5750753 [1,0,0,0,0,0|1,1,1]=4 194 B12R1.8 [C-]#[N+]CCCCc1ccccc1 Amb2690273 [1,0,0,0,0,0|2,0,1]=4 195 B12R1.8 [N-]=[N+]=NCCCc1ccccc1 Amb10572439 [1,0,0,0,0,0|3,0,0]=4 196 B14R1.148 CC(=O)CCCCc1cccc(Br)c1 Amb17264249 [0,1,0,0,0,0|1,0,0]=2 197 B14R1.148 CC(=O)CCCOc1cccc(F)c1 Amb9659942 [0,1,0,0,0,0|2,0,0]=3 198 B14R1.148 CC(=O)CCCSc1cccc(Br)c1 Amb32682857 [0,1,0,0,0,0|2,0,0]=3 199 B14R1.148 CC(=O)CCCSc1cccc(C)c1 Amb32682861 [0,1,0,0,0,0|2,0,0]=3 200 B14R1.148 CC(=O)CCCSc1cccc(Cl)c1 Amb32682858 [0,1,0,0,0,0|2,0,0]=3 201 B14R1.148 CC(=O)CCCSc1cccc(F)c1 Amb32682859 [0,1,0,0,0,0|2,0,0]=3 202 B14R1.148 CC(=O)CCSCc1cccc(C)c1 Amb32682894 [0,1,0,0,0,0|2,0,0]=3 203 B14R1.148 CC(=O)NCC#Cc1cccc(Cl)c1 Amb28251024 [0,1,0,0,0,0|1,0,2]=4 204 B14R1.148 CC(=O)NCCNc1cc(Br)ccn1 Amb27406591 [0,1,0,0,0,0|3,0,0]=4 205 B14R1.148 CC(=O)NCCNc1cc(C)ccn1 Amb19061759 [0,1,0,0,0,0|3,0,0]=4 206 B14R1.148 CC(=O)NCCNc1cc(N)ccn1 Amb19062591 [0,1,0,0,0,0|3,0,0]=4 207 B14R1.148 CC(=O)NCCNc1cccc(Br)n1 Amb28072543 [0,1,0,0,0,0|3,0,0]=4 208 B14R1.148 CC(=O)NCCNc1cccc(Cl)c1 Amb18270431 [0,1,0,0,0,0|2,0,0]=3 209 B14R1.148 CC(=O)NCCNc1cccc(F)c1 Amb18933375 [0,1,0,0,0,0|2,0,0]=3 210 B14R1.148 CC(=O)NCCNc1cccc(N)n1 Amb27471821 [0,1,0,0,0,0|3,0,0]=4 211 B14R1.148 CC(=O)NCCNc1cncc(Br)c1 Amb27404932 [0,1,0,0,0,0|3,0,0]=4 212 B14R1.148 CC(=O)NCCNc1cncc(Cl)c1 Amb29864886 [0,1,0,0,0,0|3,0,0]=4 213 B14R1.148 CC(=O)NCCOc1cc(Br)ccn1 Amb22276873 [0,1,0,0,0,0|3,0,0]=4 214 B14R1.148 CC(=O)NCCOc1cccc(Br)c1 Amb16229678 [0,1,0,0,0,0|2,0,0]=3 215 B14R1.148 CC(=O)NCCOc1cccc(F)c1 Amb9871487 [0,1,0,0,0,0|2,0,0]=3 216 B14R1.148 CC(=O)NCCOc1cccc(N)c1 Amb9870452 [0,1,0,0,0,0|2,0,0]=3 217 B14R1.148 CC(=O)OCCCc1cccc(N)c1 Amb28653244 [0,1,0,0,0,0|0,0,0]=1 218 B14R1.148 CC(=O)\C=C\CCc1cccc(Br)c1 Amb33433448 [0,1,0,0,0,0|1,0,1]=3 219 B14R1.148 CC(C)=CCCNc1cccc(Br)c1 Amb35582846 [0,1,0,0,0,0|3,0,0]=4 220 B14R1.148 CC(C)=CCCNc1cccc(C)c1 Amb35582901 [0,1,0,0,0,0|3,0,0]=4 221 B14R1.148 CC(C)=CCCNc1cccc(Cl)c1 Amb35623542 [0,1,0,0,0,0|3,0,0]=4 222 B14R1.148 CC(C)=CCCNc1cccc(F)c1 Amb30023726 [0,1,0,0,0,0|3,0,0]=4 223 B14R1.148 CC(C)=CCCNc1cccc(I)c1 Amb35582848 [0,1,0,0,0,0|3,0,0]=4 224 B14R1.148 CC(N)CCCCc1cccc(Br)c1 Amb33006666 [0,1,0,0,0,0|2,0,1]=4 225 B14R1.148 CC(O)CCCCc1cccc(Br)c1 Amb33006667 [0,1,0,0,0,0|1,0,2]=4 226 B14R1.148 C[C@@H](N)CCCCc1cccc(Br)c1 Amb33006678 [0,1,0,0,0,0|2,0,1]=4 227 B14R1.148 C[C@@H](O)CCCCc1cccc(Br)c1 Amb33006676 [0,1,0,0,0,0|1,0,2]=4 228 B14R1.148 C[C@H](N)CCCCc1cccc(Br)c1 Amb33006659 [0,1,0,0,0,0|2,0,1]=4 229 B14R1.148 C[C@H](O)CCCCc1cccc(Br)c1 Amb33006672 [0,1,0,0,0,0|1,0,2]=4 230 B14R1.148 Cc1cccc(CNCCC(=O)O)c1 Amb1111411 [0,1,0,0,0,0|3,0,0]=4 231 B14R1.148 Cc1cccc(CNCCC(=O)O)c1 Amb9154875 [0,1,0,0,0,0|3,0,0]=4 232 B14R1.148 Cc1cccc(CNCCC(N)=O)c1 Amb9277908 [0,1,0,0,0,0|3,0,0]=4 233 B14R1.148 Cc1cccc(NCCNC(N)=O)c1 Amb28241040 [0,1,0,0,0,0|3,0,0]=4 234 B14R1.148 Cc1cccc(OCCCC(=O)O)c1 Amb1206876 [0,1,0,0,0,0|3,0,0]=4 235 B14R1.148 Cc1cccc(OCCNC(N)=O)c1 Amb17235935 [0,1,0,0,0,0|3,0,0]=4 236 B14R1.148 Cc1cccc(SCCCC(=O)Cl)c1 Amb17144251 [0,1,0,0,0,0|3,0,0]=4 237 B14R1.148 Cc1cccc(SCCCC(N)=O)c1 Amb17143479 [0,1,0,0,0,0|3,0,0]=4 238 B14R1.148 NC(=O)NCCNc1cccc(Cl)c1 Amb28246386 [0,1,0,0,0,0|3,0,0]=4 239 B14R1.148 NC(=O)NCCNc1cccc(N)c1 Amb27489441 [0,1,0,0,0,0|3,0,0]=4 240 B14R1.148 NC(=O)NCCOc1cccc(Br)c1 Amb17266782 [0,1,0,0,0,0|3,0,0]=4 241 B14R1.148 NC(=O)NCCOc1cccc(Cl)c1 Amb17241797 [0,1,0,0,0,0|3,0,0]=4 242 B14R1.148 NC(=O)NCCOc1cccc(F)c1 Amb17236723 [0,1,0,0,0,0|3,0,0]=4 243 B14R1.148 Nc1cccc(CSCCC(=O)O)c1 Amb33802989 [0,1,0,0,0,0|3,0,0]=4 244 B14R1.148 Nc1cccc(OCCCC(=O)O)c1 Amb18111932 [0,1,0,0,0,0|3,0,0]=4 245 B14R1.148 O=C(Cl)CCCSc1cccc(Cl)c1 Amb17145378 [0,1,0,0,0,0|3,0,0]=4 246 B14R1.148 O=C(O)CCCCc1cccc(Br)c1 Amb18049692 [0,1,0,0,0,0|2,0,0]=3 247 B14R1.148 O=C(O)CCCCc1cccc(O)c1 Amb20668368 [0,1,0,0,0,0|2,0,0]=3 248 B14R1.148 O=C(O)CCCOc1cccc(Br)c1 Amb15371 [0,1,0,0,0,0|3,0,0]=4 249 B14R1.148 O=C(O)CCCOc1cccc(Cl)c1 Amb6252390 [0,1,0,0,0,0|3,0,0]=4 250 B14R1.148 O=C(O)CCCOc1cccc(F)c1 Amb1950653 [0,1,0,0,0,0|3,0,0]=4 251 B14R1.148 O=C(O)CCCSc1cccc(Cl)c1 Amb5776548 [0,1,0,0,0,0|3,0,0]=4 252 B14R1.148 O=C(O)CCNCc1cccc(Br)c1 Amb8833865 [0,1,0,0,0,0|3,0,0]=4 253 B14R1.148 O=C(O)CCNCc1cccc(Cl)c1 Amb10187387 [0,1,0,0,0,0|3,0,0]=4 254 B14R1.148 O=C(O)CCNCc1cccc(Cl)c1 Amb1110208 [0,1,0,0,0,0|3,0,0]=4 255 B14R1.148 O=C(O)CCNCc1cccc(F)c1 Amb2372350 [0,1,0,0,0,0|3,0,0]=4 256 B14R1.148 O=C(O)CCNCc1cccc(F)c1 Amb28600447 [0,1,0,0,0,0|3,0,0]=4 257 B14R1.148 O=C(O)COCCc1cccc(Br)c1 Amb17473652 [0,1,0,0,0,0|3,0,0]=4 258 B14R1.148 O=C(O)COCCc1cccc(Cl)c1 Amb17471508 [0,1,0,0,0,0|3,0,0]=4 259 B14R1.148 O=C(O)COCCc1cccc(F)c1 Amb17470974 [0,1,0,0,0,0|3,0,0]=4 260 B14R1.148 O=C(O)\C=C\CCc1cccc(Br)c1 Amb33433412 [0,1,0,0,0,0|2,0,1]=4 261 B14R1.148 O=[N+]([O-])CCCCc1cccc(Br)c1 Amb33006681 [0,1,0,0,0,0|3,0,0]=4 262 B14R1.159 CC(=O)CCCSc1ccccc1Br Amb9283522 [0,1,0,0,0,0|2,0,0]=3 263 B14R1.159 CC(=O)CCCSc1ccccc1C Amb32682860 [0,1,0,0,0,0|2,0,0]=3 264 B14R1.159 CC(=O)CCCSc1ccccc1Cl Amb9283485 [0,1,0,0,0,0|2,0,0]=3 265 B14R1.159 CC(=O)CCCSc1ccccc1F Amb9283476 [0,1,0,0,0,0|2,0,0]=3 266 B14R1.159 CC(=O)CCSCc1ccccc1C Amb32682895 [0,1,0,0,0,0|2,0,0]=3 267 B14R1.159 CC(=O)CCSCc1ccccc1Cl Amb32682891 [0,1,0,0,0,0|2,0,0]=3 268 B14R1.159 CC(=O)NCCNc1ccccc1C Amb27485613 [0,1,0,0,0,0|2,0,0]=3 269 B14R1.159 CC(=O)NCCNc1ccccc1N Amb9415066 [0,1,0,0,0,0|2,0,0]=3 270 B14R1.159 CC(=O)NCCNc1ccncc1F Amb35655015 [0,1,0,0,0,0|3,0,0]=4 271 B14R1.159 CC(=O)NCCNc1cnccc1N Amb28344426 [0,1,0,0,0,0|3,0,0]=4 272 B14R1.159 CC(=O)NCCNc1ncccc1Cl Amb9257541 [0,1,0,0,0,0|3,0,0]=4 273 B14R1.159 CC(=O)NCCNc1ncccc1F Amb19029646 [0,1,0,0,0,0|3,0,0]=4 274 B14R1.159 CC(=O)NCCNc1ncccc1I Amb28139543 [0,1,0,0,0,0|3,0,0]=4 275 B14R1.159 CC(=O)NCCNc1ncccc1N Amb9415061 [0,1,0,0,0,0|3,0,0]=4 276 B14R1.159 CC(=O)NCCOc1ccccc1Cl Amb6340266 [0,1,0,0,0,0|2,0,0]=3 277 B14R1.159 CC(=O)NCCOc1ccccc1F Amb6369742 [0,1,0,0,0,0|2,0,0]=3 278 B14R1.159 CC(=O)NCCOc1ccccc1N Amb17131704 [0,1,0,0,0,0|2,0,0]=3 279 B14R1.159 CC(C)=CCCNc1ccccc1Br Amb35582847 [0,1,0,0,0,0|3,0,0]=4 280 B14R1.159 CC(C)=CCCNc1ccccc1C Amb35582902 [0,1,0,0,0,0|3,0,0]=4 281 B14R1.159 CC(C)=CCCNc1ccccc1Cl Amb35623543 [0,1,0,0,0,0|3,0,0]=4 282 B14R1.159 CC(C)=CCCNc1ccccc1F Amb30023727 [0,1,0,0,0,0|3,0,0]=4 283 B14R1.159 CC(C)=CCCNc1ccccc1I Amb35582850 [0,1,0,0,0,0|3,0,0]=4 284 B14R1.159 Cc1cccc[n+]1CCCCC(=O)O Amb31127613 [0,1,0,0,0,0|3,0,0]=4 285 B14R1.159 Cc1ccccc1CNCCC(=O)O Amb2372159 [0,1,0,0,0,0|3,0,0]=4 286 B14R1.159 Cc1ccccc1OCCCC(=O)O Amb844942 [0,1,0,0,0,0|3,0,0]=4 287 B14R1.159 Cc1ccccc1OCCCC(N)=O Amb8858794 [0,1,0,0,0,0|3,0,0]=4 288 B14R1.159 Cc1ccccc1OCCNC(N)=O Amb17235933 [0,1,0,0,0,0|3,0,0]=4 289 B14R1.159 Cc1ccccc1SCCCC(=O)O Amb5768738 [0,1,0,0,0,0|3,0,0]=4 290 B14R1.159 N=C(N)NCCCc1ccccc1Br Amb18585755 [0,1,0,0,0,0|3,0,0]=4 291 B14R1.159 NC(=O)CCCSc1ccccc1Cl Amb17144304 [0,1,0,0,0,0|3,0,0]=4 292 B14R1.159 NC(=O)CCNCc1ccccc1Cl Amb8841116 [0,1,0,0,0,0|3,0,0]=4 293 B14R1.159 NC(=O)NCCOc1ccccc1Br Amb17266780 [0,1,0,0,0,0|3,0,0]=4 294 B14R1.159 NC(=O)NCCOc1ccccc1Cl Amb17241795 [0,1,0,0,0,0|3,0,0]=4 295 B14R1.159 NC(=O)NCCOc1ccccc1F Amb17236721 [0,1,0,0,0,0|3,0,0]=4 296 B14R1.159 NC(N)=NCCCc1ccccc1Br Amb32655942 [0,1,0,0,0,0|3,0,0]=4 297 B14R1.159 O=C(O)CCCCN1C=CC=CC1=O Amb18030499 [0,1,0,0,0,0|3,0,0]=4 298 B14R1.159 O=C(O)CCCOc1ccccc1Br Amb5764199 [0,1,0,0,0,0|3,0,0]=4 299 B14R1.159 O=C(O)CCCOc1ccccc1Cl Amb844943 [0,1,0,0,0,0|3,0,0]=4 300 B14R1.159 O=C(O)CCCOc1ccccc1F Amb1950642 [0,1,0,0,0,0|3,0,0]=4 301 B14R1.159 O=C(O)CCCSc1ccccc1Br Amb5772860 [0,1,0,0,0,0|3,0,0]=4 302 B14R1.159 O=C(O)CCCSc1ccccc1Cl Amb5769932 [0,1,0,0,0,0|3,0,0]=4 303 B14R1.159 O=C(O)CCNCc1ccccc1Cl Amb10187386 [0,1,0,0,0,0|3,0,0]=4 304 B14R1.159 O=C(O)CCNCc1ccccc1Cl Amb1110577 [0,1,0,0,0,0|3,0,0]=4 305 B14R1.159 O=C(O)CCNCc1ccccc1F Amb17758538 [0,1,0,0,0,0|3,0,0]=4 306 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 Amb10562812 [0,1,0,0,0,0|2,0,1]=4 307 B14R1.420 CC(=O)CCNC(C)c1ccccc1 Amb32675821 [0,1,0,0,0,0|2,0,0]=3 308 B14R1.420 CC(=O)\C=C\NC(C)c1ccccc1 Amb25324895 [0,1,0,0,0,0|2,0,1]=4 309 B14R1.420 CC(C)NCCC(C)c1ccccc1 Amb19073617 [0,1,0,0,0,0|2,0,1]=4 310 B14R1.420 CC(C)NCCC(C)c1ccccc1 Amb20673466 [0,1,0,0,0,0|2,0,1]=4 311 B14R1.420 CC(CCCC(=O)O)c1ccccc1 Amb17844447 [0,1,0,0,0,0|2,0,0]=3 312 B14R1.420 CC(CCNC(N)=O)c1ccccc1 Amb19074031 [0,1,0,0,0,0|2,0,0]=3 313 B14R1.420 CC(CNCC(=O)O)c1ccccc1 Amb9209651 [0,1,0,0,0,0|3,0,0]=4 314 B14R1.420 CC(COCC(=O)O)c1ccccc1 Amb32664591 [0,1,0,0,0,0|3,0,0]=4 315 B14R1.420 CC(NCCC(=O)O)c1ccccc1 Amb2372473 [0,1,0,0,0,0|3,0,0]=4 316 B14R1.420 CC(NCCC(N)=O)c1ccccc1 Amb8841102 [0,1,0,0,0,0|3,0,0]=4 317 B14R1.420 CC(SCCC(=O)O)c1ccccc1 Amb32410943 [0,1,0,0,0,0|3,0,0]=4 318 B14R1.420 CN(CCCC(=O)Cl)c1ccccc1 Amb17143525 [0,1,0,0,0,0|3,0,0]=4 319 B14R1.420 CN(CCCC(=O)O)c1ccccc1 Amb5775500 [0,1,0,0,0,0|3,0,0]=4 320 B14R1.420 CN(CCCC(N)=O)c1ccccc1 Amb17143114 [0,1,0,0,0,0|3,0,0]=4 321 B14R1.420 C\C(Cl)=C/CNC(C)c1ccccc1 Amb2693168 [0,1,0,0,0,0|3,0,0]=4 322 B14R1.420 NC(CCCC(=O)O)c1ccccc1 Amb34003661 [0,1,0,0,0,0|2,0,0]=3 323 B14R1.420 NC(CCCC(=O)O)c1ccccc1 Amb7770362 [0,1,0,0,0,0|2,0,0]=3 324 B14R1.420 NC(CCCC(=O)O)c1ccccn1 Amb18638961 [0,1,0,0,0,0|3,0,0]=4 325 B14R1.420 N[C@H](CCCC(=O)O)c1ccccc1 Amb33802006 [0,1,0,0,0,0|2,0,0]=3 326 B14R1.420 O=C(O)C#CCC(O)c1ccccc1 Amb28458453 [0,1,0,0,0,0|2,0,1]=4 327 B14R1.420 O=C(O)CCCC(=O)c1ccccc1 Amb2613191 [0,1,0,0,0,0|2,0,1]=4 328 B14R1.420 O=C(O)CCCC(O)c1ccccc1 Amb5740030 [0,1,0,0,0,0|2,0,0]=3 329 B14R1.420 O=C([O-])CCCC(O)c1ccccc1 Amb28653093 [0,1,0,0,0,0|2,0,0]=3 330 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 Amb8440130 [0,1,0,0,0,0|2,0,1]=4 331 B14R1.423 CC(=O)CCN(C)Cc1ccccc1 Amb17401563 [0,1,0,0,0,0|2,0,0]=3 332 B14R1.423 CC(=O)CC\C(C)=C\c1ccccc1 Amb33381234 [0,1,0,0,0,0|1,0,2]=4 333 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 Amb8332419 [0,1,0,0,0,0|2,0,1]=4 334 B14R1.423 CC(=O)NCC(C)Nc1ccccc1 Amb27646688 [0,1,0,0,0,0|2,0,0]=3 335 B14R1.423 CC(=O)NNC(=O)Cc1ccccc1 Amb3713082 [0,1,0,0,0,0|2,0,1]=4 336 B14R1.423 CC(=O)N\N=C(\N)Cc1ccccc1 Amb27803656 [0,1,0,0,0,0|2,0,1]=4 337 B14R1.423 CC(=O)ONC(=O)Nc1ccccc1 Amb28325851 [0,1,0,0,0,0|2,0,1]=4 338 B14R1.423 CC(=O)SCC(=O)Nc1ccccc1 Amb27585790 [0,1,0,0,0,0|1,1,1]=4 339 B14R1.423 CC(C)=CCC(=O)Cc1ccccc1 Amb17594894 [0,1,0,0,0,0|2,0,1]=4 340 B14R1.423 CC(CCC(=O)O)Cc1ccccc1 Amb5718197 [0,1,0,0,0,0|2,0,0]=3 341 B14R1.423 CC(Cc1ccccc1)NCC(=O)O Amb19042074 [0,1,0,0,0,0|3,0,0]=4 342 B14R1.423 CC(Cc1ccccc1)NCC(=O)O Amb4453185 [0,1,0,0,0,0|3,0,0]=4 343 B14R1.423 CN(CCC(=O)O)Cc1ccccc1 Amb15740934 [0,1,0,0,0,0|3,0,0]=4 344 B14R1.423 CN(CCC(=O)O)Cc1ccccc1 Amb5775403 [0,1,0,0,0,0|3,0,0]=4 345 B14R1.423 CN(CCC(N)=O)Cc1ccccc1 Amb578210 [0,1,0,0,0,0|3,0,0]=4 346 B14R1.423 NC(=O)OCC(N)Cc1ccccc1 Amb28653362 [0,1,0,0,0,0|1,0,0]=2 347 B14R1.423 NC(CCC(=O)O)Cc1ccccc1 Amb28750738 [0,1,0,0,0,0|2,0,0]=3 348 B14R1.423 NC(CCC(=O)O)Cc1ccccc1 Amb9782554 [0,1,0,0,0,0|2,0,0]=3 349 B14R1.423 N[C@@H](CCC(=O)O)Cc1ccccc1 Amb33816442 [0,1,0,0,0,0|2,0,0]=3 350 B14R1.677 C=C(C)CNCCc1ccc(F)cc1 Amb17317886 [0,1,0,0,0,0|3,0,0]=4 351 B14R1.677 CC(=O)CCCCc1ccc(Br)cc1 Amb17264251 [0,1,0,0,0,0|1,0,0]=2 352 B14R1.677 CC(=O)CCCCc1ccc(F)cc1 Amb17235953 [0,1,0,0,0,0|1,0,0]=2 353 B14R1.677 CC(=O)CCCSc1ccc(Br)cc1 Amb9283493 [0,1,0,0,0,0|2,0,0]=3 354 B14R1.677 CC(=O)CCCSc1ccc(C)cc1 Amb9283949 [0,1,0,0,0,0|2,0,0]=3 355 B14R1.677 CC(=O)CCCSc1ccc(Cl)cc1 Amb9283484 [0,1,0,0,0,0|2,0,0]=3 356 B14R1.677 CC(=O)CCCSc1ccc(F)cc1 Amb9283474 [0,1,0,0,0,0|2,0,0]=3 357 B14R1.677 CC(=O)CCSCc1ccc(Cl)cc1 Amb32682892 [0,1,0,0,0,0|2,0,0]=3 358 B14R1.677 CC(=O)CC\C=C\c1ccc(Br)cc1 Amb18228461 [0,1,0,0,0,0|1,0,2]=4 359 B14R1.677 CC(=O)CC\C=C\c1ccc(C)cc1 Amb18224841 [0,1,0,0,0,0|1,0,2]=4 360 B14R1.677 CC(=O)CC\C=C\c1ccc(Cl)cc1 Amb18865910 [0,1,0,0,0,0|1,0,2]=4 361 B14R1.677 CC(=O)CC\C=C\c1ccc(F)cc1 Amb18863723 [0,1,0,0,0,0|1,0,2]=4 362 B14R1.677 CC(=O)NCC#Cc1ccc(F)cc1 Amb27759375 [0,1,0,0,0,0|1,0,2]=4 363 B14R1.677 CC(=O)NCCCc1ccc(N)cc1 Amb17139367 [0,1,0,0,0,0|1,0,0]=2 364 B14R1.677 CC(=O)NCCNc1ccc(Br)cn1 Amb9415175 [0,1,0,0,0,0|3,0,0]=4 365 B14R1.677 CC(=O)NCCNc1ccc(F)cc1 Amb18270423 [0,1,0,0,0,0|2,0,0]=3 366 B14R1.677 CC(=O)NCCNc1ccc(N)cc1 Amb9415054 [0,1,0,0,0,0|2,0,0]=3 367 B14R1.677 CC(=O)NCCNc1ccc(N)cn1 Amb9415065 [0,1,0,0,0,0|3,0,0]=4 368 B14R1.677 CC(=O)NCCNc1ccc(N)nc1 Amb9415056 [0,1,0,0,0,0|3,0,0]=4 369 B14R1.677 CC(=O)NCCOc1ccc(Br)cc1 Amb1094624 [0,1,0,0,0,0|2,0,0]=3 370 B14R1.677 CC(=O)NCCOc1ccc(C)cc1 Amb1014121 [0,1,0,0,0,0|2,0,0]=3 371 B14R1.677 CC(=O)NCCOc1ccc(Cl)cc1 Amb1014120 [0,1,0,0,0,0|2,0,0]=3 372 B14R1.677 CC(=O)NCCOc1ccc(F)cc1 Amb6340267 [0,1,0,0,0,0|2,0,0]=3 373 B14R1.677 CC(=O)NCCOc1ccc(N)cc1 Amb16229560 [0,1,0,0,0,0|2,0,0]=3 374 B14R1.677 CC(=O)NCCOc1ccc(O)cc1 Amb6353790 [0,1,0,0,0,0|2,0,0]=3 375 B14R1.677 CC(=O)NCCSc1ccc(O)cc1 Amb19514711 [0,1,0,0,0,0|2,0,0]=3 376 B14R1.677 CC(=O)OCCCc1ccc(Br)cc1 Amb24046248 [0,1,0,0,0,0|0,0,0]=1 377 B14R1.677 CC(=O)OCCOc1ccc(Br)cc1 Amb22493613 [0,1,0,0,0,0|1,0,0]=2 378 B14R1.677 CC(=O)OCCOc1ccc(C)cc1 Amb22735029 [0,1,0,0,0,0|1,0,0]=2 379 B14R1.677 CC(=O)\C=C\CCc1ccc(Br)cc1 Amb33331842 [0,1,0,0,0,0|1,0,1]=3 380 B14R1.677 CC(=O)\C=C\CCc1ccc(F)cc1 Amb33319359 [0,1,0,0,0,0|1,0,1]=3 381 B14R1.677 CC(C)=CCCNc1ccc(Br)cc1 Amb35582845 [0,1,0,0,0,0|3,0,0]=4 382 B14R1.677 CC(C)=CCCNc1ccc(C)cc1 Amb35582903 [0,1,0,0,0,0|3,0,0]=4 383 B14R1.677 CC(C)=CCCNc1ccc(Cl)cc1 Amb35623541 [0,1,0,0,0,0|3,0,0]=4 384 B14R1.677 CC(C)=CCCNc1ccc(F)cc1 Amb30023725 [0,1,0,0,0,0|3,0,0]=4 385 B14R1.677 CC(C)=CCCNc1ccc(I)cc1 Amb35582849 [0,1,0,0,0,0|3,0,0]=4 386 B14R1.677 CC(C)=CCNCc1ccc(Cl)cc1 Amb33172870 [0,1,0,0,0,0|3,0,0]=4 387 B14R1.677 CC(C)=CCNCc1ccc(Cl)cc1 Amb33172871 [0,1,0,0,0,0|3,0,0]=4 388 B14R1.677 CC(N)CCCCc1ccc(Br)cc1 Amb33006393 [0,1,0,0,0,0|2,0,1]=4 389 B14R1.677 CC(N)CCCCc1ccc(F)cc1 Amb33319693 [0,1,0,0,0,0|2,0,1]=4 390 B14R1.677 CC(O)CCCCc1ccc(Br)cc1 Amb33006028 [0,1,0,0,0,0|1,0,2]=4 391 B14R1.677 CC(O)CCCCc1ccc(F)cc1 Amb33319663 [0,1,0,0,0,0|1,0,2]=4 392 B14R1.677 C[C@@H](N)CCCCc1ccc(Br)cc1 Amb33006038 [0,1,0,0,0,0|2,0,1]=4 393 B14R1.677 C[C@@H](N)CCCCc1ccc(F)cc1 Amb33319660 [0,1,0,0,0,0|2,0,1]=4 394 B14R1.677 C[C@@H](O)CCCCc1ccc(Br)cc1 Amb33006036 [0,1,0,0,0,0|1,0,2]=4 395 B14R1.677 C[C@@H](O)CCCCc1ccc(F)cc1 Amb33319661 [0,1,0,0,0,0|1,0,2]=4 396 B14R1.677 C[C@H](N)CCCCc1ccc(Br)cc1 Amb33006039 [0,1,0,0,0,0|2,0,1]=4 397 B14R1.677 C[C@H](N)CCCCc1ccc(F)cc1 Amb33319659 [0,1,0,0,0,0|2,0,1]=4 398 B14R1.677 C[C@H](O)CCCCc1ccc(Br)cc1 Amb33006032 [0,1,0,0,0,0|1,0,2]=4 399 B14R1.677 C[C@H](O)CCCCc1ccc(F)cc1 Amb33319662 [0,1,0,0,0,0|1,0,2]=4 400 B14R1.677 Cc1ccc(CCC#CC(=O)O)cc1 Amb27480244 [0,1,0,0,0,0|2,0,1]=4 401 B14R1.677 Cc1ccc(CCCCC(=O)O)cc1 Amb5739973 [0,1,0,0,0,0|2,0,0]=3 402 B14R1.677 Cc1ccc(CCCNC(=N)N)cc1 Amb18565018 [0,1,0,0,0,0|3,0,0]=4 403 B14R1.677 Cc1ccc(CCOCC(=O)O)cc1 Amb17065886 [0,1,0,0,0,0|3,0,0]=4 404 B14R1.677 Cc1ccc(CCSCC(=O)O)cc1 Amb17065871 [0,1,0,0,0,0|3,0,0]=4 405 B14R1.677 Cc1ccc(CNCCC(=O)O)cc1 Amb7755667 [0,1,0,0,0,0|3,0,0]=4 406 B14R1.677 Cc1ccc(CSCCC(=O)O)cc1 Amb6275781 [0,1,0,0,0,0|3,0,0]=4 407 B14R1.677 Cc1ccc(OCCCC(=O)Cl)cc1 Amb17143550 [0,1,0,0,0,0|3,0,0]=4 408 B14R1.677 Cc1ccc(OCCCC(=O)O)cc1 Amb1204762 [0,1,0,0,0,0|3,0,0]=4 409 B14R1.677 Cc1ccc(OCCNC(N)=O)cc1 Amb9871510 [0,1,0,0,0,0|3,0,0]=4 410 B14R1.677 Cc1ccc(SCCCC(=O)O)cc1 Amb6250329 [0,1,0,0,0,0|3,0,0]=4 411 B14R1.677 NC(=O)CCCCc1ccc(F)cc1 Amb28653432 [0,1,0,0,0,0|2,0,0]=3 412 B14R1.677 NC(=O)CCCOc1ccc(Cl)cc1 Amb9172037 [0,1,0,0,0,0|3,0,0]=4 413 B14R1.677 NC(=O)CCCOc1ccc(F)cc1 Amb8998982 [0,1,0,0,0,0|3,0,0]=4 414 B14R1.677 NC(=O)CCCSc1ccc(Cl)cc1 Amb8858368 [0,1,0,0,0,0|3,0,0]=4 415 B14R1.677 NC(=O)NCCNc1ccc(N)cc1 Amb27986156 [0,1,0,0,0,0|3,0,0]=4 416 B14R1.677 NC(=O)NCCOc1ccc(Br)cc1 Amb17266784 [0,1,0,0,0,0|3,0,0]=4 417 B14R1.677 NC(=O)NCCOc1ccc(Cl)cc1 Amb17241799 [0,1,0,0,0,0|3,0,0]=4 418 B14R1.677 NC(=O)NCCOc1ccc(F)cc1 Amb17236725 [0,1,0,0,0,0|3,0,0]=4 419 B14R1.677 Nc1ccc(CSCCC(=O)O)cc1 Amb17498383 [0,1,0,0,0,0|3,0,0]=4 420 B14R1.677 Nc1ccc(NCCCC(=O)O)cc1 Amb19374547 [0,1,0,0,0,0|3,0,0]=4 421 B14R1.677 Nc1ccc(OCCCC(=O)O)cc1 Amb8470923 [0,1,0,0,0,0|3,0,0]=4 422 B14R1.677 O=C(Cl)CCCCc1ccc(F)cc1 Amb5739998 [0,1,0,0,0,0|2,0,0]=3 423 B14R1.677 O=C(Cl)CCCOc1ccc(Cl)cc1 Amb17144450 [0,1,0,0,0,0|3,0,0]=4 424 B14R1.677 O=C(Cl)CCCOc1ccc(F)cc1 Amb17143677 [0,1,0,0,0,0|3,0,0]=4 425 B14R1.677 O=C(Cl)CCCSc1ccc(Cl)cc1 Amb17145379 [0,1,0,0,0,0|3,0,0]=4 426 B14R1.677 O=C(O)CCCCc1ccc(Br)cc1 Amb5739981 [0,1,0,0,0,0|2,0,0]=3 427 B14R1.677 O=C(O)CCCCc1ccc(Cl)cc1 Amb5739980 [0,1,0,0,0,0|2,0,0]=3 428 B14R1.677 O=C(O)CCCCc1ccc(F)cc1 Amb2688400 [0,1,0,0,0,0|2,0,0]=3 429 B14R1.677 O=C(O)CCCCc1ccc(I)cc1 Amb7770315 [0,1,0,0,0,0|2,0,0]=3 430 B14R1.677 O=C(O)CCCCc1ccc(O)cc1 Amb6357606 [0,1,0,0,0,0|2,0,0]=3 431 B14R1.677 O=C(O)CCCNc1ccc(I)cc1 Amb7785115 [0,1,0,0,0,0|3,0,0]=4 432 B14R1.677 O=C(O)CCCOc1ccc(Br)cc1 Amb15374 [0,1,0,0,0,0|3,0,0]=4 433 B14R1.677 O=C(O)CCCOc1ccc(Cl)cc1 Amb1950628 [0,1,0,0,0,0|3,0,0]=4 434 B14R1.677 O=C(O)CCCOc1ccc(F)cc1 Amb6662832 [0,1,0,0,0,0|3,0,0]=4 435 B14R1.677 O=C(O)CCCOc1ccc(I)cc1 Amb8838528 [0,1,0,0,0,0|3,0,0]=4 436 B14R1.677 O=C(O)CCCSc1ccc(Br)cc1 Amb5779473 [0,1,0,0,0,0|3,0,0]=4 437 B14R1.677 O=C(O)CCCSc1ccc(Cl)cc1 Amb1102903 [0,1,0,0,0,0|3,0,0]=4 438 B14R1.677 O=C(O)CCCSc1ccc(F)cc1 Amb6243753 [0,1,0,0,0,0|3,0,0]=4 439 B14R1.677 O=C(O)CCNCc1ccc(Br)cc1 Amb8831944 [0,1,0,0,0,0|3,0,0]=4 440 B14R1.677 O=C(O)CCNCc1ccc(Cl)cc1 Amb1110486 [0,1,0,0,0,0|3,0,0]=4 441 B14R1.677 O=C(O)CCNCc1ccc(Cl)cc1 Amb33552192 [0,1,0,0,0,0|3,0,0]=4 442 B14R1.677 O=C(O)CCNCc1ccc(F)cc1 Amb10187378 [0,1,0,0,0,0|3,0,0]=4 443 B14R1.677 O=C(O)CCNCc1ccc(F)cc1 Amb1109654 [0,1,0,0,0,0|3,0,0]=4 444 B14R1.677 O=C(O)CCSCc1ccc(Cl)cc1 Amb6277653 [0,1,0,0,0,0|3,0,0]=4 445 B14R1.677 O=C(O)CCSCc1ccc(F)cc1 Amb6261702 [0,1,0,0,0,0|3,0,0]=4 446 B14R1.677 O=C(O)COCCc1ccc(Br)cc1 Amb17065893 [0,1,0,0,0,0|3,0,0]=4 447 B14R1.677 O=C(O)COCCc1ccc(Cl)cc1 Amb17065894 [0,1,0,0,0,0|3,0,0]=4 448 B14R1.677 O=C(O)COCCc1ccc(F)cc1 Amb17470972 [0,1,0,0,0,0|3,0,0]=4 449 B14R1.677 O=C(O)CSCCc1ccc(F)cc1 Amb17065879 [0,1,0,0,0,0|3,0,0]=4 450 B14R1.677 O=C(O)\C=C\CCc1ccc(Br)cc1 Amb33332185 [0,1,0,0,0,0|2,0,1]=4 451 B14R1.677 O=C(O)\C=C\CCc1ccc(F)cc1 Amb33320655 [0,1,0,0,0,0|2,0,1]=4 452 B14R1.677 O=C([O-])CCCCc1ccc(F)cc1 Amb33513289 [0,1,0,0,0,0|2,0,0]=3 453 B14R1.677 O=C1C=CN(CCCCC(=O)O)C=C1 Amb18029470 [0,1,0,0,0,0|3,0,0]=4 454 B14R1.677 O=[N+]([O-])CCCCc1ccc(Br)cc1 Amb33006040 [0,1,0,0,0,0|3,0,0]=4 455 B14R1.677 O=[N+]([O-])CCCCc1ccc(F)cc1 Amb33319638 [0,1,0,0,0,0|3,0,0]=4 456 B14R1.716 C#CC(=O)CCNCc1ccccc1 Amb33131464 [0,1,0,0,0,0|2,0,1]=4 457 B14R1.716 C=CC(=O)CCNCc1ccccc1 Amb33131465 [0,1,0,0,0,0|2,0,1]=4 458 B14R1.716 C=CC(=O)CCOCc1ccccc1 Amb27472400 [0,1,0,0,0,0|2,0,1]=4 459 B14R1.716 CC(C=O)OCC#Cc1ccccc1 Amb28144073 [0,1,0,0,0,0|0,0,3]=4 460 B14R1.716 CC(CN)NCCCc1ccccc1 Amb24119035 [0,1,0,0,0,0|2,0,1]=4 461 B14R1.716 CCC(=O)CCCSc1ccccc1 Amb32682990 [0,1,0,0,0,0|2,0,0]=3 462 B14R1.716 CCC(=O)CCNCc1ccccc1 Amb25040589 [0,1,0,0,0,0|2,0,0]=3 463 B14R1.716 CCC(=O)NCNCc1ccccc1 Amb28252142 [0,1,0,0,0,0|2,0,0]=3 464 B14R1.716 CCC(=O)OCCOc1ccccc1 Amb4005896 [0,1,0,0,0,0|1,0,0]=2 465 B14R1.716 CCC(=O)\C=C/NCc1ccccc1 Amb27965467 [0,1,0,0,0,0|2,0,1]=4 466 B14R1.716 CCC(C)NCCCc1ccccc1 Amb20673663 [0,1,0,0,0,0|2,0,1]=4 467 B14R1.716 CCC(C)NCCCc1ccccc1 Amb9749932 [0,1,0,0,0,0|2,0,1]=4 468 B14R1.716 CCS(=O)CCNCc1ccccc1 Amb28255222 [0,1,0,0,0,0|3,0,0]=4 469 B14R1.716 CNC(=O)CCNCc1cccnc1 Amb19079385 [0,1,0,0,0,0|3,0,0]=4 470 B14R1.716 CNC(=O)CCNCc1cccnc1 Amb19984984 [0,1,0,0,0,0|3,0,0]=4 471 B14R1.716 CNC(=O)CCOCc1ccccc1 Amb26361930 [0,1,0,0,0,0|2,0,0]=3 472 B14R1.716 CNC(=O)NCCNc1ccccc1 Amb27764648 [0,1,0,0,0,0|2,0,0]=3 473 B14R1.716 CNC(=O)NCCNc1ccccn1 Amb28400407 [0,1,0,0,0,0|3,0,0]=4 474 B14R1.716 CNC(=O)OCCOc1ccccc1 Amb24081214 [0,1,0,0,0,0|1,0,0]=2 475 B14R1.716 COC(=N)CCOCc1ccccc1 Amb27444424 [0,1,0,0,0,0|3,0,0]=4 476 B14R1.716 COC(=O)C#CCOc1ccccc1 Amb27755610 [0,1,0,0,0,0|2,0,1]=4 477 B14R1.716 COC(=O)C#CCSc1ccccc1 Amb27795338 [0,1,0,0,0,0|2,0,1]=4 478 B14R1.716 COC(=O)CCCCc1ccccc1 Amb8392132 [0,1,0,0,0,0|1,0,0]=2 479 B14R1.716 COC(=O)CCCCc1ccccn1 Amb24113266 [0,1,0,0,0,0|2,0,0]=3 480 B14R1.716 COC(=O)CCCNc1ccccn1 Amb18933129 [0,1,0,0,0,0|3,0,0]=4 481 B14R1.716 COC(=O)CCCNc1ccncc1 Amb18933138 [0,1,0,0,0,0|3,0,0]=4 482 B14R1.716 COC(=O)CCCSc1ccccc1 Amb8950459 [0,1,0,0,0,0|2,0,0]=3 483 B14R1.716 COC(=O)CCNCc1ccccc1 Amb288483 [0,1,0,0,0,0|2,0,0]=3 484 B14R1.716 COC(=O)CCNCc1ccccc1 Amb996333 [0,1,0,0,0,0|2,0,0]=3 485 B14R1.716 COC(=O)CCNCc1ccccn1 Amb8830818 [0,1,0,0,0,0|3,0,0]=4 486 B14R1.716 COC(=O)CCNCc1cccnc1 Amb9203455 [0,1,0,0,0,0|3,0,0]=4 487 B14R1.716 COC(=O)CCNCc1ccncc1 Amb8830819 [0,1,0,0,0,0|3,0,0]=4 488 B14R1.716 COC(=O)CCOCc1ccccc1 Amb7773811 [0,1,0,0,0,0|2,0,0]=3 489 B14R1.716 COC(=O)CNCCc1ccccc1 Amb6686977 [0,1,0,0,0,0|2,0,0]=3 490 B14R1.716 COC(=O)NCC#Cc1ccccc1 Amb24374036 [0,1,0,0,0,0|1,0,2]=4 491 B14R1.716 C[C@@H](C=O)CCOCc1ccccc1 Amb27957589 [0,1,0,0,0,0|2,0,1]=4 492 B14R1.716 C\C(=C\COCc1ccccc1)CN Amb27461189 [0,1,0,0,0,0|3,0,0]=4 493 B14R1.716 C\C(=C\COCc1ccccc1)CO Amb27827297 [0,1,0,0,0,0|2,0,1]=4 494 B14R1.716 C\C(CCNCc1ccccc1)=N/O Amb27483946 [0,1,0,0,0,0|2,0,1]=4 495 B14R1.716 NCC(=O)NCCCc1ccccc1 Amb5783138 [0,1,0,0,0,0|1,0,0]=2 496 B14R1.716 NCC(=O)NCCOc1ccccc1 Amb17235931 [0,1,0,0,0,0|2,0,0]=3 497 B14R1.716 NNC(=O)CCCOc1ccccc1 Amb8998039 [0,1,0,0,0,0|3,0,0]=4 498 B14R1.716 NNC(=O)CCNCc1ccccc1 Amb28382954 [0,1,0,0,0,0|3,0,0]=4 499 B14R1.716 NNC(=O)CCOCc1ccccc1 Amb26521710 [0,1,0,0,0,0|3,0,0]=4 500 B14R1.716 O=C(CBr)NCCCc1ccccc1 Amb17323643 [0,1,0,0,0,0|1,0,0]=2 501 B14R1.716 O=C(CBr)NCCOc1ccccc1 Amb17333035 [0,1,0,0,0,0|2,0,0]=3 502 B14R1.716 O=C(CCl)NCC#Cc1ccccc1 Amb19514326 [0,1,0,0,0,0|1,0,2]=4 503 B14R1.716 O=C(CCl)NCCCc1ccccc1 Amb1103589 [0,1,0,0,0,0|1,0,0]=2 504 B14R1.716 O=C(CCl)NCCCc1ccccn1 Amb31176172 [0,1,0,0,0,0|2,0,0]=3 505 B14R1.716 O=C(CCl)NCCCc1cccnc1 Amb31176175 [0,1,0,0,0,0|2,0,0]=3 506 B14R1.716 O=C(CCl)NCCCc1ccncc1 Amb31176177 [0,1,0,0,0,0|2,0,0]=3 507 B14R1.716 O=C(CCl)NCCOc1ccccc1 Amb6336217 [0,1,0,0,0,0|2,0,0]=3 508 B14R1.716 O=C(CCl)NCCSc1ccccc1 Amb1657260 [0,1,0,0,0,0|2,0,0]=3 509 B14R1.716 O=C(CCl)NC\C=C\c1ccccc1 Amb31158323 [0,1,0,0,0,0|1,0,2]=4 510 B14R1.716 O=C(CCl)OCCCc1ccccc1 Amb3372153 [0,1,0,0,0,0|0,0,0]=1 511 B14R1.716 O=C(CO)CCOCc1ccccc1 Amb28139815 [0,1,0,0,0,0|2,0,0]=3 512 B14R1.716 O=CC(=O)OCC#Cc1ccccc1 Amb28194554 [0,1,0,0,0,0|0,0,3]=4 513 B14R1.716 OC\C(F)=C\COCc1ccccc1 Amb27484682 [0,1,0,0,0,0|3,0,0]=4 514 B14R1.818 C=C(C)CC(C)NCc1ccccc1 Amb27632466 [0,1,0,0,0,0|3,0,0]=4 515 B14R1.818 CC(=O)CC(=O)NCc1ccccc1 Amb1034892 [0,1,0,0,0,0|2,0,1]=4 516 B14R1.818 CC(=O)CC(=O)OCc1ccccc1 Amb6357286 [0,1,0,0,0,0|2,0,1]=4 517 B14R1.818 CC(=O)CC(=S)NCc1ccccc1 Amb24451576 [0,1,0,0,0,0|2,0,1]=4 518 B14R1.818 CC(=O)CC(C)OCc1ccccc1 Amb28319449 [0,1,0,0,0,0|2,0,0]=3 519 B14R1.818 CC(=O)CC(C)SCc1ccccc1 Amb32683046 [0,1,0,0,0,0|2,0,0]=3 520 B14R1.818 CC(=O)NC(=O)CCc1ccccc1 Amb27387927 [0,1,0,0,0,0|1,0,1]=3 521 B14R1.818 CC(=O)NC(=S)NCc1ccccc1 Amb2054418 [0,1,0,0,0,0|2,0,1]=4 522 B14R1.818 CC(=O)NC(C)NCc1ccccc1 Amb27773815 [0,1,0,0,0,0|2,0,0]=3 523 B14R1.818 CC(=O)OC(C)C#Cc1ccccc1 Amb25676953 [0,1,0,0,0,0|0,0,2]=3 524 B14R1.818 CC(=O)OC(C)CCc1ccccc1 Amb4034624 [0,1,0,0,0,0|0,0,0]=1 525 B14R1.818 CC(=O)\C=C(\C)NCc1ccccc1 Amb4297998 [0,1,0,0,0,0|2,0,1]=4 526 B14R1.818 CC(C)=CC(C)OCc1ccccc1 Amb17844386 [0,1,0,0,0,0|3,0,0]=4 527 B14R1.818 CC(C)NC(C)CCc1ccccc1 Amb6685419 [0,1,0,0,0,0|2,0,1]=4 528 B14R1.818 CC(CC(=O)O)NCc1ccccc1 Amb6357298 [0,1,0,0,0,0|3,0,0]=4 529 B14R1.818 CC(CCc1ccccc1)CC(=O)O Amb6749216 [0,1,0,0,0,0|2,0,0]=3 530 B14R1.818 CC(CCc1ccccc1)NC(=N)N Amb19073485 [0,1,0,0,0,0|3,0,0]=4 531 B14R1.818 CC(CNc1ccccc1)NC(N)=O Amb28122040 [0,1,0,0,0,0|3,0,0]=4 532 B14R1.818 CN(CCc1ccccc1)CC(=O)O Amb28653100 [0,1,0,0,0,0|3,0,0]=4 533 B14R1.818 CN(CCc1ccccc1)CC(=O)O Amb9301012 [0,1,0,0,0,0|3,0,0]=4 534 B14R1.818 C[C@@H](CC(=O)O)NCc1ccccc1 Amb25124067 [0,1,0,0,0,0|3,0,0]=4 535 B14R1.818 C[C@@H](CC(=O)O)OCc1ccccc1 Amb24335959 [0,1,0,0,0,0|3,0,0]=4 536 B14R1.818 C[C@H](CC(N)=O)OCc1ccccc1 Amb27817889 [0,1,0,0,0,0|3,0,0]=4 537 B14R1.818 C\C(=C/C(=O)O)CCc1ccccc1 Amb6749184 [0,1,0,0,0,0|2,0,1]=4 538 B14R1.818 NC(CCc1ccccc1)CC(=O)O Amb1993736 [0,1,0,0,0,0|2,0,0]=3 539 B14R1.818 NC(CCc1ccccc1)CC(=O)O Amb30117911 [0,1,0,0,0,0|2,0,0]=3 540 B14R1.818 N[C@@H](CCc1ccccc1)CC(=O)O Amb19887670 [0,1,0,0,0,0|2,0,0]=3 541 B14R1.818 N[C@@H](CCc1ccccc1)CC(=O)O Amb22746249 [0,1,0,0,0,0|2,0,0]=3 542 B14R1.818 N[C@H](CCc1ccccc1)CC(=O)O Amb16231748 [0,1,0,0,0,0|2,0,0]=3 543 B14R1.818 N[C@H](CCc1ccccc1)CC(=O)O Amb19888418 [0,1,0,0,0,0|2,0,0]=3 544 B14R1.3331 CS(=O)(=O)OCCCc1ccccc1 Amb27215331 [0,1,0,0,0,0|1,0,0]=2 545 B14R1.3331 CS(=O)(=O)OCCCc1cccnc1 Amb25983993 [0,1,0,0,0,0|2,0,0]=3 546 B14R1.3331 CS(=O)(=O)OCCCc1ccncc1 Amb26421941 [0,1,0,0,0,0|2,0,0]=3 547 B14R1.3331 CS(=O)(=O)OCCNc1ccccc1 Amb27957907 [0,1,0,0,0,0|2,0,0]=3 548 B14R1.3331 CS(=O)(=O)OCCOc1ccccc1 Amb4035420 [0,1,0,0,0,0|2,0,0]=3 549 B14R1.3331 NS(=O)(=O)CCCCc1ccccc1 Amb32715396 [0,1,0,0,0,0|3,0,0]=4 550 B14R1.3331 O=P(O)(O)CCCCc1ccccc1 Amb8629287 [0,1,0,0,0,0|3,0,0]=4 551 B14R1.3331 O=S(=O)(Cl)CCCCc1ccccc1 Amb18560100 [0,1,0,0,0,0|3,0,0]=4 552 B14R1.6449 C=C(C)C(=O)CNCc1ccccc1 Amb33307880 [0,1,0,0,0,0|3,0,0]=4 553 B14R1.6449 C=C(C)C(Cl)COCc1ccccc1 Amb28074840 [0,1,0,0,0,0|3,0,0]=4 554 B14R1.6449 C=C(CNCc1ccccc1)C(=O)O Amb27465081 [0,1,0,0,0,0|3,0,0]=4 555 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 Amb17401500 [0,1,0,0,0,0|2,0,0]=3 556 B14R1.6449 CC(=O)[C@H](C)COCc1ccccc1 Amb27750417 [0,1,0,0,0,0|2,0,0]=3 557 B14R1.6449 CC(CCCc1ccccc1)C(=O)O Amb17235376 [0,1,0,0,0,0|2,0,0]=3 558 B14R1.6449 CC(CCOc1ccccc1)C(=O)O Amb17235913 [0,1,0,0,0,0|3,0,0]=4 559 B14R1.6449 CC(CNCc1ccccc1)C(=O)O Amb20623866 [0,1,0,0,0,0|3,0,0]=4 560 B14R1.6449 CC(CNCc1ccccc1)C(=O)O Amb9400318 [0,1,0,0,0,0|3,0,0]=4 561 B14R1.6449 CC(COCc1ccccc1)C(=O)O Amb9399793 [0,1,0,0,0,0|3,0,0]=4 562 B14R1.6449 CC(COCc1ccccc1)C(N)=O Amb26620812 [0,1,0,0,0,0|3,0,0]=4 563 B14R1.6449 CC(CSCc1ccccc1)C(=O)O Amb9400039 [0,1,0,0,0,0|3,0,0]=4 564 B14R1.6449 CC(OCCc1ccccc1)C(=O)O Amb7790062 [0,1,0,0,0,0|3,0,0]=4 565 B14R1.6449 CN(C)C(=S)CCCc1ccccc1 Amb24072816 [0,1,0,0,0,0|3,0,0]=4 566 B14R1.6449 CN(CCNc1ccccc1)C(N)=O Amb16229498 [0,1,0,0,0,0|3,0,0]=4 567 B14R1.6449 C[C@H](COCc1ccccc1)C(N)=O Amb27814268 [0,1,0,0,0,0|3,0,0]=4 568 B14R1.6449 NC(=O)C(N)CNCc1ccccc1 Amb27183784 [0,1,0,0,0,0|3,0,0]=4 569 B14R1.6449 NC(=O)C(N)COCc1ccccc1 Amb25809213 [0,1,0,0,0,0|3,0,0]=4 570 B14R1.6449 NC(=O)C(O)CNCc1ccccc1 Amb28075787 [0,1,0,0,0,0|3,0,0]=4 571 B14R1.6449 NC(=O)C(O)COCc1ccccc1 Amb27591575 [0,1,0,0,0,0|3,0,0]=4 572 B14R1.6449 NC(=O)[C@H](N)COCc1ccccc1 Amb27174294 [0,1,0,0,0,0|3,0,0]=4 573 B14R1.6449 NC(CCCc1ccccc1)C(=O)O Amb19342362 [0,1,0,0,0,0|2,0,0]=3 574 B14R1.6449 NC(CCCc1ccccc1)C(=O)O Amb9726682 [0,1,0,0,0,0|2,0,0]=3 575 B14R1.6449 NC(CCOc1ccccc1)C(=O)O Amb32752690 [0,1,0,0,0,0|3,0,0]=4 576 B14R1.6449 NC(CCOc1ccccc1)C(=O)O Amb33547968 [0,1,0,0,0,0|3,0,0]=4 577 B14R1.6449 NC(CCSc1ccccc1)C(=O)O Amb28653163 [0,1,0,0,0,0|3,0,0]=4 578 B14R1.6449 NC(CNCc1ccccc1)C(=O)O Amb26032867 [0,1,0,0,0,0|3,0,0]=4 579 B14R1.6449 NC(CNCc1ccccc1)C(=O)O Amb28750769 [0,1,0,0,0,0|3,0,0]=4 580 B14R1.6449 NC(COCc1ccccc1)C(=O)O Amb3941669 [0,1,0,0,0,0|3,0,0]=4 581 B14R1.6449 NC(CSCc1ccccc1)C(=O)O Amb9726318 [0,1,0,0,0,0|3,0,0]=4 582 B14R1.6449 N[C@@H](CCCc1ccccc1)C(=O)O Amb20241024 [0,1,0,0,0,0|2,0,0]=3 583 B14R1.6449 N[C@@H](CCOc1ccccc1)C(=O)O Amb32667500 [0,1,0,0,0,0|3,0,0]=4 584 B14R1.6449 N[C@@H](COCc1ccccc1)C(=O)O Amb2760730 [0,1,0,0,0,0|3,0,0]=4 585 B14R1.6449 N[C@@H](COCc1ccccc1)C(=O)O Amb31289420 [0,1,0,0,0,0|3,0,0]=4 586 B14R1.6449 N[C@@H](CSCc1ccccc1)C(=O)O Amb533304 [0,1,0,0,0,0|3,0,0]=4 587 B14R1.6449 N[C@H](CCCc1ccccc1)C(=O)O Amb6295896 [0,1,0,0,0,0|2,0,0]=3 588 B14R1.6449 N[C@H](CCOc1ccccc1)C(=O)O Amb32668011 [0,1,0,0,0,0|3,0,0]=4 589 B14R1.6449 N[C@H](CCOc1ccccc1)C(=O)O Amb32668012 [0,1,0,0,0,0|3,0,0]=4 590 B14R1.6449 N[C@H](CNCc1ccccc1)C(=O)O Amb8389449 [0,1,0,0,0,0|3,0,0]=4 591 B14R1.6449 N[C@H](COCc1ccccc1)C(=O)O Amb19944297 [0,1,0,0,0,0|3,0,0]=4 592 B14R1.6449 N[C@H](COCc1ccccc1)C(=O)O Amb3938903 [0,1,0,0,0,0|3,0,0]=4 593 B14R1.6449 N[C@H](CSCc1ccccc1)C(=O)O Amb8389452 [0,1,0,0,0,0|3,0,0]=4 594 B14R1.6449 O=C(O)C(=O)NCCc1ccccc1 Amb9303971 [0,1,0,0,0,0|3,0,0]=4 595 B14R1.6449 O=C(O)C(F)CNCc1ccccc1 Amb27858443 [0,1,0,0,0,0|3,0,0]=4 596 B14R1.6449 O=C(O)C(O)CNCc1ccccc1 Amb28240691 [0,1,0,0,0,0|3,0,0]=4 597 B14R1.6449 O=C(O)C(O)COCc1ccccc1 Amb8393609 [0,1,0,0,0,0|3,0,0]=4 598 B14R1.6449 O=C(O)[C@@H](O)COCc1ccccc1 Amb25088415 [0,1,0,0,0,0|3,0,0]=4 599 B14R1.6449 O=C(O)[C@H](O)COCc1ccccc1 Amb24428781 [0,1,0,0,0,0|3,0,0]=4 600 B14R2.2 CC(=N)NC1CCc2ccccc21 Amb27647883 [0,0,0,1,0,0|2,0,0]=3 601 B14R2.2 CC(=O)CC1CCc2ccccc21 Amb26020778 [0,0,0,1,0,0|1,0,0]=2 602 B14R2.2 CC(=O)NC1=CCc2ccccc21 Amb22270448 [0,0,0,1,0,0|1,0,2]=4 603 B14R2.2 CC(=O)NC1CCc2ccccc21 Amb8391858 [0,0,0,1,0,0|1,0,0]=2 604 B14R2.2 CC(=O)NC1CSc2ccccc21 Amb27753570 [0,0,0,1,0,0|2,0,0]=3 605 B14R2.2 CC(=O)N[C@@H]1CCc2ccccc21 Amb28255664 [0,0,0,1,0,0|1,0,0]=2 606 B14R2.2 CC(=O)N[C@H]1CCc2ccccc21 Amb27167719 [0,0,0,1,0,0|1,0,0]=2 607 B14R2.2 CC(=O)OC1CCc2ccccc21 Amb24323359 [0,0,0,1,0,0|0,0,0]=1 608 B14R2.2 CC(=O)OC1CCc2cccnc21 Amb22497182 [0,0,0,1,0,0|1,0,0]=2 609 B14R2.2 CC(=O)Oc1coc2ccccc12 Amb6357855 [0,0,0,1,0,0|1,0,2]=4 610 B14R2.2 CC(=O)Oc1noc2ccccc12 Amb27158049 [0,0,0,1,0,0|2,0,1]=4 611 B14R2.2 CC(=O)\C=C1/OCc2ccccc21 Amb19651458 [0,0,0,1,0,0|2,0,1]=4 612 B14R2.2 CC(=O)\C=C1\OCc2ccccc21 Amb27185877 [0,0,0,1,0,0|2,0,1]=4 613 B14R2.2 CC(Br)CC1CCc2ccccc21 Amb33430894 [0,0,0,1,0,0|2,0,1]=4 614 B14R2.2 CC(C)NC1CCc2ccccc21 Amb6685456 [0,0,0,1,0,0|2,0,1]=4 615 B14R2.2 CC(N)CC1CCc2ccccc21 Amb33745573 [0,0,0,1,0,0|2,0,1]=4 616 B14R2.2 CC(O)CC1CCc2ccccc21 Amb33145769 [0,0,0,1,0,0|1,0,2]=4 617 B14R2.2 CN(O)CC1CCc2ccccc21 Amb33146109 [0,0,0,1,0,0|2,0,1]=4 618 B14R2.2 CS(=O)\N=C1\CCc2ccccc21 Amb29858777 [0,0,0,1,0,0|2,0,1]=4 619 B14R2.2 C[C@@H](N)CC1CCc2ccccc21 Amb33145119 [0,0,0,1,0,0|2,0,1]=4 620 B14R2.2 C[C@@H](O)CC1CCc2ccccc21 Amb33226439 [0,0,0,1,0,0|1,0,2]=4 621 B14R2.2 C[C@H](N)CC1CCc2ccccc21 Amb33145118 [0,0,0,1,0,0|2,0,1]=4 622 B14R2.2 C[C@H](O)CC1CCc2ccccc21 Amb33145117 [0,0,0,1,0,0|1,0,2]=4 623 B14R2.2 N=C(N)CC1CCc2ccccc21 Amb33144967 [0,0,0,1,0,0|3,0,0]=4 624 B14R2.2 N=C(N)NC1CCc2ccccc21 Amb18183953 [0,0,0,1,0,0|3,0,0]=4 625 B14R2.2 N=C(N)SC1CCc2ccccc21 Amb22330388 [0,0,0,1,0,0|2,1,0]=4 626 B14R2.2 N=C(N)SC1CCc2ccccc21 Amb24113402 [0,0,0,1,0,0|2,1,0]=4 627 B14R2.2 NC(=O)CC1CCc2ccccc21 Amb17233113 [0,0,0,1,0,0|2,0,0]=3 628 B14R2.2 NC(=O)CC1COc2ccccc21 Amb28242506 [0,0,0,1,0,0|3,0,0]=4 629 B14R2.2 NC(=O)CN1CCc2ccccc21 Amb8342950 [0,0,0,1,0,0|3,0,0]=4 630 B14R2.2 NC(=O)\C=C1\CCc2ccccc21 Amb26609942 [0,0,0,1,0,0|2,0,1]=4 631 B14R2.2 NC(=S)CC1CCc2ccccc21 Amb33144212 [0,0,0,1,0,0|2,1,0]=4 632 B14R2.2 NC(N)=NC1CCc2ccccc21 Amb33550638 [0,0,0,1,0,0|3,0,0]=4 633 B14R2.2 O=C(Cl)CN1CCc2ccccc21 Amb2695676 [0,0,0,1,0,0|3,0,0]=4 634 B14R2.2 O=C(Cl)NC1COc2ccccc21 Amb35625887 [0,0,0,1,0,0|3,0,0]=4 635 B14R2.2 O=C(O)CC1CCc2ccccc21 Amb33528469 [0,0,0,1,0,0|2,0,0]=3 636 B14R2.2 O=C(O)CC1CNc2ccccc21 Amb19429209 [0,0,0,1,0,0|3,0,0]=4 637 B14R2.2 O=C(O)CC1CNc2ccccc21 Amb6739958 [0,0,0,1,0,0|3,0,0]=4 638 B14R2.2 O=C(O)CC1COc2ccccc21 Amb26960397 [0,0,0,1,0,0|3,0,0]=4 639 B14R2.2 O=C(O)CC1CSc2ccccc21 Amb27618125 [0,0,0,1,0,0|3,0,0]=4 640 B14R2.2 O=C(O)CC1NCc2ccccc21 Amb18196180 [0,0,0,1,0,0|3,0,0]=4 641 B14R2.2 O=C(O)CC1OCc2ccccc21 Amb18195570 [0,0,0,1,0,0|3,0,0]=4 642 B14R2.2 O=C(O)CN1CCc2ccccc21 Amb2695675 [0,0,0,1,0,0|3,0,0]=4 643 B14R2.2 O=C(O)CN1CCc2ccccc21 Amb8630136 [0,0,0,1,0,0|3,0,0]=4 644 B14R2.2 O=C(O)\C=C1/CCc2ccccc21 Amb18035939 [0,0,0,1,0,0|2,0,1]=4 645 B14R2.2 O=[N+]([O-])CC1CCc2ccccc21 Amb33226437 [0,0,0,1,0,0|3,0,0]=4 646 B14R2.19 BrC1CCC(Cc2ccccc2)C1 Amb25345569 [0,0,0,1,0,0|2,0,1]=4 647 B14R2.19 C=C1CCN(Cc2ccccc2)C1 Amb19334016 [0,0,0,1,0,0|3,0,0]=4 648 B14R2.19 CC1=CCC(Cc2ccccc2)=C1 Amb27398578 [0,0,0,1,0,0|2,0,1]=4 649 B14R2.19 CC1=NC(Cc2ccccc2)CO1 Amb26964500 [0,0,0,1,0,0|1,0,0]=2 650 B14R2.19 CC1CC(Cc2ccccc2)CN1 Amb9777222 [0,0,0,1,0,0|2,0,1]=4 651 B14R2.19 CC1CC(Nc2ccccc2)CO1 Amb35679125 [0,0,0,1,0,0|2,0,1]=4 652 B14R2.19 Cc1nc(Cc2ccccc2)no1 Amb25760165 [0,0,0,1,0,0|2,0,1]=4 653 B14R2.19 ClC1CCC(Cc2ccccc2)C1 Amb27443400 [0,0,0,1,0,0|2,0,1]=4 654 B14R2.19 NC1=NC(Cc2ccccc2)CO1 Amb23449444 [0,0,0,1,0,0|2,0,0]=3 655 B14R2.19 NC1=NC(Cc2ccccc2)CS1 Amb27400638 [0,0,0,1,0,0|2,1,0]=4 656 B14R2.19 NC1=NCC(Cc2ccccc2)N1 Amb27800741 [0,0,0,1,0,0|3,0,0]=4 657 B14R2.19 NC1=N[C@H](Cc2ccccc2)CO1 Amb27464486 [0,0,0,1,0,0|2,0,0]=3 658 B14R2.19 NC1CCC(Cc2ccccc2)C1 Amb25337996 [0,0,0,1,0,0|2,0,1]=4 659 B14R2.19 O=C1C=C(Cc2ccccc2)CC1 Amb25900544 [0,0,0,1,0,0|1,0,2]=4 660 B14R2.19 O=C1C=C(Sc2ccccc2)CO1 Amb21928058 [0,0,0,1,0,0|1,0,2]=4 661 B14R2.19 O=C1CC(Cc2ccccc2)=NO1 Amb1099037 [0,0,0,1,0,0|1,0,1]=3 662 B14R2.19 O=C1CC(Cc2ccccc2)CN1 Amb10608007 [0,0,0,1,0,0|1,0,0]=2 663 B14R2.19 O=C1CC(Cc2ccccc2)CO1 Amb8487117 [0,0,0,1,0,0|0,0,0]=1 664 B14R2.19 O=C1CC(Cc2ccccc2)NN1 Amb29862360 [0,0,0,1,0,0|2,0,0]=3 665 B14R2.19 O=C1CC(Cc2cccnc2)CN1 Amb27412618 [0,0,0,1,0,0|2,0,0]=3 666 B14R2.19 O=C1CC(Nc2ccccc2)CO1 Amb27415556 [0,0,0,1,0,0|1,0,0]=2 667 B14R2.19 O=C1CCC(Cc2ccccc2)C1 Amb24455173 [0,0,0,1,0,0|1,0,0]=2 668 B14R2.19 O=C1CCC(Cc2ccccc2)N1 Amb6404055 [0,0,0,1,0,0|2,0,0]=3 669 B14R2.19 O=C1CCC(Cc2ccccc2)O1 Amb20669272 [0,0,0,1,0,0|2,0,0]=3 670 B14R2.19 O=C1CCC(Cc2ccncc2)N1 Amb27972750 [0,0,0,1,0,0|3,0,0]=4 671 B14R2.19 O=C1CCC(Nc2ccccc2)C1 Amb28137731 [0,0,0,1,0,0|2,0,0]=3 672 B14R2.19 O=C1CCC(Nc2ccccc2)N1 Amb27816227 [0,0,0,1,0,0|3,0,0]=4 673 B14R2.19 O=C1CCC(Sc2ccccc2)C1 Amb25815229 [0,0,0,1,0,0|2,0,0]=3 674 B14R2.19 O=C1CCC(Sc2ccccc2)N1 Amb27799846 [0,0,0,1,0,0|3,0,0]=4 675 B14R2.19 O=C1CCC(Sc2ccncc2)C1 Amb27416047 [0,0,0,1,0,0|3,0,0]=4 676 B14R2.19 O=C1CCN(Cc2ccccc2)C1 Amb1680105 [0,0,0,1,0,0|2,0,0]=3 677 B14R2.19 O=C1CCN(Cc2ccccc2)C1 Amb18048933 [0,0,0,1,0,0|2,0,0]=3 678 B14R2.19 O=C1CCN(Cc2ccccc2)N1 Amb2423894 [0,0,0,1,0,0|3,0,0]=4 679 B14R2.19 O=C1CN(Cc2ccccc2)CO1 Amb27861590 [0,0,0,1,0,0|1,0,0]=2 680 B14R2.19 O=C1COC(Cc2ccccc2)C1 Amb35718934 [0,0,0,1,0,0|2,0,0]=3 681 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CN1 Amb27777300 [0,0,0,1,0,0|1,0,0]=2 682 B14R2.19 O=C1NC(Cc2ccccc2)CO1 Amb9809273 [0,0,0,1,0,0|1,0,0]=2 683 B14R2.19 O=C1NC(Cc2ccccc2)CS1 Amb27618346 [0,0,0,1,0,0|1,1,0]=3 684 B14R2.19 O=C1NC(Cc2ccncc2)CO1 Amb27607810 [0,0,0,1,0,0|2,0,0]=3 685 B14R2.19 O=C1NCC(Cc2ccccc2)N1 Amb18061673 [0,0,0,1,0,0|2,0,0]=3 686 B14R2.19 O=C1NCC(Cc2ccccc2)O1 Amb18061675 [0,0,0,1,0,0|2,0,0]=3 687 B14R2.19 O=C1NC[C@H](Cc2ccccc2)N1 Amb27772403 [0,0,0,1,0,0|2,0,0]=3 688 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CO1 Amb2725669 [0,0,0,1,0,0|1,0,0]=2 689 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CS1 Amb19887642 [0,0,0,1,0,0|1,1,0]=3 690 B14R2.19 O=C1N[C@H](Cc2ccccc2)CO1 Amb6357181 [0,0,0,1,0,0|1,0,0]=2 691 B14R2.19 O=C1N[C@H](Cc2ccccc2)CS1 Amb19888420 [0,0,0,1,0,0|1,1,0]=3 692 B14R2.19 O=C1N\C(=C/c2ccccc2)CO1 Amb27815226 [0,0,0,1,0,0|1,0,2]=4 693 B14R2.19 O=C1N\C(=C\c2ccccc2)CO1 Amb27981988 [0,0,0,1,0,0|1,0,2]=4 694 B14R2.19 O=C1OCC(Oc2ccccn2)O1 Amb28182698 [0,0,0,1,0,0|3,0,0]=4 695 B14R2.19 OC1CC(Cc2ccccc2)CO1 Amb22752560 [0,0,0,1,0,0|0,0,2]=3 696 B14R2.19 OC1CCC(Cc2ccccc2)C1 Amb27664443 [0,0,0,1,0,0|1,0,2]=4 697 B14R2.19 S=C1NC(Cc2ccccc2)CO1 Amb25938312 [0,0,0,1,0,0|1,1,0]=3 698 B14R2.19 S=C1NC(Cc2ccccc2)CS1 Amb24079058 [0,0,0,1,0,0|1,2,0]=4 699 B14R2.19 S=C1NCC(Cc2ccccc2)S1 Amb27798328 [0,0,0,1,0,0|2,1,0]=4 700 B14R2.19 S=C1N[C@@H](Cc2ccccc2)CO1 Amb8629174 [0,0,0,1,0,0|1,1,0]=3 701 B14R2.19 S=C1N[C@@H](Cc2ccccc2)CS1 Amb8629263 [0,0,0,1,0,0|1,2,0]=4 702 B14R2.19 S=C1N[C@H](Cc2ccccc2)CO1 Amb8629175 [0,0,0,1,0,0|1,1,0]=3 703 B14R2.19 S=C1N[C@H](Cc2ccccc2)CS1 Amb8629264 [0,0,0,1,0,0|1,2,0]=4 704 B14R2.21 C=C1OCCC(c2ccccc2)O1 Amb25897352 [0,0,0,1,0,0|0,0,2]=3 705 B14R2.21 CC1CC(c2ccccc2)CCN1 Amb25765759 [0,0,0,1,0,0|2,0,1]=4 706 B14R2.21 CC1CC(c2ccncc2)CCO1 Amb2694570 [0,0,0,1,0,0|2,0,1]=4 707 B14R2.21 CC1CCCC(c2ccccc2)N1 Amb5717718 [0,0,0,1,0,0|2,0,1]=4 708 B14R2.21 CC1NC(c2ccccc2)CCO1 Amb33193177 [0,0,0,1,0,0|1,0,1]=3 709 B14R2.21 CN1CCCC(c2ccccc2)C1 Amb27467534 [0,0,0,1,0,0|3,0,0]=4 710 B14R2.21 C[C@@H]1CCC[C@H](c2ccccc2)N1 Amb24710306 [0,0,0,1,0,0|2,0,1]=4 711 B14R2.21 C[C@H]1CCC[C@@H](c2ccccc2)N1 Amb28052152 [0,0,0,1,0,0|2,0,1]=4 712 B14R2.21 ClC1CCCC(c2ccccc2)C1 Amb4035352 [0,0,0,1,0,0|2,0,1]=4 713 B14R2.21 Cl[C@@H]1CCC[C@@H](c2ccccc2)C1 Amb28132362 [0,0,0,1,0,0|2,0,1]=4 714 B14R2.21 NC1=NC(c2ccccc2)CCN1 Amb18127516 [0,0,0,1,0,0|3,0,0]=4 715 B14R2.21 NC1=NC(c2ccccc2)CCN1 Amb35752611 [0,0,0,1,0,0|3,0,0]=4 716 B14R2.21 NC1CCCC(c2ccccc2)C1 Amb24183813 [0,0,0,1,0,0|2,0,1]=4 717 B14R2.21 NC1CCCC(c2ccccc2)C1 Amb33546016 [0,0,0,1,0,0|2,0,1]=4 718 B14R2.21 NN1CCCC(c2ccccc2)C1 Amb25157115 [0,0,0,1,0,0|3,0,0]=4 719 B14R2.21 O=C1C=C(c2ccccc2)CCC1 Amb2613651 [0,0,0,1,0,0|1,0,2]=4 720 B14R2.21 O=C1C=CC[C@@H](c2ccccc2)N1 Amb28071064 [0,0,0,1,0,0|2,0,1]=4 721 B14R2.21 O=C1C=CNC(c2ccccc2)C1 Amb27149335 [0,0,0,1,0,0|2,0,1]=4 722 B14R2.21 O=C1C=COC(c2ccccc2)C1 Amb8392695 [0,0,0,1,0,0|2,0,1]=4 723 B14R2.21 O=C1C=CO[C@H](c2ccccc2)C1 Amb27961396 [0,0,0,1,0,0|2,0,1]=4 724 B14R2.21 O=C1CC(c2ccccc2)CCN1 Amb20171612 [0,0,0,1,0,0|1,0,0]=2 725 B14R2.21 O=C1CC(c2ccccc2)CCO1 Amb22499444 [0,0,0,1,0,0|0,0,0]=1 726 B14R2.21 O=C1CCCC(c2ccccc2)C1 Amb18065540 [0,0,0,1,0,0|1,0,0]=2 727 B14R2.21 O=C1CCCC(c2ccccc2)N1 Amb2615419 [0,0,0,1,0,0|2,0,0]=3 728 B14R2.21 O=C1CCCC(c2ccccn2)C1 Amb21961938 [0,0,0,1,0,0|2,0,0]=3 729 B14R2.21 O=C1CCCC(c2ccccn2)N1 Amb23569074 [0,0,0,1,0,0|3,0,0]=4 730 B14R2.21 O=C1CCCC(c2cccnc2)C1 Amb24553703 [0,0,0,1,0,0|2,0,0]=3 731 B14R2.21 O=C1CCCC(c2cccnc2)N1 Amb2615471 [0,0,0,1,0,0|3,0,0]=4 732 B14R2.21 O=C1CCCC(c2ccncc2)C1 Amb25044331 [0,0,0,1,0,0|2,0,0]=3 733 B14R2.21 O=C1CCCN(c2ccccc2)N1 Amb4004671 [0,0,0,1,0,0|3,0,0]=4 734 B14R2.21 O=C1CCCN(c2ccncc2)C1 Amb27666535 [0,0,0,1,0,0|3,0,0]=4 735 B14R2.21 O=C1CCC[C@@H](c2cccnc2)N1 Amb28046253 [0,0,0,1,0,0|3,0,0]=4 736 B14R2.21 O=C1CCC[C@H](c2ccccc2)C1 Amb26881373 [0,0,0,1,0,0|1,0,0]=2 737 B14R2.21 O=C1CCNC(c2ccccc2)C1 Amb17233086 [0,0,0,1,0,0|2,0,0]=3 738 B14R2.21 O=C1CCNC(c2ccccc2)C1 Amb22274020 [0,0,0,1,0,0|2,0,0]=3 739 B14R2.21 O=C1CCNC(c2ccccc2)N1 Amb27233614 [0,0,0,1,0,0|3,0,0]=4 740 B14R2.21 O=C1CCNC(c2ccccn2)C1 Amb18196728 [0,0,0,1,0,0|3,0,0]=4 741 B14R2.21 O=C1CCNC(c2cccnc2)C1 Amb17233193 [0,0,0,1,0,0|3,0,0]=4 742 B14R2.21 O=C1CCNC(c2ccncc2)C1 Amb18196727 [0,0,0,1,0,0|3,0,0]=4 743 B14R2.21 O=C1CCN[C@@H](c2ccccc2)C1 Amb27828475 [0,0,0,1,0,0|2,0,0]=3 744 B14R2.21 O=C1CCN[C@H](c2ccccc2)C1 Amb27230890 [0,0,0,1,0,0|2,0,0]=3 745 B14R2.21 O=C1CCOC(c2ccccc2)C1 Amb19957821 [0,0,0,1,0,0|2,0,0]=3 746 B14R2.21 O=C1CCOC(c2ccccn2)C1 Amb28430591 [0,0,0,1,0,0|3,0,0]=4 747 B14R2.21 O=C1CNCC(c2ccccc2)N1 Amb26855077 [0,0,0,1,0,0|3,0,0]=4 748 B14R2.21 O=C1CNCC(c2ccccc2)N1 Amb32410675 [0,0,0,1,0,0|3,0,0]=4 749 B14R2.21 O=C1CNC[C@H](c2ccccc2)N1 Amb28143509 [0,0,0,1,0,0|3,0,0]=4 750 B14R2.21 O=C1CNC[C@H](c2ccccc2)O1 Amb27847500 [0,0,0,1,0,0|3,0,0]=4 751 B14R2.21 O=C1COCC(c2ccccc2)C1 Amb28381209 [0,0,0,1,0,0|2,0,0]=3 752 B14R2.21 O=C1COCC(c2ccccc2)N1 Amb21864800 [0,0,0,1,0,0|3,0,0]=4 753 B14R2.21 O=C1COC[C@@H](c2ccccc2)N1 Amb24654701 [0,0,0,1,0,0|3,0,0]=4 754 B14R2.21 O=C1COC[C@H](c2ccccc2)N1 Amb24181880 [0,0,0,1,0,0|3,0,0]=4 755 B14R2.21 O=C1CSCC(c2ccccc2)N1 Amb26304275 [0,0,0,1,0,0|3,0,0]=4 756 B14R2.21 O=C1C[C@@H](c2ccccc2)CCO1 Amb27187321 [0,0,0,1,0,0|0,0,0]=1 757 B14R2.21 O=C1NC(c2ccccc2)CCO1 Amb27481645 [0,0,0,1,0,0|1,0,0]=2 758 B14R2.21 O=C1NC(c2ccccn2)CCO1 Amb27396944 [0,0,0,1,0,0|2,0,0]=3 759 B14R2.21 O=C1NCCC(c2ccccc2)N1 Amb25733512 [0,0,0,1,0,0|2,0,0]=3 760 B14R2.21 O=C1NCCC(c2ccccn2)N1 Amb24358813 [0,0,0,1,0,0|3,0,0]=4 761 B14R2.21 O=C1NCCC(c2cccnc2)N1 Amb26514169 [0,0,0,1,0,0|3,0,0]=4 762 B14R2.21 O=C1NCCC(c2ccncc2)N1 Amb26406351 [0,0,0,1,0,0|3,0,0]=4 763 B14R2.21 O=C1NN(c2ccccc2)CCO1 Amb27826339 [0,0,0,1,0,0|2,0,0]=3 764 B14R2.21 O=C1N[C@H](c2ccccn2)CCO1 Amb27172183 [0,0,0,1,0,0|2,0,0]=3 765 B14R2.21 O=C1N[C@H](c2ccncc2)CCO1 Amb27951607 [0,0,0,1,0,0|2,0,0]=3 766 B14R2.21 O=S1CCNC(c2ccccc2)C1 Amb19374300 [0,0,0,1,0,0|3,0,0]=4 767 B14R2.21 O=S1CCN[C@@H](c2ccccc2)C1 Amb27608680 [0,0,0,1,0,0|3,0,0]=4 768 B14R2.21 OC1CCCC(c2ccccc2)C1 Amb26612874 [0,0,0,1,0,0|1,0,2]=4 769 B14R2.333 CC1(C)NCCC1c2ccccc2 Amb18279937 [0,0,0,1,0,0|2,0,1]=4 770 B14R2.333 O=S1(=O)CCCC1c2ccccc2 Amb27395637 [0,0,0,1,0,0|3,0,0]=4 771 B14R2.333 O=S1(=O)NCCC1c2ccccc2 Amb22230020 [0,0,0,1,0,0|3,0,0]=4 772 B14R2.391 CN1CCCCc2ccccc2C1 Amb27946054 [0,0,0,1,0,0|3,0,0]=4 773 B14R2.391 N=C1NCCCc2ccccc2N1 Amb27643357 [0,0,0,1,0,0|3,0,0]=4 774 B14R2.391 O=C1CCCCc2ccccc2C1 Amb27260503 [0,0,0,1,0,0|1,0,0]=2 775 B14R2.391 O=C1CCCCc2ccccc2N1 Amb27250578 [0,0,0,1,0,0|2,0,0]=3 776 B14R2.391 O=C1CCCCc2ccccc2O1 Amb28242400 [0,0,0,1,0,0|2,0,0]=3 777 B14R2.391 O=C1CCCNc2ccccc2N1 Amb27170064 [0,0,0,1,0,0|3,0,0]=4 778 B14R2.391 O=C1Cc2ccccc2CCCN1 Amb28252381 [0,0,0,1,0,0|1,0,0]=2 779 B14R2.391 S=C1NCCCc2ccccc2N1 Amb28048864 [0,0,0,1,0,0|2,1,0]=4 780 B14R2.402 CC1(C)OC1CNc2ccccc2 Amb4358566 [0,0,0,1,0,0|2,0,1]=4 781 B14R2.436 C=C1CC(OCc2ccccc2)C1 Amb25911266 [0,0,0,1,0,0|3,0,0]=4 782 B14R2.436 NC1CC(CCc2ccccc2)C1 Amb27415257 [0,0,0,1,0,0|2,0,1]=4 783 B14R2.436 O=C1C=C(OCc2ccccc2)C1 Amb27771408 [0,0,0,1,0,0|2,0,1]=4 784 B14R2.436 O=C1CC(CCc2ccccc2)C1 Amb27235487 [0,0,0,1,0,0|1,0,0]=2 785 B14R2.436 O=C1CC(OCc2ccccc2)C1 Amb10844904 [0,0,0,1,0,0|2,0,0]=3 786 B14R2.436 O=C1CC(SCc2ccccn2)N1 Amb27596989 [0,0,0,1,0,0|3,0,0]=4 787 B14R2.436 O=C1CC(SCc2ccncc2)N1 Amb27950901 [0,0,0,1,0,0|3,0,0]=4 788 B14R2.436 O=C1C[C@@H](CCc2ccccc2)N1 Amb27413661 [0,0,0,1,0,0|1,0,0]=2 789 B14R2.436 O=C1C[C@H](CCc2ccccc2)N1 Amb27206618 [0,0,0,1,0,0|1,0,0]=2 790 B14R2.764 CC(=O)C1C\C1=C/c2ccccc2 Amb27854648 [0,0,0,1,0,0|1,0,2]=4 791 B14R2.764 CC(=O)[C@H]1O[C@H]1Cc2ccccc2 Amb28054314 [0,0,0,1,0,0|2,0,0]=3 792 B14R2.764 O=C(O)C1CC1Cc2ccccc2 Amb18990227 [0,0,0,1,0,0|2,0,0]=3 793 B14R2.764 O=C(O)C1CC1Oc2ccccc2 Amb27955312 [0,0,0,1,0,0|3,0,0]=4 794 B14R2.764 O=C(O)C1CC1Sc2ccccc2 Amb28251062 [0,0,0,1,0,0|3,0,0]=4 795 B14R2.764 O=C(O)C1CN1Cc2ccccc2 Amb9782119 [0,0,0,1,0,0|3,0,0]=4 796 B14R2.764 O=C(O)C1OC1Cc2ccccc2 Amb28136429 [0,0,0,1,0,0|3,0,0]=4 797 B14R2.764 O=C(O)[C@@H]1C[C@H]1Cc2ccccc2 Amb25179092 [0,0,0,1,0,0|2,0,0]=3 798 B14R2.764 O=C(O)[C@@H]1C[C@H]1Oc2ccccc2 Amb25173187 [0,0,0,1,0,0|3,0,0]=4 799 B14R2.764 O=C(O)[C@H]1C[C@@H]1Cc2ccccc2 Amb27211567 [0,0,0,1,0,0|2,0,0]=3 800 B14R2.764 O=C(O)[C@H]1C[C@H]1Cc2ccccc2 Amb27878637 [0,0,0,1,0,0|2,0,0]=3 801 B14R2.764 O=C([O-])C1CN1Cc2ccccc2 Amb22261487 [0,0,0,1,0,0|3,0,0]=4 802 B14R2.780 CC(=O)C1=C(c2ccccc2)CC1 Amb28062994 [0,0,0,1,0,0|1,0,1]=3 803 B14R2.780 CC(=O)[C@H]1CC[C@@H]1c2ccccc2 Amb27427949 [0,0,0,1,0,0|1,0,0]=2 804 B14R2.780 NC(=O)N1CCC1c2ccccc2 Amb26332685 [0,0,0,1,0,0|2,0,0]=3 805 B14R2.780 O=C(O)C1CCC1c2ccccc2 Amb28076679 [0,0,0,1,0,0|2,0,0]=3 806 B14R2.780 O=C(O)C1NCC1c2ccccc2 Amb26376881 [0,0,0,1,0,0|3,0,0]=4 807 B14R2.780 O=C(O)C1NCC1c2ccccc2 Amb33189157 [0,0,0,1,0,0|3,0,0]=4 808 B14R2.780 O=C(O)[C@@H]1NC[C@H]1c2ccccc2 Amb24552426 [0,0,0,1,0,0|3,0,0]=4 809 B14R2.780 O=C(O)[C@@H]1NC[C@H]1c2ccccc2 Amb31156681 [0,0,0,1,0,0|3,0,0]=4 810 B14R2.790 CC(=O)CC1OC1c2ccccc2 Amb27750372 [0,0,0,1,0,0|2,0,0]=3 811 B14R2.790 CC(=O)NC1CC1c2ccccc2 Amb6359955 [0,0,0,1,0,0|1,0,0]=2 812 B14R2.790 CC(=O)NC1CC1c2cccnc2 Amb27443450 [0,0,0,1,0,0|2,0,0]=3 813 B14R2.790 CC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb24273291 [0,0,0,1,0,0|1,0,0]=2 814 B14R2.790 N=C(N)N[C@H]1C[C@@H]1c2ccccc2 Amb27202803 [0,0,0,1,0,0|3,0,0]=4 815 B14R2.790 NC(=O)C[C@@H]1C[C@H]1c2ccccc2 Amb27420759 [0,0,0,1,0,0|2,0,0]=3 816 B14R2.790 NC(=O)N[C@H]1C[C@@H]1c2ccccc2 Amb27966822 [0,0,0,1,0,0|2,0,0]=3 817 B14R2.790 O=C(Cl)NC1CC1c2ccccc2 Amb35625650 [0,0,0,1,0,0|2,0,0]=3 818 B14R2.790 O=C(O)CC1CC1c2ccccc2 Amb17233181 [0,0,0,1,0,0|2,0,0]=3 819 B14R2.790 O=C(O)C[C@@H]1C[C@@H]1c2ccccc2 Amb28385583 [0,0,0,1,0,0|2,0,0]=3 820 B14R2.790 O=C(O)C[C@@H]1C[C@H]1c2ccccc2 Amb24467878 [0,0,0,1,0,0|2,0,0]=3 821 B14R2.3018 c1ccc(CCCNC2CC2)cc1 Amb6249030 [0,0,0,1,0,0|2,0,1]=4 822 B14R2.31137 CC(=O)OCC1Cc2ccccc21 Amb27774602 [0,0,0,1,0,0|0,0,0]=1 823 B14R2.31137 CC(C)NCC1Cc2ccccc21 Amb18968592 [0,0,0,1,0,0|2,0,1]=4 824 B14R2.31137 NC(=O)NCC1Cc2ccccc21 Amb27453203 [0,0,0,1,0,0|2,0,0]=3 825 B14R2.31137 O=C(Cl)NCC1Cc2ccccc21 Amb35625785 [0,0,0,1,0,0|2,0,0]=3 826 B14R2.31137 O=C(O)C#CC1Cc2ccccc21 Amb27399132 [0,0,0,1,0,0|2,0,1]=4 827 B14R2.31359 CC(=O)C1CCCc2ccccc21 Amb18183860 [0,0,0,1,0,0|1,0,0]=2 828 B14R2.31359 CC(=O)C1CCCc2cccnc21 Amb25046405 [0,0,0,1,0,0|2,0,0]=3 829 B14R2.31359 CC(=O)C1CNCc2ccccc21 Amb27415059 [0,0,0,1,0,0|2,0,0]=3 830 B14R2.31359 CC(=O)C1OCCc2ccccc21 Amb17594476 [0,0,0,1,0,0|2,0,0]=3 831 B14R2.31359 CC(=O)N1CC=Cc2ccccc21 Amb26639322 [0,0,0,1,0,0|1,0,2]=4 832 B14R2.31359 CC(=O)N1CCCc2ccccc21 Amb6340880 [0,0,0,1,0,0|1,0,0]=2 833 B14R2.31359 CC(=O)N1CCCc2ncccc21 Amb25100904 [0,0,0,1,0,0|2,0,0]=3 834 B14R2.31359 CC(=O)N1CCNc2ccccc21 Amb676553 [0,0,0,1,0,0|2,0,0]=3 835 B14R2.31359 CC(=O)N1CCNc2cccnc21 Amb18196089 [0,0,0,1,0,0|3,0,0]=4 836 B14R2.31359 CC(=O)N1CCOc2ccccc21 Amb17593003 [0,0,0,1,0,0|2,0,0]=3 837 B14R2.31359 CC(=O)N1CCSc2ccccc21 Amb27166105 [0,0,0,1,0,0|2,0,0]=3 838 B14R2.31359 CC(=O)N1CCSc2ccncc21 Amb27761423 [0,0,0,1,0,0|3,0,0]=4 839 B14R2.31359 CC(C)N1CCCc2ccccc21 Amb27187414 [0,0,0,1,0,0|2,0,1]=4 840 B14R2.31359 CC(N)C1CCCc2ccccc21 Amb27985502 [0,0,0,1,0,0|2,0,1]=4 841 B14R2.31359 CC(N)C1CCCc2ccccc21 Amb32666122 [0,0,0,1,0,0|2,0,1]=4 842 B14R2.31359 CC(N)[C@H]1CCCc2ccccc21 Amb27649238 [0,0,0,1,0,0|2,0,1]=4 843 B14R2.31359 CC(O)C1CCCc2ccccc21 Amb27408133 [0,0,0,1,0,0|1,0,2]=4 844 B14R2.31359 CS(=O)C1CCCc2ccccc21 Amb27771144 [0,0,0,1,0,0|2,0,0]=3 845 B14R2.31359 CS(=O)C1CCOc2ccccc21 Amb28351009 [0,0,0,1,0,0|3,0,0]=4 846 B14R2.31359 C[C@@H](N)C1CCCc2ccccc21 Amb28069964 [0,0,0,1,0,0|2,0,1]=4 847 B14R2.31359 C[C@@H](O)C1CCCc2ccccc21 Amb25933581 [0,0,0,1,0,0|1,0,2]=4 848 B14R2.31359 C[C@H](N)C1CCCc2ccccc21 Amb27978272 [0,0,0,1,0,0|2,0,1]=4 849 B14R2.31359 C[C@H](N)C1CCCc2ccccc21 Amb33140990 [0,0,0,1,0,0|2,0,1]=4 850 B14R2.31359 C[C@H](O)C1CCCc2ccccc21 Amb25066923 [0,0,0,1,0,0|1,0,2]=4 851 B14R2.31359 N=C(N)C1CCCc2ccccc21 Amb20667628 [0,0,0,1,0,0|3,0,0]=4 852 B14R2.31359 N=C(N)C1CCCc2ccccc21 Amb22059226 [0,0,0,1,0,0|3,0,0]=4 853 B14R2.31359 N=C(N)N1CCCc2ccccc21 Amb6682741 [0,0,0,1,0,0|3,0,0]=4 854 B14R2.31359 NC(=O)C1=CCCc2ccccc21 Amb28396588 [0,0,0,1,0,0|2,0,1]=4 855 B14R2.31359 NC(=O)C1CCNc2ccccc21 Amb22059639 [0,0,0,1,0,0|3,0,0]=4 856 B14R2.31359 NC(=O)C1CCSc2ccccc21 Amb27399363 [0,0,0,1,0,0|3,0,0]=4 857 B14R2.31359 NC(=O)C1CNCc2ccccc21 Amb25849864 [0,0,0,1,0,0|3,0,0]=4 858 B14R2.31359 NC(=O)C1CNCc2ccccc21 Amb32670753 [0,0,0,1,0,0|3,0,0]=4 859 B14R2.31359 NC(=O)C1NCCc2ccccc21 Amb18946033 [0,0,0,1,0,0|3,0,0]=4 860 B14R2.31359 NC(=O)C1NCCc2ccccc21 Amb32667424 [0,0,0,1,0,0|3,0,0]=4 861 B14R2.31359 NC(=O)C1OCCc2ccccc21 Amb18180638 [0,0,0,1,0,0|3,0,0]=4 862 B14R2.31359 NC(=O)C1SCCc2ccccc21 Amb26569549 [0,0,0,1,0,0|3,0,0]=4 863 B14R2.31359 NC(=O)N1CCCc2ccccc21 Amb1126930 [0,0,0,1,0,0|2,0,0]=3 864 B14R2.31359 NC(=O)N1CCCc2ncccc21 Amb28182889 [0,0,0,1,0,0|3,0,0]=4 865 B14R2.31359 NC(=O)N1CCOc2ccccc21 Amb27163806 [0,0,0,1,0,0|3,0,0]=4 866 B14R2.31359 NC(=O)N1CCSc2ccccc21 Amb27852993 [0,0,0,1,0,0|3,0,0]=4 867 B14R2.31359 NC(=S)C1CCCc2ccccc21 Amb6893241 [0,0,0,1,0,0|2,1,0]=4 868 B14R2.31359 NC(=S)N1CCCc2ccccc21 Amb1135602 [0,0,0,1,0,0|2,1,0]=4 869 B14R2.31359 O=C(Cl)C1CCOc2ccccc21 Amb27402778 [0,0,0,1,0,0|3,0,0]=4 870 B14R2.31359 O=C(Cl)C1OCCc2ccccc21 Amb24571154 [0,0,0,1,0,0|3,0,0]=4 871 B14R2.31359 O=C(Cl)N1CCCc2ccccc21 Amb17563101 [0,0,0,1,0,0|2,0,0]=3 872 B14R2.31359 O=C(Cl)[C@H]1CCCc2ccccc21 Amb27438024 [0,0,0,1,0,0|2,0,0]=3 873 B14R2.31359 O=C(O)C1=CCCc2ccccc21 Amb17232997 [0,0,0,1,0,0|2,0,1]=4 874 B14R2.31359 O=C(O)C1CCCc2ccccc21 Amb6371221 [0,0,0,1,0,0|2,0,0]=3 875 B14R2.31359 O=C(O)C1CCCc2cccnc21 Amb25943745 [0,0,0,1,0,0|3,0,0]=4 876 B14R2.31359 O=C(O)C1CCCc2cccnc21 Amb28600352 [0,0,0,1,0,0|3,0,0]=4 877 B14R2.31359 O=C(O)C1CCCc2ncccc21 Amb24443964 [0,0,0,1,0,0|3,0,0]=4 878 B14R2.31359 O=C(O)C1CCCc2ncccc21 Amb33743295 [0,0,0,1,0,0|3,0,0]=4 879 B14R2.31359 O=C(O)C1CCNc2ccccc21 Amb10603353 [0,0,0,1,0,0|3,0,0]=4 880 B14R2.31359 O=C(O)C1CCNc2ccccc21 Amb21857054 [0,0,0,1,0,0|3,0,0]=4 881 B14R2.31359 O=C(O)C1CCOc2ccccc21 Amb13952834 [0,0,0,1,0,0|3,0,0]=4 882 B14R2.31359 O=C(O)C1CCSc2ccccc21 Amb18651956 [0,0,0,1,0,0|3,0,0]=4 883 B14R2.31359 O=C(O)C1CNCc2ccccc21 Amb22751637 [0,0,0,1,0,0|3,0,0]=4 884 B14R2.31359 O=C(O)C1CNCc2ccccc21 Amb2372591 [0,0,0,1,0,0|3,0,0]=4 885 B14R2.31359 O=C(O)C1COCc2ccccc21 Amb27180431 [0,0,0,1,0,0|3,0,0]=4 886 B14R2.31359 O=C(O)C1NCCc2ccccc21 Amb1034897 [0,0,0,1,0,0|3,0,0]=4 887 B14R2.31359 O=C(O)C1NCCc2ccccc21 Amb22492442 [0,0,0,1,0,0|3,0,0]=4 888 B14R2.31359 O=C(O)C1OCCc2ccccc21 Amb2372592 [0,0,0,1,0,0|3,0,0]=4 889 B14R2.31359 O=C(O)C1SCCc2ccccc21 Amb19148991 [0,0,0,1,0,0|3,0,0]=4 890 B14R2.31359 O=C(O)[C@@H]1CCCc2ccccc21 Amb8390357 [0,0,0,1,0,0|2,0,0]=3 891 B14R2.31359 O=C(O)[C@@H]1NCCc2ccccc21 Amb2694771 [0,0,0,1,0,0|3,0,0]=4 892 B14R2.31359 O=C(O)[C@H]1CCCc2ccccc21 Amb17672002 [0,0,0,1,0,0|2,0,0]=3 893 B14R2.31359 O=C(O)[C@H]1NCCc2ccccc21 Amb2694993 [0,0,0,1,0,0|3,0,0]=4 894 B14R2.31359 O=C(O)[C@H]1OCCc2ccccc21 Amb27179358 [0,0,0,1,0,0|3,0,0]=4 895 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,0,0,0,1,0|2,0,1]=4 896 B12R1.252 C=C(C)CCNc1ccncc1 Amb28322222 [0,0,0,0,1,0|3,0,0]=4 897 B12R1.252 C=C(C)CNCc1ccccc1 Amb10608684 [0,0,0,0,1,0|2,0,0]=3 898 B12R1.252 C=C(C)CNCc1ccccc1 Amb17622487 [0,0,0,0,1,0|2,0,0]=3 899 B12R1.252 C=C(C)CNCc1ccccn1 Amb17308945 [0,0,0,0,1,0|3,0,0]=4 900 B12R1.252 C=C(C)CNCc1cccnc1 Amb18800663 [0,0,0,0,1,0|3,0,0]=4 901 B12R1.252 C=C(C)CNCc1ccncc1 Amb17308927 [0,0,0,0,1,0|3,0,0]=4 902 B12R1.252 C=C(C)COCc1ccccc1 Amb28062621 [0,0,0,0,1,0|2,0,0]=3 903 B12R1.252 CC(=O)C#CCc1ccccc1 Amb27177980 [0,0,0,0,1,0|0,0,2]=3 904 B12R1.252 CC(=O)CC#Cc1ccccc1 Amb28122481 [0,0,0,0,1,0|0,0,2]=3 905 B12R1.252 CC(=O)CCCc1ccccc1 Amb4358586 [0,0,0,0,1,0|0,0,0]=1 906 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [0,0,0,0,1,0|1,0,0]=2 907 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [0,0,0,0,1,0|1,0,0]=2 908 B12R1.252 CC(=O)CCNc1ccccc1 Amb26422328 [0,0,0,0,1,0|1,0,0]=2 909 B12R1.252 CC(=O)CCOc1ccccc1 Amb7777351 [0,0,0,0,1,0|1,0,0]=2 910 B12R1.252 CC(=O)CCSc1ccccc1 Amb4020770 [0,0,0,0,1,0|1,0,0]=2 911 B12R1.252 CC(=O)COCc1ccccc1 Amb3433615 [0,0,0,0,1,0|1,0,0]=2 912 B12R1.252 CC(=O)CONc1ccccc1 Amb28243855 [0,0,0,0,1,0|2,0,0]=3 913 B12R1.252 CC(=O)CSCc1ccccc1 Amb4018341 [0,0,0,0,1,0|1,0,0]=2 914 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [0,0,0,0,1,0|0,0,2]=3 915 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [0,0,0,0,1,0|1,0,1]=3 916 B12R1.252 CC(=O)NCCc1ccccc1 Amb2781514 [0,0,0,0,1,0|1,0,0]=2 917 B12R1.252 CC(=O)NCCc1cnccn1 Amb25277212 [0,0,0,0,1,0|3,0,0]=4 918 B12R1.252 CC(=O)NCSc1ccccc1 Amb27797274 [0,0,0,0,1,0|2,0,0]=3 919 B12R1.252 CC(=O)NNCc1ccccn1 Amb28366245 [0,0,0,0,1,0|3,0,0]=4 920 B12R1.252 CC(=O)N\N=C\c1ccccc1 Amb2732164 [0,0,0,0,1,0|2,0,1]=4 921 B12R1.252 CC(=O)OCCc1ccccc1 Amb6357159 [0,0,0,0,1,0|0,0,0]=1 922 B12R1.252 CC(=O)OCCc1ccccn1 Amb8391177 [0,0,0,0,1,0|1,0,0]=2 923 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [0,0,0,0,1,0|0,0,2]=3 924 B12R1.252 CC(=O)\C=C/Nc1ccccc1 Amb28461253 [0,0,0,0,1,0|1,0,2]=4 925 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb32954414 [0,0,0,0,1,0|0,0,2]=3 926 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [0,0,0,0,1,0|1,0,2]=4 927 B12R1.252 CC(=O)\C=C\Oc1ccccc1 Amb26528572 [0,0,0,0,1,0|1,0,2]=4 928 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb35789855 [0,0,0,0,1,0|1,0,2]=4 929 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [0,0,0,0,1,0|2,0,1]=4 930 B12R1.252 CC(=O)\[C+]=N\[N-]c1ccccc1 Amb27614630 [0,0,0,0,1,0|2,0,1]=4 931 B12R1.252 CC(=S)NCCc1ccccc1 Amb27412033 [0,0,0,0,1,0|1,1,0]=3 932 B12R1.252 CC(Br)CCCc1ccccc1 Amb32951525 [0,0,0,0,1,0|1,0,1]=3 933 B12R1.252 CC(Br)CCSc1ccccc1 Amb20623511 [0,0,0,0,1,0|2,0,1]=4 934 B12R1.252 CC(Br)COCc1ccccc1 Amb27481240 [0,0,0,0,1,0|2,0,1]=4 935 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,0,0,0,1,0|1,0,1]=3 936 B12R1.252 CC(C)=CCCc1cccnc1 Amb35582905 [0,0,0,0,1,0|2,0,1]=4 937 B12R1.252 CC(C)=CCNc1ccccc1 Amb27638094 [0,0,0,0,1,0|2,0,1]=4 938 B12R1.252 CC(C)=CCSc1ccccc1 Amb8394723 [0,0,0,0,1,0|2,0,1]=4 939 B12R1.252 CC(C)=NOCc1ccccc1 Amb27827763 [0,0,0,0,1,0|3,0,0]=4 940 B12R1.252 CC(C)CCCc1ccncc1 Amb2613010 [0,0,0,0,1,0|2,0,1]=4 941 B12R1.252 CC(C)CCNc1ccccc1 Amb4016589 [0,0,0,0,1,0|2,0,1]=4 942 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [0,0,0,0,1,0|2,0,1]=4 943 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [0,0,0,0,1,0|2,0,1]=4 944 B12R1.252 CC(C)CNCc1ccccc1 Amb6687359 [0,0,0,0,1,0|2,0,1]=4 945 B12R1.252 CC(C)NCCc1ccccc1 Amb2111109 [0,0,0,0,1,0|2,0,1]=4 946 B12R1.252 CC(C)NCCc1ccccc1 Amb6246148 [0,0,0,0,1,0|2,0,1]=4 947 B12R1.252 CC(C)OCCc1ccccn1 Amb10573511 [0,0,0,0,1,0|2,0,1]=4 948 B12R1.252 CC(Cl)CNCc1ccccc1 Amb27656927 [0,0,0,0,1,0|2,0,1]=4 949 B12R1.252 CC(F)CCCc1ccccc1 Amb22229780 [0,0,0,0,1,0|1,0,1]=3 950 B12R1.252 CC(N)CCCc1ccccc1 Amb2721865 [0,0,0,0,1,0|1,0,1]=3 951 B12R1.252 CC(N)CCCc1cccnc1 Amb17232504 [0,0,0,0,1,0|2,0,1]=4 952 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,0,0,0,1,0|2,0,1]=4 953 B12R1.252 CC(N)CCOc1ccccc1 Amb7772215 [0,0,0,0,1,0|2,0,1]=4 954 B12R1.252 CC(N)CCSc1ccccc1 Amb13881552 [0,0,0,0,1,0|2,0,1]=4 955 B12R1.252 CC(N)COCc1ccccc1 Amb1124568 [0,0,0,0,1,0|2,0,1]=4 956 B12R1.252 CC(N)CSCc1ccccc1 Amb18648554 [0,0,0,0,1,0|2,0,1]=4 957 B12R1.252 CC(O)CCCc1ccccc1 Amb17138575 [0,0,0,0,1,0|0,0,2]=3 958 B12R1.252 CC(O)CCCc1cccnc1 Amb22292250 [0,0,0,0,1,0|1,0,2]=4 959 B12R1.252 CC(O)CCOc1ccccc1 Amb6298179 [0,0,0,0,1,0|1,0,2]=4 960 B12R1.252 CC(O)CNCc1ccccc1 Amb837676 [0,0,0,0,1,0|1,0,2]=4 961 B12R1.252 CC(O)COCc1ccccc1 Amb4020574 [0,0,0,0,1,0|1,0,2]=4 962 B12R1.252 CC(S)COCc1ccccc1 Amb32788346 [0,0,0,0,1,0|1,1,1]=4 963 B12R1.252 CN(C)CCCc1ccccc1 Amb1085936 [0,0,0,0,1,0|2,0,0]=3 964 B12R1.252 CN(C)CCNc1ccccc1 Amb6477740 [0,0,0,0,1,0|3,0,0]=4 965 B12R1.252 CN(C)CCOc1ccccc1 Amb2876295 [0,0,0,0,1,0|3,0,0]=4 966 B12R1.252 CN(N)CCOc1ccccc1 Amb18563757 [0,0,0,0,1,0|3,0,0]=4 967 B12R1.252 CN(O)CCCc1ccccc1 Amb32951844 [0,0,0,0,1,0|1,0,1]=3 968 B12R1.252 CS(=O)\N=C\Cc1ccccc1 Amb35681654 [0,0,0,0,1,0|2,0,1]=4 969 B12R1.252 C[C@@H](N)CCCc1ccccc1 Amb33081452 [0,0,0,0,1,0|1,0,1]=3 970 B12R1.252 C[C@@H](N)CCCc1cccnc1 Amb22388607 [0,0,0,0,1,0|2,0,1]=4 971 B12R1.252 C[C@@H](N)CCOc1ccccc1 Amb33081226 [0,0,0,0,1,0|2,0,1]=4 972 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [0,0,0,0,1,0|2,0,1]=4 973 B12R1.252 C[C@@H](O)CCCc1ccccc1 Amb33082320 [0,0,0,0,1,0|0,0,2]=3 974 B12R1.252 C[C@@H](O)CCOc1ccccc1 Amb32951805 [0,0,0,0,1,0|1,0,2]=4 975 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [0,0,0,0,1,0|1,0,2]=4 976 B12R1.252 C[C@H](N)CCCc1ccccc1 Amb32954284 [0,0,0,0,1,0|1,0,1]=3 977 B12R1.252 C[C@H](N)CCOc1ccccc1 Amb32954086 [0,0,0,0,1,0|2,0,1]=4 978 B12R1.252 C[C@H](N)COCc1ccccc1 Amb17061656 [0,0,0,0,1,0|2,0,1]=4 979 B12R1.252 C[C@H](O)CCCc1ccccc1 Amb32954841 [0,0,0,0,1,0|0,0,2]=3 980 B12R1.252 C[C@H](O)CCOc1ccccc1 Amb32952875 [0,0,0,0,1,0|1,0,2]=4 981 B12R1.252 C[C@H](O)CNCc1ccccc1 Amb27862492 [0,0,0,0,1,0|1,0,2]=4 982 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [0,0,0,0,1,0|1,0,2]=4 983 B12R1.252 C\C(Cl)=C\CNc1ccccc1 Amb4303986 [0,0,0,0,1,0|2,0,1]=4 984 B12R1.252 C\C(N)=N\OCc1ccccc1 Amb27760408 [0,0,0,0,1,0|3,0,0]=4 985 B12R1.252 ClC(Cl)=CCCc1ccccc1 Amb27443084 [0,0,0,0,1,0|2,0,1]=4 986 B12R1.252 N=C(N)CCCc1ccccc1 Amb6276737 [0,0,0,0,1,0|2,0,0]=3 987 B12R1.252 N=C(N)CCCc1ccccn1 Amb21618753 [0,0,0,0,1,0|3,0,0]=4 988 B12R1.252 N=C(N)CCCc1cccnc1 Amb24062322 [0,0,0,0,1,0|3,0,0]=4 989 B12R1.252 N=C(N)CCOc1ccccc1 Amb6279642 [0,0,0,0,1,0|3,0,0]=4 990 B12R1.252 N=C(N)COCc1ccccc1 Amb6266963 [0,0,0,0,1,0|3,0,0]=4 991 B12R1.252 N=C(N)COCc1ccccc1 Amb8630424 [0,0,0,0,1,0|3,0,0]=4 992 B12R1.252 N=C(N)CSCc1ccccc1 Amb28555674 [0,0,0,0,1,0|3,0,0]=4 993 B12R1.252 N=C(N)CSCc1ccccc1 Amb6678181 [0,0,0,0,1,0|3,0,0]=4 994 B12R1.252 N=C(N)NCCc1ccccc1 Amb22736089 [0,0,0,0,1,0|3,0,0]=4 995 B12R1.252 N=C(N)NCCc1ccccc1 Amb22736599 [0,0,0,0,1,0|3,0,0]=4 996 B12R1.252 N=C(N)NCCc1ccccc1 Amb28974714 [0,0,0,0,1,0|3,0,0]=4 997 B12R1.252 N=C(N)NCCc1ccccc1 Amb6761287 [0,0,0,0,1,0|3,0,0]=4 998 B12R1.252 N=C(N)NCCc1ccccc1 Amb838720 [0,0,0,0,1,0|3,0,0]=4 999 B12R1.252 N=C(N)SCCc1ccccc1 Amb20675983 [0,0,0,0,1,0|2,1,0]=4 1000 B12R1.252 NC(=O)CC#Cc1ccccc1 Amb28256571 [0,0,0,0,1,0|1,0,2]=4 1001 B12R1.252 NC(=O)CCCc1ccccc1 Amb3886649 [0,0,0,0,1,0|1,0,0]=2 1002 B12R1.252 NC(=O)CCNc1ccccc1 Amb453169 [0,0,0,0,1,0|2,0,0]=3 1003 B12R1.252 NC(=O)CCOc1ccccc1 Amb8997689 [0,0,0,0,1,0|2,0,0]=3 1004 B12R1.252 NC(=O)CCSc1ccccc1 Amb3836115 [0,0,0,0,1,0|2,0,0]=3 1005 B12R1.252 NC(=O)CNCc1ccccc1 Amb2696395 [0,0,0,0,1,0|2,0,0]=3 1006 B12R1.252 NC(=O)CNCc1ccccn1 Amb6661065 [0,0,0,0,1,0|3,0,0]=4 1007 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [0,0,0,0,1,0|3,0,0]=4 1008 B12R1.252 NC(=O)CNCc1cccnc1 Amb33545533 [0,0,0,0,1,0|3,0,0]=4 1009 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [0,0,0,0,1,0|3,0,0]=4 1010 B12R1.252 NC(=O)COCc1ccccc1 Amb8858432 [0,0,0,0,1,0|2,0,0]=3 1011 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [0,0,0,0,1,0|2,0,0]=3 1012 B12R1.252 NC(=O)NCCc1ccccn1 Amb6274566 [0,0,0,0,1,0|3,0,0]=4 1013 B12R1.252 NC(=O)NCCc1cccnc1 Amb19515015 [0,0,0,0,1,0|3,0,0]=4 1014 B12R1.252 NC(=O)NCSc1ccccc1 Amb28200898 [0,0,0,0,1,0|3,0,0]=4 1015 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [0,0,0,0,1,0|3,0,0]=4 1016 B12R1.252 NC(=S)CCCc1ccccc1 Amb6244938 [0,0,0,0,1,0|1,1,0]=3 1017 B12R1.252 NC(=S)CCOc1ccccc1 Amb5542247 [0,0,0,0,1,0|2,1,0]=4 1018 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,0,0,0,1,0|2,1,0]=4 1019 B12R1.252 NC(=S)COCc1ccccc1 Amb6276568 [0,0,0,0,1,0|2,1,0]=4 1020 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [0,0,0,0,1,0|2,1,0]=4 1021 B12R1.252 O=C(Cl)CCCc1ccccc1 Amb2792925 [0,0,0,0,1,0|1,0,0]=2 1022 B12R1.252 O=C(Cl)CCOc1ccccc1 Amb33528394 [0,0,0,0,1,0|2,0,0]=3 1023 B12R1.252 O=C(Cl)CCSc1ccccc1 Amb10064363 [0,0,0,0,1,0|2,0,0]=3 1024 B12R1.252 O=C(Cl)COCc1ccccc1 Amb3939158 [0,0,0,0,1,0|2,0,0]=3 1025 B12R1.252 O=C(Cl)CSCc1ccccc1 Amb10880013 [0,0,0,0,1,0|2,0,0]=3 1026 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [0,0,0,0,1,0|1,0,2]=4 1027 B12R1.252 O=C(Cl)NCCc1ccccn1 Amb35637082 [0,0,0,0,1,0|3,0,0]=4 1028 B12R1.252 O=C(Cl)NCCc1cccnc1 Amb35625524 [0,0,0,0,1,0|3,0,0]=4 1029 B12R1.252 O=C(Cl)NCCc1ccncc1 Amb35625591 [0,0,0,0,1,0|3,0,0]=4 1030 B12R1.252 O=C(Cl)OCCc1ccccc1 Amb32661047 [0,0,0,0,1,0|1,0,0]=2 1031 B12R1.252 O=C(Cl)OCCc1ccccn1 Amb33297001 [0,0,0,0,1,0|2,0,0]=3 1032 B12R1.252 O=C(Cl)OCCc1cccnc1 Amb33297282 [0,0,0,0,1,0|2,0,0]=3 1033 B12R1.252 O=C(Cl)OCCc1cnccn1 Amb33297047 [0,0,0,0,1,0|3,0,0]=4 1034 B12R1.252 O=C(O)CC#Cc1ccccc1 Amb18296382 [0,0,0,0,1,0|1,0,2]=4 1035 B12R1.252 O=C(O)CCCC1=CCC=CC1 Amb6295892 [0,0,0,0,1,0|1,0,2]=4 1036 B12R1.252 O=C(O)CCCc1ccccc1 Amb2388283 [0,0,0,0,1,0|1,0,0]=2 1037 B12R1.252 O=C(O)CCCc1ccccn1 Amb1099328 [0,0,0,0,1,0|2,0,0]=3 1038 B12R1.252 O=C(O)CCCc1ccccn1 Amb19356883 [0,0,0,0,1,0|2,0,0]=3 1039 B12R1.252 O=C(O)CCCc1cccnc1 Amb17232526 [0,0,0,0,1,0|2,0,0]=3 1040 B12R1.252 O=C(O)CCCc1cccnc1 Amb33529414 [0,0,0,0,1,0|2,0,0]=3 1041 B12R1.252 O=C(O)CCCc1cccnc1 Amb33541549 [0,0,0,0,1,0|2,0,0]=3 1042 B12R1.252 O=C(O)CCCc1ccncc1 Amb1099336 [0,0,0,0,1,0|2,0,0]=3 1043 B12R1.252 O=C(O)CCCc1ccncc1 Amb19929548 [0,0,0,0,1,0|2,0,0]=3 1044 B12R1.252 O=C(O)CCCc1ccncn1 Amb33172094 [0,0,0,0,1,0|3,0,0]=4 1045 B12R1.252 O=C(O)CCCc1cncnc1 Amb18827885 [0,0,0,0,1,0|3,0,0]=4 1046 B12R1.252 O=C(O)CCCc1ncccn1 Amb18862661 [0,0,0,0,1,0|3,0,0]=4 1047 B12R1.252 O=C(O)CCNc1ccccc1 Amb1207377 [0,0,0,0,1,0|2,0,0]=3 1048 B12R1.252 O=C(O)CCNc1ccccn1 Amb10609119 [0,0,0,0,1,0|3,0,0]=4 1049 B12R1.252 O=C(O)CCNc1ccccn1 Amb6258091 [0,0,0,0,1,0|3,0,0]=4 1050 B12R1.252 O=C(O)CCNc1cccnc1 Amb18269696 [0,0,0,0,1,0|3,0,0]=4 1051 B12R1.252 O=C(O)CCNc1ccncc1 Amb33456130 [0,0,0,0,1,0|3,0,0]=4 1052 B12R1.252 O=C(O)CCNc1ccncc1 Amb6280380 [0,0,0,0,1,0|3,0,0]=4 1053 B12R1.252 O=C(O)CCOc1ccccc1 Amb1206804 [0,0,0,0,1,0|2,0,0]=3 1054 B12R1.252 O=C(O)CCOc1cccnc1 Amb33527345 [0,0,0,0,1,0|3,0,0]=4 1055 B12R1.252 O=C(O)CCSc1ccccc1 Amb1036581 [0,0,0,0,1,0|2,0,0]=3 1056 B12R1.252 O=C(O)CCSc1ccccn1 Amb1133894 [0,0,0,0,1,0|3,0,0]=4 1057 B12R1.252 O=C(O)CNCc1ccccc1 Amb2720113 [0,0,0,0,1,0|2,0,0]=3 1058 B12R1.252 O=C(O)CNCc1ccccc1 Amb6357824 [0,0,0,0,1,0|2,0,0]=3 1059 B12R1.252 O=C(O)CNCc1ccccn1 Amb1111426 [0,0,0,0,1,0|3,0,0]=4 1060 B12R1.252 O=C(O)CNCc1ccccn1 Amb13951702 [0,0,0,0,1,0|3,0,0]=4 1061 B12R1.252 O=C(O)CNCc1cccnc1 Amb1111197 [0,0,0,0,1,0|3,0,0]=4 1062 B12R1.252 O=C(O)CNCc1cccnc1 Amb6893093 [0,0,0,0,1,0|3,0,0]=4 1063 B12R1.252 O=C(O)CNCc1ccncc1 Amb1110916 [0,0,0,0,1,0|3,0,0]=4 1064 B12R1.252 O=C(O)CNCc1ccncc1 Amb32729434 [0,0,0,0,1,0|3,0,0]=4 1065 B12R1.252 O=C(O)COCc1ccccc1 Amb3939856 [0,0,0,0,1,0|2,0,0]=3 1066 B12R1.252 O=C(O)COCc1ccccn1 Amb32680346 [0,0,0,0,1,0|3,0,0]=4 1067 B12R1.252 O=C(O)COCc1ccccn1 Amb33548165 [0,0,0,0,1,0|3,0,0]=4 1068 B12R1.252 O=C(O)COCc1cccnc1 Amb28653073 [0,0,0,0,1,0|3,0,0]=4 1069 B12R1.252 O=C(O)COCc1ccncc1 Amb13883046 [0,0,0,0,1,0|3,0,0]=4 1070 B12R1.252 O=C(O)COCc1ccncc1 Amb8010071 [0,0,0,0,1,0|3,0,0]=4 1071 B12R1.252 O=C(O)CSCc1ccccc1 Amb6357378 [0,0,0,0,1,0|2,0,0]=3 1072 B12R1.252 O=C(O)CSCc1ccccn1 Amb1126746 [0,0,0,0,1,0|3,0,0]=4 1073 B12R1.252 O=C(O)CSCc1cccnc1 Amb1129471 [0,0,0,0,1,0|3,0,0]=4 1074 B12R1.252 O=C(O)CSCc1ccncc1 Amb1134758 [0,0,0,0,1,0|3,0,0]=4 1075 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb24113880 [0,0,0,0,1,0|2,0,0]=3 1076 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb6366026 [0,0,0,0,1,0|2,0,0]=3 1077 B12R1.252 O=C(O)C\C=C\c1ccccc1 Amb6280352 [0,0,0,0,1,0|1,0,2]=4 1078 B12R1.252 O=C(O)C\N=N\c1ccccc1 Amb27863405 [0,0,0,0,1,0|3,0,0]=4 1079 B12R1.252 O=C(O)\C=C\Cc1ccccc1 Amb8392409 [0,0,0,0,1,0|1,0,2]=4 1080 B12R1.252 O=C([O-])CCCc1ccccc1 Amb15690987 [0,0,0,0,1,0|1,0,0]=2 1081 B12R1.252 O=C([O-])CC[NH2+]c1ccccc1 Amb22499683 [0,0,0,0,1,0|2,0,0]=3 1082 B12R1.252 O=S([O-])CCCc1ccccc1 Amb32755679 [0,0,0,0,1,0|2,0,0]=3 1083 B12R1.252 O=S([O-])CCOc1ccccc1 Amb32755206 [0,0,0,0,1,0|3,0,0]=4 1084 B12R1.252 O=[PH](O)CNCc1ccccc1 Amb28383469 [0,0,0,0,1,0|3,0,0]=4 1085 B12R1.255 CC(=O)CCCCc1ccsc1 Amb33448717 [0,0,0,0,1,0|2,0,0]=3 1086 B12R1.255 CC(=O)CCCCn1cccn1 Amb9659582 [0,0,0,0,1,0|3,0,0]=4 1087 B12R1.255 CC(=O)\C=C\CCc1ccsc1 Amb33320898 [0,0,0,0,1,0|2,0,1]=4 1088 B12R1.255 O=C(Cl)CCCCc1cccs1 Amb5739989 [0,0,0,0,1,0|3,0,0]=4 1089 B12R1.255 O=C(O)CCCCc1ccco1 Amb18646922 [0,0,0,0,1,0|3,0,0]=4 1090 B12R1.255 O=C(O)CCCCc1cccs1 Amb6341870 [0,0,0,0,1,0|3,0,0]=4 1091 B12R1.255 O=C(O)CCCCc1ccsc1 Amb6300536 [0,0,0,0,1,0|3,0,0]=4 1092 B12R1.255 O=C(O)CCCCn1cccc1 Amb22495749 [0,0,0,0,1,0|3,0,0]=4 1093 B14R1.422 CC(=N)NCCOCc1ccccc1 Amb27428538 [0,0,0,0,0,1|2,0,0]=3 1094 B14R1.422 CC(=O)CCCCSc1ccccc1 Amb9660314 [0,0,0,0,0,1|1,0,0]=2 1095 B14R1.422 CC(=O)CCCNCc1ccccc1 Amb27831408 [0,0,0,0,0,1|1,0,0]=2 1096 B14R1.422 CC(=O)CCCSCc1ccccc1 Amb9660328 [0,0,0,0,0,1|1,0,0]=2 1097 B14R1.422 CC(=O)NCCNCc1ccccc1 Amb6732654 [0,0,0,0,0,1|1,0,0]=2 1098 B14R1.422 CC(=O)NCC\N=C\c1ccccc1 Amb24073400 [0,0,0,0,0,1|1,0,1]=3 1099 B14R1.422 CC(=O)NCNOCc1ccccc1 Amb28143645 [0,0,0,0,0,1|2,0,0]=3 1100 B14R1.422 CC(=O)OCCCOc1ccccc1 Amb24046251 [0,0,0,0,0,1|0,0,0]=1 1101 B14R1.422 CC(=O)OCCNCc1ccccc1 Amb18929298 [0,0,0,0,0,1|0,0,0]=1 1102 B14R1.422 CC(=O)SCCNCc1ccccc1 Amb27408459 [0,0,0,0,0,1|0,1,0]=2 1103 B14R1.422 CC(C)=CCCC#Cc1ccccc1 Amb35581885 [0,0,0,0,0,1|2,0,1]=4 1104 B14R1.422 CC(C)=CCCNCc1ccccc1 Amb27803975 [0,0,0,0,0,1|2,0,0]=3 1105 B14R1.422 CC(C)=CCCOCc1ccccc1 Amb27620812 [0,0,0,0,0,1|2,0,0]=3 1106 B14R1.422 CC(C)=CCNOCc1ccccc1 Amb27189924 [0,0,0,0,0,1|3,0,0]=4 1107 B14R1.422 CC(C)=C\C=C\CCc1ccccc1 Amb22546753 [0,0,0,0,0,1|2,0,1]=4 1108 B14R1.422 CC(C)CCOCCc1ccccc1 Amb22732326 [0,0,0,0,0,1|2,0,1]=4 1109 B14R1.422 CC(C)CNCCCc1ccccc1 Amb20673698 [0,0,0,0,0,1|2,0,1]=4 1110 B14R1.422 CC(C)CNCCCc1ccccc1 Amb6707256 [0,0,0,0,0,1|2,0,1]=4 1111 B14R1.422 CC(C)NCCCOc1ccccc1 Amb7760717 [0,0,0,0,0,1|2,0,1]=4 1112 B14R1.422 CC(O)CCCNCc1ccccc1 Amb27605962 [0,0,0,0,0,1|1,0,2]=4 1113 B14R1.422 CC(O)CCCOCc1ccccc1 Amb19042638 [0,0,0,0,0,1|1,0,2]=4 1114 B14R1.422 CC(O)CCNCCc1ccccc1 Amb33455982 [0,0,0,0,0,1|1,0,2]=4 1115 B14R1.422 CN(C)CCCNCc1ccccc1 Amb2370817 [0,0,0,0,0,1|3,0,0]=4 1116 B14R1.422 CN(C)CCCNCc1ccccc1 Amb6574221 [0,0,0,0,0,1|3,0,0]=4 1117 B14R1.422 CN(C)CCNCCc1ccccc1 Amb1136705 [0,0,0,0,0,1|3,0,0]=4 1118 B14R1.422 C[C@@H](O)CCCOCc1ccccc1 Amb27756440 [0,0,0,0,0,1|1,0,2]=4 1119 B14R1.422 C[C@H](O)CCCOCc1ccccc1 Amb27457818 [0,0,0,0,0,1|1,0,2]=4 1120 B14R1.422 N=C(N)NCCCCc1ccccc1 Amb32412066 [0,0,0,0,0,1|3,0,0]=4 1121 B14R1.422 N=C(N)NCCOCc1ccccc1 Amb28255031 [0,0,0,0,0,1|3,0,0]=4 1122 B14R1.422 N=C(N)NNCCCc1ccccc1 Amb24064219 [0,0,0,0,0,1|3,0,0]=4 1123 B14R1.422 N=C(N)SCCCOc1ccccc1 Amb20675993 [0,0,0,0,0,1|2,1,0]=4 1124 B14R1.422 N=C(N)SCCNCc1ccccc1 Amb27446566 [0,0,0,0,0,1|2,1,0]=4 1125 B14R1.422 NC(=O)CCCOCc1ccccc1 Amb25073445 [0,0,0,0,0,1|2,0,0]=3 1126 B14R1.422 NC(=O)CCNCCc1ccccc1 Amb22587630 [0,0,0,0,0,1|2,0,0]=3 1127 B14R1.422 NC(=O)CCNCCc1ccccc1 Amb8511712 [0,0,0,0,0,1|2,0,0]=3 1128 B14R1.422 NC(=O)CNCCCc1ccccc1 Amb6714614 [0,0,0,0,0,1|2,0,0]=3 1129 B14R1.422 NC(=O)OCCC#Cc1ccccc1 Amb27975850 [0,0,0,0,0,1|1,0,1]=3 1130 B14R1.422 NC(=O)OCCNCc1ccccc1 Amb28145444 [0,0,0,0,0,1|1,0,0]=2 1131 B14R1.422 NC(=O)\C=C\COCc1ccccc1 Amb27170679 [0,0,0,0,0,1|2,0,1]=4 1132 B14R1.422 NC(=S)COCCCc1ccncc1 Amb9208892 [0,0,0,0,0,1|2,1,0]=4 1133 B14R1.422 NC(N)=NCCNCc1ccccc1 Amb26938735 [0,0,0,0,0,1|3,0,0]=4 1134 B14R1.422 O=C(O)CCCCCc1ccccc1 Amb6357124 [0,0,0,0,0,1|2,0,0]=3 1135 B14R1.422 O=C(O)CCCCCc1ccccn1 Amb2503929 [0,0,0,0,0,1|3,0,0]=4 1136 B14R1.422 O=C(O)CCCCNc1ccccn1 Amb31204347 [0,0,0,0,0,1|3,0,0]=4 1137 B14R1.422 O=C(O)CCCCOc1ccccc1 Amb7764633 [0,0,0,0,0,1|2,0,0]=3 1138 B14R1.422 O=C(O)CCCNCc1ccccc1 Amb1111090 [0,0,0,0,0,1|2,0,0]=3 1139 B14R1.422 O=C(O)CCCNCc1ccccc1 Amb33546428 [0,0,0,0,0,1|2,0,0]=3 1140 B14R1.422 O=C(O)CCCNCc1ccccn1 Amb33526714 [0,0,0,0,0,1|3,0,0]=4 1141 B14R1.422 O=C(O)CCCNCc1cccnc1 Amb1110505 [0,0,0,0,0,1|3,0,0]=4 1142 B14R1.422 O=C(O)CCCNCc1ccncc1 Amb1109734 [0,0,0,0,0,1|3,0,0]=4 1143 B14R1.422 O=C(O)CCCOCc1ccccc1 Amb3939004 [0,0,0,0,0,1|2,0,0]=3 1144 B14R1.422 O=C(O)CCCSCc1ccccc1 Amb6245504 [0,0,0,0,0,1|2,0,0]=3 1145 B14R1.422 O=C(O)CCNCCc1ccccc1 Amb1111405 [0,0,0,0,0,1|2,0,0]=3 1146 B14R1.422 O=C(O)CCNCCc1ccccc1 Amb13952728 [0,0,0,0,0,1|2,0,0]=3 1147 B14R1.422 O=C(O)CCNOCc1ccccc1 Amb28254459 [0,0,0,0,0,1|3,0,0]=4 1148 B14R1.422 O=C(O)CCSCCc1ccncc1 Amb2719319 [0,0,0,0,0,1|3,0,0]=4 1149 B14R1.422 O=C(O)COCCCc1ccncc1 Amb9208854 [0,0,0,0,0,1|2,0,0]=3 1150 B14R1.422 O=C(O)COCCOc1ccccc1 Amb6278949 [0,0,0,0,0,1|2,0,0]=3 1151 B14R1.422 O=C(O)COC\C=C\c1ccccc1 Amb19041553 [0,0,0,0,0,1|1,0,2]=4 1152 B14R1.422 O=C(O)CSCCCc1ccccc1 Amb1110511 [0,0,0,0,0,1|1,1,0]=3 1153 B14R1.422 O=C(O)CSCCOc1ccccc1 Amb2417110 [0,0,0,0,0,1|2,1,0]=4 1154 B14R1.422 O=C(O)\C=C\COCc1ccccc1 Amb32718710 [0,0,0,0,0,1|2,0,1]=4 1155 B14R1.422 O=S(O)CCCNCc1ccccc1 Amb27236857 [0,0,0,0,0,1|3,0,0]=4 1156 B14R1.422 O=S([O-])CCCOCc1ccccc1 Amb27489321 [0,0,0,0,0,1|3,0,0]=4 1157 B11R1.28 BrCCCCc1ccccc1 Amb2685395 [2,0,0,0,0,0|1,0,1]=4 1158 B11R1.28 Br[Mg]CCCc1ccccc1 Amb6300511 [2,0,0,0,0,0|2,0,0]=4 1159 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [2,0,0,0,0,0|0,0,2]=4 1160 B11R1.28 C=CCCNc1ccccc1 Amb27495374 [2,0,0,0,0,0|1,0,1]=4 1161 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [2,0,0,0,0,0|1,0,1]=4 1162 B11R1.28 C=CCCSc1ccccc1 Amb27270191 [2,0,0,0,0,0|1,0,1]=4 1163 B11R1.28 C=CCNCc1ccccc1 Amb6683954 [2,0,0,0,0,0|1,0,1]=4 1164 B11R1.28 C=CCNCc1ccccc1 Amb6864764 [2,0,0,0,0,0|1,0,1]=4 1165 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [2,0,0,0,0,0|1,0,1]=4 1166 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [2,0,0,0,0,0|1,0,1]=4 1167 B11R1.28 CCCCCc1ccccc1 Amb2722921 [2,0,0,0,0,0|0,0,1]=3 1168 B11R1.28 CCCCCc1ccccn1 Amb533507 [2,0,0,0,0,0|1,0,1]=4 1169 B11R1.28 CCCCCc1cccnc1 Amb17672949 [2,0,0,0,0,0|1,0,1]=4 1170 B11R1.28 CCCCCc1ccncc1 Amb17672950 [2,0,0,0,0,0|1,0,1]=4 1171 B11R1.28 CCCCNc1ccccc1 Amb3940154 [2,0,0,0,0,0|1,0,1]=4 1172 B11R1.28 CCCCOc1ccccc1 Amb2685665 [2,0,0,0,0,0|1,0,1]=4 1173 B11R1.28 CCCCSc1ccccc1 Amb3836105 [2,0,0,0,0,0|1,0,1]=4 1174 B11R1.28 CCCNCc1ccccc1 Amb1105937 [2,0,0,0,0,0|1,0,1]=4 1175 B11R1.28 CCCNCc1ccccc1 Amb6537999 [2,0,0,0,0,0|1,0,1]=4 1176 B11R1.28 CCCSCc1ccccc1 Amb27000631 [2,0,0,0,0,0|1,0,1]=4 1177 B11R1.28 CCNCCc1ccccc1 Amb33551205 [2,0,0,0,0,0|1,0,1]=4 1178 B11R1.28 CCNCCc1ccccc1 Amb6244873 [2,0,0,0,0,0|1,0,1]=4 1179 B11R1.28 CCOCCc1ccccc1 Amb4035236 [2,0,0,0,0,0|0,0,1]=3 1180 B11R1.28 CCOCCc1ccccn1 Amb2722907 [2,0,0,0,0,0|1,0,1]=4 1181 B11R1.28 CCOCOc1ccccc1 Amb28388170 [2,0,0,0,0,0|1,0,1]=4 1182 B11R1.28 CCONCc1ccccc1 Amb25151184 [2,0,0,0,0,0|1,0,1]=4 1183 B11R1.28 CNCCCc1ccccc1 Amb21954280 [2,0,0,0,0,0|1,0,0]=3 1184 B11R1.28 CNCCCc1ccccc1 Amb2721795 [2,0,0,0,0,0|1,0,0]=3 1185 B11R1.28 CNCCCc1ccccn1 Amb18312462 [2,0,0,0,0,0|2,0,0]=4 1186 B11R1.28 CNCCNc1ccccc1 Amb6825621 [2,0,0,0,0,0|2,0,0]=4 1187 B11R1.28 CNCCOc1ccccc1 Amb1105525 [2,0,0,0,0,0|2,0,0]=4 1188 B11R1.28 CNCCOc1ccccc1 Amb2691365 [2,0,0,0,0,0|2,0,0]=4 1189 B11R1.28 CNCCSc1ccccc1 Amb10608735 [2,0,0,0,0,0|2,0,0]=4 1190 B11R1.28 CNCCSc1ccccc1 Amb17622507 [2,0,0,0,0,0|2,0,0]=4 1191 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [2,0,0,0,0,0|0,0,2]=4 1192 B11R1.28 COCCCc1ccncn1 Amb23453461 [2,0,0,0,0,0|2,0,0]=4 1193 B11R1.28 COCCNc1ccccc1 Amb596066 [2,0,0,0,0,0|1,0,0]=3 1194 B11R1.28 COCCNc1cccnc1 Amb18268638 [2,0,0,0,0,0|2,0,0]=4 1195 B11R1.28 COCCNc1ccncc1 Amb6632784 [2,0,0,0,0,0|2,0,0]=4 1196 B11R1.28 COCCOc1ccccc1 Amb4018811 [2,0,0,0,0,0|1,0,0]=3 1197 B11R1.28 COCCSc1ccccn1 Amb17760116 [2,0,0,0,0,0|2,0,0]=4 1198 B11R1.28 COCNCc1ccccc1 Amb25053350 [2,0,0,0,0,0|1,0,0]=3 1199 B11R1.28 CONCCc1cccnc1 Amb27987592 [2,0,0,0,0,0|2,0,0]=4 1200 B11R1.28 CONCCc1ccncc1 Amb27987581 [2,0,0,0,0,0|2,0,0]=4 1201 B11R1.28 CSCCCc1ccccc1 Amb25383748 [2,0,0,0,0,0|0,1,0]=3 1202 B11R1.28 CSCCNc1ccccc1 Amb17307504 [2,0,0,0,0,0|1,1,0]=4 1203 B11R1.28 CSCCOc1ccccc1 Amb4020915 [2,0,0,0,0,0|1,1,0]=4 1204 B11R1.28 CSCNCc1ccccc1 Amb26414504 [2,0,0,0,0,0|1,1,0]=4 1205 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [2,0,0,0,0,0|0,0,1]=3 1206 B11R1.28 C\C=C\CCc1ccncc1 Amb25830692 [2,0,0,0,0,0|1,0,1]=4 1207 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [2,0,0,0,0,0|1,0,1]=4 1208 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [2,0,0,0,0,0|1,0,1]=4 1209 B11R1.28 ClCCCCc1ccccc1 Amb3940707 [2,0,0,0,0,0|1,0,1]=4 1210 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [2,0,0,0,0,0|1,0,1]=4 1211 B11R1.28 ICCCCc1ccccc1 Amb25380384 [2,0,0,0,0,0|1,0,1]=4 1212 B11R1.28 N#CCCCc1ccccc1 Amb6251750 [2,0,0,0,0,0|1,0,1]=4 1213 B11R1.28 NCCCCc1ccccc1 Amb1227740 [2,0,0,0,0,0|1,0,1]=4 1214 B11R1.28 NNCCCc1ccccc1 Amb19373221 [2,0,0,0,0,0|2,0,0]=4 1215 B11R1.28 NNCCCc1ccccc1 Amb6252219 [2,0,0,0,0,0|2,0,0]=4 1216 B11R1.28 NOCCCc1ccccc1 Amb2610651 [2,0,0,0,0,0|1,0,0]=3 1217 B11R1.28 NOCCCc1ccccn1 Amb17089546 [2,0,0,0,0,0|2,0,0]=4 1218 B11R1.28 NOCCCc1cccnc1 Amb17089547 [2,0,0,0,0,0|2,0,0]=4 1219 B11R1.28 NOCCCc1ccncc1 Amb17089548 [2,0,0,0,0,0|2,0,0]=4 1220 B11R1.28 NOCCOc1ccccc1 Amb17088287 [2,0,0,0,0,0|2,0,0]=4 1221 B11R1.28 NOCCOc1ccccc1 Amb19894640 [2,0,0,0,0,0|2,0,0]=4 1222 B11R1.28 NOCOCc1ccccc1 Amb10606697 [2,0,0,0,0,0|2,0,0]=4 1223 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [2,0,0,0,0,0|1,0,1]=4 1224 B11R1.28 O=CCC#Cc1ccccc1 Amb27390152 [2,0,0,0,0,0|0,0,2]=4 1225 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [2,0,0,0,0,0|0,0,0]=2 1226 B11R1.28 O=CCCCc1ccccn1 Amb22897023 [2,0,0,0,0,0|1,0,0]=3 1227 B11R1.28 O=CCCCc1cccnc1 Amb24099514 [2,0,0,0,0,0|1,0,0]=3 1228 B11R1.28 O=CCCCc1ccncc1 Amb24099515 [2,0,0,0,0,0|1,0,0]=3 1229 B11R1.28 O=CCCCc1ccncn1 Amb24099617 [2,0,0,0,0,0|2,0,0]=4 1230 B11R1.28 O=CCCCc1cnccn1 Amb26990640 [2,0,0,0,0,0|2,0,0]=4 1231 B11R1.28 O=CCCCc1cncnc1 Amb24063015 [2,0,0,0,0,0|2,0,0]=4 1232 B11R1.28 O=CCCCc1ncccn1 Amb24061342 [2,0,0,0,0,0|2,0,0]=4 1233 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [2,0,0,0,0,0|1,0,0]=3 1234 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [2,0,0,0,0,0|1,0,0]=3 1235 B11R1.28 O=CCCSc1ccncc1 Amb27671141 [2,0,0,0,0,0|2,0,0]=4 1236 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [2,0,0,0,0,0|1,0,0]=3 1237 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [2,0,0,0,0,0|1,0,0]=3 1238 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [2,0,0,0,0,0|1,0,0]=3 1239 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [2,0,0,0,0,0|2,0,0]=4 1240 B11R1.28 O=COCCc1ccccc1 Amb6357955 [2,0,0,0,0,0|0,0,0]=2 1241 B11R1.28 O=C\C=C/Cc1ccccc1 Amb27861231 [2,0,0,0,0,0|0,0,2]=4 1242 B11R1.28 O=C\C=C\Cc1ccccc1 Amb32954519 [2,0,0,0,0,0|0,0,2]=4 1243 B11R1.28 OCCCCc1ccccc1 Amb3939083 [2,0,0,0,0,0|0,0,2]=4 1244 B11R1.28 ONCCCc1ccccc1 Amb26650950 [2,0,0,0,0,0|1,0,1]=4 1245 B11R1.28 SCCCCc1ccccc1 Amb17400224 [2,0,0,0,0,0|0,1,1]=4 1246 B11R1.28 [C-]#[N+]CCCc1ccccc1 Amb2690315 [2,0,0,0,0,0|1,0,1]=4 1247 B13R1.6 CCCCCCc1cccc(Br)c1 Amb10808077 [1,1,0,0,0,0|1,0,1]=4 1248 B13R1.6 CCOCCOc1cccc(N)c1 Amb2095282 [1,1,0,0,0,0|1,0,1]=4 1249 B13R1.6 CCOCCOc1cccc(N)c1 Amb9024642 [1,1,0,0,0,0|1,0,1]=4 1250 B13R1.6 CNCCCCc1cccc(Br)c1 Amb31157052 [1,1,0,0,0,0|2,0,0]=4 1251 B13R1.6 CNCCCCc1cccc(Br)c1 Amb33309544 [1,1,0,0,0,0|2,0,0]=4 1252 B13R1.6 Cc1cccc(CCCN=C=O)c1 Amb31094176 [1,1,0,0,0,0|1,0,1]=4 1253 B13R1.6 Cc1cccc(CSCCC=O)c1 Amb19042837 [1,1,0,0,0,0|2,0,0]=4 1254 B13R1.6 O=C=NCCCc1cccc(Br)c1 Amb31094181 [1,1,0,0,0,0|1,0,1]=4 1255 B13R1.6 O=C=NCCCc1cccc(Cl)c1 Amb31094180 [1,1,0,0,0,0|1,0,1]=4 1256 B13R1.6 O=C=NCCCc1cccc(F)c1 Amb31094178 [1,1,0,0,0,0|1,0,1]=4 1257 B13R1.6 O=CCCCCc1cccc(Br)c1 Amb18549459 [1,1,0,0,0,0|1,0,0]=3 1258 B13R1.6 O=CCCCOc1cccc(F)c1 Amb33226688 [1,1,0,0,0,0|2,0,0]=4 1259 B13R1.6 O=C\C=C\CCc1cccc(Br)c1 Amb33433434 [1,1,0,0,0,0|1,0,1]=4 1260 B13R1.9 CCCCCCc1ccc(Br)cc1 Amb2722820 [1,1,0,0,0,0|1,0,1]=4 1261 B13R1.9 CCCCCCc1ccc(I)cc1 Amb22043588 [1,1,0,0,0,0|1,0,1]=4 1262 B13R1.9 CCCCCCc1ccc(N)cc1 Amb2720502 [1,1,0,0,0,0|1,0,1]=4 1263 B13R1.9 CCOCCNc1ccc(Cl)cc1 Amb28555840 [1,1,0,0,0,0|1,0,1]=4 1264 B13R1.9 CCOCCOc1ccc(Br)cc1 Amb9239858 [1,1,0,0,0,0|1,0,1]=4 1265 B13R1.9 CCOCCOc1ccc(N)cc1 Amb2091063 [1,1,0,0,0,0|1,0,1]=4 1266 B13R1.9 CCOCCOc1ccc(N)cc1 Amb6676244 [1,1,0,0,0,0|1,0,1]=4 1267 B13R1.9 CNCCCCc1ccc(Br)cc1 Amb17106027 [1,1,0,0,0,0|2,0,0]=4 1268 B13R1.9 CNCCCCc1ccc(Cl)cc1 Amb17106026 [1,1,0,0,0,0|2,0,0]=4 1269 B13R1.9 CNCCCCc1ccc(F)cc1 Amb17106025 [1,1,0,0,0,0|2,0,0]=4 1270 B13R1.9 C\C=C\CCNc1ccc(N)cc1 Amb27791637 [1,1,0,0,0,0|2,0,0]=4 1271 B13R1.9 Cc1ccc(CCCCC=O)cc1 Amb18549429 [1,1,0,0,0,0|1,0,0]=3 1272 B13R1.9 Cc1ccc(CCCN=C=O)cc1 Amb17089363 [1,1,0,0,0,0|1,0,1]=4 1273 B13R1.9 O=C=NCCCc1ccc(Br)cc1 Amb17089372 [1,1,0,0,0,0|1,0,1]=4 1274 B13R1.9 O=C=NCCCc1ccc(Cl)cc1 Amb17089371 [1,1,0,0,0,0|1,0,1]=4 1275 B13R1.9 O=C=NCCCc1ccc(F)cc1 Amb17089370 [1,1,0,0,0,0|1,0,1]=4 1276 B13R1.9 O=CCCCCc1ccc(Br)cc1 Amb18050046 [1,1,0,0,0,0|1,0,0]=3 1277 B13R1.9 O=CCCCCc1ccc(Cl)cc1 Amb18050047 [1,1,0,0,0,0|1,0,0]=3 1278 B13R1.9 O=CCCCCc1ccc(F)cc1 Amb18549430 [1,1,0,0,0,0|1,0,0]=3 1279 B13R1.9 O=CCCSCc1ccc(Cl)cc1 Amb32682690 [1,1,0,0,0,0|2,0,0]=4 1280 B13R1.9 O=C\C=C\CCc1ccc(Br)cc1 Amb33332215 [1,1,0,0,0,0|1,0,1]=4 1281 B13R1.9 O=C\C=C\CCc1ccc(F)cc1 Amb33319642 [1,1,0,0,0,0|1,0,1]=4 1282 B13R1.24 C=CCCCC(N)c1ccccc1 Amb18127534 [1,1,0,0,0,0|1,0,1]=4 1283 B13R1.24 CC#CCCC(N)c1ccccc1 Amb27617693 [1,1,0,0,0,0|1,0,1]=4 1284 B13R1.24 CC(CCN=C=O)c1ccccc1 Amb32953286 [1,1,0,0,0,0|1,0,1]=4 1285 B13R1.24 CCCCCC(N)c1ccccc1 Amb7764725 [1,1,0,0,0,0|1,0,1]=4 1286 B13R1.24 CCCCCC(O)c1ccccc1 Amb9619574 [1,1,0,0,0,0|1,0,1]=4 1287 B13R1.24 CCCCCC(S)c1ccccc1 Amb32788166 [1,1,0,0,0,0|1,0,1]=4 1288 B13R1.28 BrCCCCCCc1ccccc1 Amb2685411 [1,1,0,0,0,0|1,0,1]=4 1289 B13R1.28 BrCCOCCOc1ccccc1 Amb6256002 [1,1,0,0,0,0|1,0,1]=4 1290 B13R1.28 C=CCCCOCc1ccccc1 Amb25286747 [1,1,0,0,0,0|1,0,1]=4 1291 B13R1.28 C=CCCNCCc1ccccc1 Amb19737352 [1,1,0,0,0,0|1,0,1]=4 1292 B13R1.28 C=CCNCCCc1ccccc1 Amb20673619 [1,1,0,0,0,0|1,0,1]=4 1293 B13R1.28 C=CCNCCCc1ccccc1 Amb6706500 [1,1,0,0,0,0|1,0,1]=4 1294 B13R1.28 CC#CCCNCc1ccccc1 Amb27955822 [1,1,0,0,0,0|1,0,1]=4 1295 B13R1.28 CCCCCCCc1ccccc1 Amb8513456 [1,1,0,0,0,0|1,0,1]=4 1296 B13R1.28 CCCCCCNc1ccccc1 Amb597405 [1,1,0,0,0,0|1,0,1]=4 1297 B13R1.28 CCCCCNCc1ccccc1 Amb838091 [1,1,0,0,0,0|1,0,1]=4 1298 B13R1.28 CCCCNCCc1ccccc1 Amb2172322 [1,1,0,0,0,0|1,0,1]=4 1299 B13R1.28 CCCCNCCc1ccccc1 Amb875620 [1,1,0,0,0,0|1,0,1]=4 1300 B13R1.28 CCCCOCCc1ccccc1 Amb24065444 [1,1,0,0,0,0|1,0,1]=4 1301 B13R1.28 CCCNCCCc1ccccc1 Amb20673529 [1,1,0,0,0,0|1,0,1]=4 1302 B13R1.28 CCCNCCCc1ccccc1 Amb6714447 [1,1,0,0,0,0|1,0,1]=4 1303 B13R1.28 CCCOCCCc1ccccc1 Amb24063573 [1,1,0,0,0,0|0,0,1]=3 1304 B13R1.28 CCNCCCCc1ccccc1 Amb8853688 [1,1,0,0,0,0|1,0,1]=4 1305 B13R1.28 CCNCCCOc1ccccc1 Amb7760967 [1,1,0,0,0,0|1,0,1]=4 1306 B13R1.28 CCOCCCNc1ccncc1 Amb6638685 [1,1,0,0,0,0|1,0,1]=4 1307 B13R1.28 CCOCCNCc1ccccc1 Amb9241003 [1,1,0,0,0,0|0,0,1]=3 1308 B13R1.28 CCOCCNCc1ccccn1 Amb9241011 [1,1,0,0,0,0|1,0,1]=4 1309 B13R1.28 CCOCCNCc1cccnc1 Amb9241013 [1,1,0,0,0,0|1,0,1]=4 1310 B13R1.28 CCOCCNCc1ccncc1 Amb9241012 [1,1,0,0,0,0|1,0,1]=4 1311 B13R1.28 CNCCCCOc1ccccc1 Amb17309029 [1,1,0,0,0,0|2,0,0]=4 1312 B13R1.28 CNCCCOCc1ccccc1 Amb18186412 [1,1,0,0,0,0|2,0,0]=4 1313 B13R1.28 COCCCNCc1ccccc1 Amb2172436 [1,1,0,0,0,0|2,0,0]=4 1314 B13R1.28 COCCCNCc1ccccc1 Amb838852 [1,1,0,0,0,0|2,0,0]=4 1315 B13R1.28 COCCNCCc1ccccc1 Amb6685596 [1,1,0,0,0,0|2,0,0]=4 1316 B13R1.28 CONCCOCc1ccccc1 Amb27655349 [1,1,0,0,0,0|2,0,0]=4 1317 B13R1.28 CSCCCNCc1ccccc1 Amb6719949 [1,1,0,0,0,0|2,0,0]=4 1318 B13R1.28 ClCOCCOCc1ccccc1 Amb27205014 [1,1,0,0,0,0|1,0,1]=4 1319 B13R1.28 ClC\C=C\CNCc1ccccc1 Amb28044386 [1,1,0,0,0,0|2,0,0]=4 1320 B13R1.28 NCC#CCCCc1ccccc1 Amb27415576 [1,1,0,0,0,0|1,0,1]=4 1321 B13R1.28 NCCCCCCc1ccccc1 Amb17233312 [1,1,0,0,0,0|1,0,1]=4 1322 B13R1.28 NCCNCCCc1ccccc1 Amb17091041 [1,1,0,0,0,0|1,0,1]=4 1323 B13R1.28 NCCOCCCc1ccncc1 Amb9208860 [1,1,0,0,0,0|1,0,1]=4 1324 B13R1.28 NCCOCCOc1ccccc1 Amb10609253 [1,1,0,0,0,0|1,0,1]=4 1325 B13R1.28 NCCOCCOc1ccccc1 Amb6248766 [1,1,0,0,0,0|1,0,1]=4 1326 B13R1.28 NCCOCCSc1ccccc1 Amb17402217 [1,1,0,0,0,0|1,0,1]=4 1327 B13R1.28 NCCOCCSc1ccccc1 Amb32662201 [1,1,0,0,0,0|1,0,1]=4 1328 B13R1.28 NC\C=C\CNCc1ccccc1 Amb27648518 [1,1,0,0,0,0|2,0,0]=4 1329 B13R1.28 O=C=NCCCOc1ccccc1 Amb20668029 [1,1,0,0,0,0|1,0,1]=4 1330 B13R1.28 O=CCCCCOc1ccccc1 Amb18790943 [1,1,0,0,0,0|1,0,0]=3 1331 B13R1.28 O=CCCCOCc1ccccc1 Amb26588994 [1,1,0,0,0,0|1,0,0]=3 1332 B13R1.28 O=CCOCC#Cc1ccccc1 Amb27592899 [1,1,0,0,0,0|0,0,2]=4 1333 B13R1.28 O=CCOCCCc1ccccc1 Amb18790942 [1,1,0,0,0,0|0,0,0]=2 1334 B13R1.28 O=CNCCC#Cc1ccccc1 Amb27637706 [1,1,0,0,0,0|1,0,1]=4 1335 B13R1.28 OCCCCCCc1ccccc1 Amb8515378 [1,1,0,0,0,0|1,0,1]=4 1336 B13R1.28 OCCNCCCc1ccccc1 Amb7757048 [1,1,0,0,0,0|1,0,1]=4 1337 B13R1.28 OCCOCCOc1ccccc1 Amb18796575 [1,1,0,0,0,0|1,0,1]=4 1338 B13R1.28 OCCOCOCc1ccccc1 Amb27390681 [1,1,0,0,0,0|1,0,1]=4 1339 B13R1.28 OCCSCCCc1ccccc1 Amb9362854 [1,1,0,0,0,0|0,1,1]=4 1340 B13R1.28 OC\C=C/COCc1ccccc1 Amb9825931 [1,1,0,0,0,0|2,0,0]=4 1341 B13R1.28 OC\C=C\COCc1ccccc1 Amb27180534 [1,1,0,0,0,0|2,0,0]=4 1342 B13R1.28 SC\C=C\COCc1ccccc1 Amb27651552 [1,1,0,0,0,0|2,0,0]=4 1343 B13R1.42 C=CCC(O)CCc1ccccc1 Amb8392369 [1,1,0,0,0,0|1,0,1]=4 1344 B13R1.42 C=COC(=O)CCc1ccccc1 Amb21858909 [1,1,0,0,0,0|0,0,2]=4 1345 B13R1.42 CC#CC(O)CCc1ccccc1 Amb17619341 [1,1,0,0,0,0|1,0,1]=4 1346 B13R1.42 CC(CCc1ccccc1)N=C=O Amb33081222 [1,1,0,0,0,0|1,0,1]=4 1347 B13R1.42 CCCC(N)CCc1ccccc1 Amb9031789 [1,1,0,0,0,0|1,0,1]=4 1348 B13R1.42 CCOC(=O)CCc1ccccc1 Amb3940133 [1,1,0,0,0,0|0,0,2]=4 1349 B13R1.42 CCOC(C)OCc1ccccc1 Amb28247923 [1,1,0,0,0,0|1,0,1]=4 1350 B13R1.42 C[C@H](CC=O)OCc1ccccc1 Amb27755041 [1,1,0,0,0,0|2,0,0]=4 1351 B13R1.42 C\C=C\[C@H](C)NCc1ccccc1 Amb27390054 [1,1,0,0,0,0|2,0,0]=4 1352 B13R1.44 CCCCC(O)Cc1ccccc1 Amb4034774 [1,1,0,0,0,0|1,0,1]=4 1353 B13R1.44 C\C=C\CN(C)Cc1ccccc1 Amb28453964 [1,1,0,0,0,0|2,0,0]=4 1354 B13R1.555 CCOCCNc1ccccc1N Amb8396582 [1,1,0,0,0,0|1,0,1]=4 1355 B13R1.555 CCOCCOc1ccccc1N Amb2111920 [1,1,0,0,0,0|1,0,1]=4 1356 B13R1.555 CCOCCOc1ccccc1N Amb6676242 [1,1,0,0,0,0|1,0,1]=4 1357 B13R1.555 Cc1ccccc1CCCN=C=O Amb31094175 [1,1,0,0,0,0|1,0,1]=4 1358 B13R1.555 Cc1ccccc1CSCCC=O Amb19042836 [1,1,0,0,0,0|2,0,0]=4 1359 B13R1.555 O=C=NCCCc1ccccc1Cl Amb31094179 [1,1,0,0,0,0|1,0,1]=4 1360 B13R1.555 O=C=NCCCc1ccccc1F Amb31094177 [1,1,0,0,0,0|1,0,1]=4 1361 B13R1.555 O=CCCSCc1ccccc1Cl Amb32682687 [1,1,0,0,0,0|2,0,0]=4 1362 B13R1.718 C=C(C=O)COCc1ccccc1 Amb8392637 [1,1,0,0,0,0|2,0,0]=4 1363 B13R1.718 CC(C=O)CNCc1ccccc1 Amb27748669 [1,1,0,0,0,0|2,0,0]=4 1364 B13R1.718 CC(C=O)COCc1ccccc1 Amb18128219 [1,1,0,0,0,0|2,0,0]=4 1365 B13R1.718 CNC(=O)CCCc1ccccc1 Amb3886751 [1,1,0,0,0,0|2,0,0]=4 1366 B13R1.718 COC(=O)CCCc1ccccc1 Amb2720838 [1,1,0,0,0,0|2,0,0]=4 1367 B13R1.718 O=CC(F)COCc1ccccc1 Amb28144110 [1,1,0,0,0,0|2,0,0]=4 1368 B13R1.718 O=C[C@H](F)COCc1ccccc1 Amb27782446 [1,1,0,0,0,0|2,0,0]=4 1369 B13R1.45 C=C(C)CNC(C)c1ccccc1 Amb17308958 [0,1,0,0,1,0|2,0,0]=4 1370 B13R1.45 C=C(COC(C)=O)c1ccccc1 Amb17778927 [0,1,0,0,1,0|0,0,1]=3 1371 B13R1.45 CC(=O)CCC(=O)c1ccccc1 Amb6357807 [0,1,0,0,1,0|0,0,1]=3 1372 B13R1.45 CC(=O)CCC(=O)c1ccccn1 Amb6301488 [0,1,0,0,1,0|1,0,1]=4 1373 B13R1.45 CC(=O)CCC(=O)c1cccnc1 Amb9472228 [0,1,0,0,1,0|1,0,1]=4 1374 B13R1.45 CC(=O)CCC(=O)c1ccncc1 Amb9472251 [0,1,0,0,1,0|1,0,1]=4 1375 B13R1.45 CC(=O)CCC(C)c1ccccc1 Amb33082106 [0,1,0,0,1,0|0,0,0]=2 1376 B13R1.45 CC(=O)CCC(Cl)c1ccccc1 Amb17402167 [0,1,0,0,1,0|0,0,0]=2 1377 B13R1.45 CC(=O)CCC(Cl)c1ccccn1 Amb17402226 [0,1,0,0,1,0|1,0,0]=3 1378 B13R1.45 CC(=O)CCC(Cl)c1cccnc1 Amb17402227 [0,1,0,0,1,0|1,0,0]=3 1379 B13R1.45 CC(=O)CCC(Cl)c1ccncc1 Amb17402228 [0,1,0,0,1,0|1,0,0]=3 1380 B13R1.45 CC(=O)CCN(C)c1ccccc1 Amb8388281 [0,1,0,0,1,0|1,0,0]=3 1381 B13R1.45 CC(=O)CNC(=O)c1ccccc1 Amb9836069 [0,1,0,0,1,0|1,0,1]=4 1382 B13R1.45 CC(=O)COC(=O)c1ccccc1 Amb22497327 [0,1,0,0,1,0|1,0,1]=4 1383 B13R1.45 CC(=O)C\C=C(/C)c1ccccc1 Amb27169026 [0,1,0,0,1,0|0,0,2]=4 1384 B13R1.45 CC(=O)NCC(=O)c1ccccc1 Amb17335159 [0,1,0,0,1,0|1,0,1]=4 1385 B13R1.45 CC(=O)NCC(Br)c1ccccc1 Amb27809645 [0,1,0,0,1,0|1,0,0]=3 1386 B13R1.45 CC(=O)NCC(C)c1ccccc1 Amb8384388 [0,1,0,0,1,0|1,0,0]=3 1387 B13R1.45 CC(=O)NCC(C)c1ccccn1 Amb35694000 [0,1,0,0,1,0|2,0,0]=4 1388 B13R1.45 CC(=O)NCC(O)c1ccccc1 Amb9244841 [0,1,0,0,1,0|1,0,0]=3 1389 B13R1.45 CC(=O)NCC(O)c1ccccn1 Amb27268413 [0,1,0,0,1,0|2,0,0]=4 1390 B13R1.45 CC(=O)NCC(O)c1ccncc1 Amb27591120 [0,1,0,0,1,0|2,0,0]=4 1391 B13R1.45 CC(=O)NCN(C)c1ccccc1 Amb27946390 [0,1,0,0,1,0|2,0,0]=4 1392 B13R1.45 CC(=O)NC[C@H](O)c1ccccc1 Amb27427139 [0,1,0,0,1,0|1,0,0]=3 1393 B13R1.45 CC(=O)NC[PH](=O)c1ccccc1 Amb27174263 [0,1,0,0,1,0|2,0,0]=4 1394 B13R1.45 CC(=O)OCC(=O)c1ccccc1 Amb4017907 [0,1,0,0,1,0|0,0,1]=3 1395 B13R1.45 CC(=O)OCC(C)c1ccccc1 Amb4020115 [0,1,0,0,1,0|0,0,0]=2 1396 B13R1.45 CC(=O)O\C=C(/C)c1ccccc1 Amb17778975 [0,1,0,0,1,0|0,0,2]=4 1397 B13R1.45 CC(=O)O\C=C(\C)c1ccccc1 Amb25290986 [0,1,0,0,1,0|0,0,2]=4 1398 B13R1.45 CC(=O)\C=C/C(O)c1ccccc1 Amb27749808 [0,1,0,0,1,0|0,0,2]=4 1399 B13R1.45 CC(=O)\C=C\C(C)c1ccccc1 Amb24090253 [0,1,0,0,1,0|0,0,2]=4 1400 B13R1.45 CC(C)=CCC(O)c1ccccc1 Amb27945977 [0,1,0,0,1,0|1,0,1]=4 1401 B13R1.45 CC(C)=CC[C@H](O)c1ccccc1 Amb27757376 [0,1,0,0,1,0|1,0,1]=4 1402 B13R1.45 CC(C)CCC(N)c1ccccc1 Amb35745830 [0,1,0,0,1,0|1,0,1]=4 1403 B13R1.45 CC(C)CCC(N)c1ccccc1 Amb6744642 [0,1,0,0,1,0|1,0,1]=4 1404 B13R1.45 CC(C)OC[C@@H](N)c1ccccc1 Amb17061653 [0,1,0,0,1,0|1,0,1]=4 1405 B13R1.45 CC(CCC(=O)O)c1ccccc1 Amb857806 [0,1,0,0,1,0|1,0,0]=3 1406 B13R1.45 CC(CC[C@@H](C)N)c1ccccc1 Amb33081846 [0,1,0,0,1,0|1,0,1]=4 1407 B13R1.45 CC(CC[C@@H](C)O)c1ccccc1 Amb33081845 [0,1,0,0,1,0|0,0,2]=4 1408 B13R1.45 CC(CC[C@H](C)N)c1ccccc1 Amb33081850 [0,1,0,0,1,0|1,0,1]=4 1409 B13R1.45 CC(CC[C@H](C)O)c1ccccc1 Amb33081839 [0,1,0,0,1,0|0,0,2]=4 1410 B13R1.45 CC(CC[N+](=O)[O-])c1ccccc1 Amb33081885 [0,1,0,0,1,0|2,0,0]=4 1411 B13R1.45 CC(CNC(=O)Cl)c1ccccc1 Amb35609815 [0,1,0,0,1,0|2,0,0]=4 1412 B13R1.45 CC(CNC(N)=O)c1ccccc1 Amb25156032 [0,1,0,0,1,0|2,0,0]=4 1413 B13R1.45 CC(COC(=O)Cl)c1ccccc1 Amb33297204 [0,1,0,0,1,0|1,0,0]=3 1414 B13R1.45 CC(N)CCC(C)c1ccccc1 Amb32953212 [0,1,0,0,1,0|1,0,1]=4 1415 B13R1.45 CC(NCC(=O)O)c1ccccc1 Amb7766412 [0,1,0,0,1,0|2,0,0]=4 1416 B13R1.45 CC(NCC(N)=O)c1ccccc1 Amb33541973 [0,1,0,0,1,0|2,0,0]=4 1417 B13R1.45 CC(O)CCC(C)c1ccccc1 Amb33081451 [0,1,0,0,1,0|0,0,2]=4 1418 B13R1.45 CC(OCC(=O)O)c1ccccc1 Amb6269624 [0,1,0,0,1,0|2,0,0]=4 1419 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb1108005 [0,1,0,0,1,0|2,0,0]=4 1420 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb22754498 [0,1,0,0,1,0|2,0,0]=4 1421 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb13949100 [0,1,0,0,1,0|2,0,0]=4 1422 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb30622860 [0,1,0,0,1,0|2,0,0]=4 1423 B13R1.45 CN(C)CCC(N)c1ccccc1 Amb9751862 [0,1,0,0,1,0|2,0,0]=4 1424 B13R1.45 CN(C)CCC(O)c1ccccc1 Amb671497 [0,1,0,0,1,0|2,0,0]=4 1425 B13R1.45 CN(CCC(=O)Cl)c1ccccc1 Amb17143181 [0,1,0,0,1,0|2,0,0]=4 1426 B13R1.45 CN(CCC(=O)O)c1ccccc1 Amb33551397 [0,1,0,0,1,0|2,0,0]=4 1427 B13R1.45 CN(CCC(=O)O)c1ccccc1 Amb845407 [0,1,0,0,1,0|2,0,0]=4 1428 B13R1.45 CN(CCC(N)=O)c1ccccc1 Amb17142975 [0,1,0,0,1,0|2,0,0]=4 1429 B13R1.45 C[C@@H](NCC(=O)O)c1ccccc1 Amb17935709 [0,1,0,0,1,0|2,0,0]=4 1430 B13R1.45 C[C@@H](NCC(N)=O)c1ccccc1 Amb24271280 [0,1,0,0,1,0|2,0,0]=4 1431 B13R1.45 C[C@@H](OCC(=O)O)c1ccccc1 Amb32946281 [0,1,0,0,1,0|2,0,0]=4 1432 B13R1.45 C[C@H](NCC(=O)O)c1ccccc1 Amb17935708 [0,1,0,0,1,0|2,0,0]=4 1433 B13R1.45 C[C@H](OCC(=O)O)c1ccccc1 Amb32946283 [0,1,0,0,1,0|2,0,0]=4 1434 B13R1.45 NC(=O)CCC(=O)c1ccccc1 Amb17233256 [0,1,0,0,1,0|1,0,1]=4 1435 B13R1.45 NC(=O)CCC(O)c1ccccc1 Amb17335290 [0,1,0,0,1,0|1,0,0]=3 1436 B13R1.45 NC(=O)CCC(O)c1ccccn1 Amb17335401 [0,1,0,0,1,0|2,0,0]=4 1437 B13R1.45 NC(=O)CCC(O)c1cccnc1 Amb17335403 [0,1,0,0,1,0|2,0,0]=4 1438 B13R1.45 NC(=O)CCC(O)c1ccncc1 Amb17335405 [0,1,0,0,1,0|2,0,0]=4 1439 B13R1.45 NC(=O)NCC(O)c1ccccc1 Amb9248137 [0,1,0,0,1,0|2,0,0]=4 1440 B13R1.45 NC(=O)OCC(O)c1ccccc1 Amb17594650 [0,1,0,0,1,0|1,0,0]=3 1441 B13R1.45 NC(CCC(=O)O)c1ccccc1 Amb19514853 [0,1,0,0,1,0|1,0,0]=3 1442 B13R1.45 NC(CCC(=O)O)c1ccccc1 Amb9781823 [0,1,0,0,1,0|1,0,0]=3 1443 B13R1.45 NC(CCC(=O)O)c1ccccn1 Amb32953630 [0,1,0,0,1,0|2,0,0]=4 1444 B13R1.45 NC(CCC(=O)O)c1cccnc1 Amb2697486 [0,1,0,0,1,0|2,0,0]=4 1445 B13R1.45 NC(CCC(=O)O)c1ccncc1 Amb33079854 [0,1,0,0,1,0|2,0,0]=4 1446 B13R1.45 N[C@@H](CCC(=O)O)c1ccccc1 Amb22745911 [0,1,0,0,1,0|1,0,0]=3 1447 B13R1.45 N[C@H](CCC(=O)O)c1ccccc1 Amb33801866 [0,1,0,0,1,0|1,0,0]=3 1448 B13R1.45 O=C(Cl)OCC(=O)c1ccccc1 Amb33297274 [0,1,0,0,1,0|1,0,1]=4 1449 B13R1.45 O=C(O)CCC(=O)c1ccccc1 Amb1224638 [0,1,0,0,1,0|1,0,1]=4 1450 B13R1.45 O=C(O)CCC(O)c1ccccc1 Amb2721927 [0,1,0,0,1,0|1,0,0]=3 1451 B13R1.45 O=C(O)CCC(O)c1ccccn1 Amb18824244 [0,1,0,0,1,0|2,0,0]=4 1452 B13R1.45 O=C(O)CCC(O)c1cccnc1 Amb18805211 [0,1,0,0,1,0|2,0,0]=4 1453 B13R1.45 O=C(O)CCC(O)c1ccncc1 Amb18193342 [0,1,0,0,1,0|2,0,0]=4 1454 B13R1.149 C=C(Br)CCCc1cccc(Cl)c1 Amb13890656 [0,1,0,0,1,0|1,0,1]=4 1455 B13R1.149 CC(=O)CCCc1cccc(Br)c1 Amb17255477 [0,1,0,0,1,0|0,0,0]=2 1456 B13R1.149 CC(=O)CCCc1cccc(C)c1 Amb17233199 [0,1,0,0,1,0|0,0,0]=2 1457 B13R1.149 CC(=O)CCCc1cccc(Cl)c1 Amb17236502 [0,1,0,0,1,0|0,0,0]=2 1458 B13R1.149 CC(=O)CCNc1cccc(C)c1 Amb27259362 [0,1,0,0,1,0|1,0,0]=3 1459 B13R1.149 CC(=O)CCOc1cccc(C)c1 Amb7777348 [0,1,0,0,1,0|1,0,0]=3 1460 B13R1.149 CC(=O)CCOc1cccc(Cl)c1 Amb17139724 [0,1,0,0,1,0|1,0,0]=3 1461 B13R1.149 CC(=O)CCOc1cccc(F)c1 Amb7777353 [0,1,0,0,1,0|1,0,0]=3 1462 B13R1.149 CC(=O)CCOc1cccc(N)c1 Amb4422083 [0,1,0,0,1,0|1,0,0]=3 1463 B13R1.149 CC(=O)CCSc1cccc(Br)c1 Amb32682896 [0,1,0,0,1,0|1,0,0]=3 1464 B13R1.149 CC(=O)CCSc1cccc(C)c1 Amb19042835 [0,1,0,0,1,0|1,0,0]=3 1465 B13R1.149 CC(=O)CCSc1cccc(Cl)c1 Amb32682921 [0,1,0,0,1,0|1,0,0]=3 1466 B13R1.149 CC(=O)CCSc1cccc(F)c1 Amb32682926 [0,1,0,0,1,0|1,0,0]=3 1467 B13R1.149 CC(=O)CSCc1cccc(C)c1 Amb19063166 [0,1,0,0,1,0|1,0,0]=3 1468 B13R1.149 CC(=O)C\C=C\c1cccc(Br)c1 Amb26905228 [0,1,0,0,1,0|0,0,2]=4 1469 B13R1.149 CC(=O)NCCc1cccc(Br)c1 Amb27985315 [0,1,0,0,1,0|1,0,0]=3 1470 B13R1.149 CC(=O)NCCc1cccc(N)c1 Amb28291587 [0,1,0,0,1,0|1,0,0]=3 1471 B13R1.149 CC(=O)NCCc1cccc(O)c1 Amb26946233 [0,1,0,0,1,0|1,0,0]=3 1472 B13R1.149 CC(=O)OCCc1cccc(N)c1 Amb28556007 [0,1,0,0,1,0|0,0,0]=2 1473 B13R1.149 CC(C)=CCCc1cccc(Br)c1 Amb35623558 [0,1,0,0,1,0|1,0,1]=4 1474 B13R1.149 CC(C)=CCCc1cccc(C)c1 Amb22227609 [0,1,0,0,1,0|1,0,1]=4 1475 B13R1.149 CC(C)=CCCc1cccc(Cl)c1 Amb35588027 [0,1,0,0,1,0|1,0,1]=4 1476 B13R1.149 CC(C)=CCCc1cccc(F)c1 Amb35588019 [0,1,0,0,1,0|1,0,1]=4 1477 B13R1.149 CC(N)CCCc1cccc(Br)c1 Amb17255966 [0,1,0,0,1,0|1,0,1]=4 1478 B13R1.149 CC(N)CCCc1cccc(Cl)c1 Amb17236682 [0,1,0,0,1,0|1,0,1]=4 1479 B13R1.149 CC(O)CCCc1cccc(Br)c1 Amb33242567 [0,1,0,0,1,0|0,0,2]=4 1480 B13R1.149 CN(C)CCCc1cccc(N)c1 Amb17050706 [0,1,0,0,1,0|2,0,0]=4 1481 B13R1.149 CN(O)CCCc1cccc(Br)c1 Amb33434160 [0,1,0,0,1,0|1,0,1]=4 1482 B13R1.149 CS(=O)CCNc1cccc(Br)c1 Amb28430219 [0,1,0,0,1,0|2,0,0]=4 1483 B13R1.149 CS(=O)CCNc1cccc(Cl)c1 Amb27786008 [0,1,0,0,1,0|2,0,0]=4 1484 B13R1.149 CS(=O)CCNc1cccc(F)c1 Amb27779998 [0,1,0,0,1,0|2,0,0]=4 1485 B13R1.149 C[C@@H](N)CCCc1cccc(Br)c1 Amb33433747 [0,1,0,0,1,0|1,0,1]=4 1486 B13R1.149 C[C@@H](O)CCCc1cccc(Br)c1 Amb33433759 [0,1,0,0,1,0|0,0,2]=4 1487 B13R1.149 C[C@H](N)CCCc1cccc(Br)c1 Amb33433749 [0,1,0,0,1,0|1,0,1]=4 1488 B13R1.149 C[C@H](O)CCCc1cccc(Br)c1 Amb33433757 [0,1,0,0,1,0|0,0,2]=4 1489 B13R1.149 Cc1cc(CCCC(=O)O)ccn1 Amb32733008 [0,1,0,0,1,0|2,0,0]=4 1490 B13R1.149 Cc1cccc(CCCC(=O)O)c1 Amb3932920 [0,1,0,0,1,0|1,0,0]=3 1491 B13R1.149 Cc1cccc(CCCC(=O)O)n1 Amb32429836 [0,1,0,0,1,0|2,0,0]=4 1492 B13R1.149 Cc1cccc(CCCC(C)N)c1 Amb17233314 [0,1,0,0,1,0|1,0,1]=4 1493 B13R1.149 Cc1cccc(CCCC(N)=O)n1 Amb32429826 [0,1,0,0,1,0|2,0,0]=4 1494 B13R1.149 Cc1cccc(CCNC(=O)Cl)c1 Amb35625795 [0,1,0,0,1,0|2,0,0]=4 1495 B13R1.149 Cc1cccc(CNCC(=O)O)c1 Amb1110883 [0,1,0,0,1,0|2,0,0]=4 1496 B13R1.149 Cc1cccc(CNCC(=O)O)c1 Amb19341149 [0,1,0,0,1,0|2,0,0]=4 1497 B13R1.149 Cc1cccc(COCC(=O)O)c1 Amb17470624 [0,1,0,0,1,0|2,0,0]=4 1498 B13R1.149 Cc1cccc(CSCC(=O)O)c1 Amb6718310 [0,1,0,0,1,0|2,0,0]=4 1499 B13R1.149 Cc1cccc(NCCC(=O)O)c1 Amb2209157 [0,1,0,0,1,0|2,0,0]=4 1500 B13R1.149 Cc1cccc(NCCC(N)=O)c1 Amb8841800 [0,1,0,0,1,0|2,0,0]=4 1501 B13R1.149 Cc1cccc(NCCS(C)=O)c1 Amb27852279 [0,1,0,0,1,0|2,0,0]=4 1502 B13R1.149 Cc1cccc(OCCC(=O)Cl)c1 Amb6743374 [0,1,0,0,1,0|2,0,0]=4 1503 B13R1.149 Cc1cccc(OCCC(=O)O)c1 Amb1102786 [0,1,0,0,1,0|2,0,0]=4 1504 B13R1.149 Cc1cccc(OCCC(N)=O)c1 Amb8997688 [0,1,0,0,1,0|2,0,0]=4 1505 B13R1.149 Cc1cccc(SCCC(=O)Cl)c1 Amb17143636 [0,1,0,0,1,0|2,0,0]=4 1506 B13R1.149 Cc1cccc(SCCC(N)=O)c1 Amb17143163 [0,1,0,0,1,0|2,0,0]=4 1507 B13R1.149 Cc1ccnc(CCCC(=O)O)c1 Amb32429824 [0,1,0,0,1,0|2,0,0]=4 1508 B13R1.149 Cc1cncc(CCCC(=O)O)c1 Amb33317649 [0,1,0,0,1,0|2,0,0]=4 1509 B13R1.149 N=C(N)CCCc1cccc(Br)c1 Amb33433798 [0,1,0,0,1,0|2,0,0]=4 1510 B13R1.149 NC(=O)CCNc1cccc(Br)c1 Amb8841799 [0,1,0,0,1,0|2,0,0]=4 1511 B13R1.149 NC(=O)CCNc1cccc(Cl)c1 Amb8841803 [0,1,0,0,1,0|2,0,0]=4 1512 B13R1.149 NC(=O)CCNc1cccc(F)c1 Amb8841804 [0,1,0,0,1,0|2,0,0]=4 1513 B13R1.149 NC(=O)CCNc1cccc(I)c1 Amb9209196 [0,1,0,0,1,0|2,0,0]=4 1514 B13R1.149 NC(=O)CCNc1cccc(N)c1 Amb9415700 [0,1,0,0,1,0|2,0,0]=4 1515 B13R1.149 NC(=O)CCOc1cccc(F)c1 Amb8858809 [0,1,0,0,1,0|2,0,0]=4 1516 B13R1.149 NC(=O)CCOc1cccc(N)c1 Amb8842884 [0,1,0,0,1,0|2,0,0]=4 1517 B13R1.149 NC(=S)CCCc1cccc(Br)c1 Amb33433801 [0,1,0,0,1,0|1,1,0]=4 1518 B13R1.149 Nc1cccc(CCCC(=O)O)c1 Amb10603728 [0,1,0,0,1,0|1,0,0]=3 1519 B13R1.149 Nc1cccc(CCCC(=O)O)c1 Amb17335328 [0,1,0,0,1,0|1,0,0]=3 1520 B13R1.149 Nc1cccc(SCCC(=O)O)c1 Amb19662090 [0,1,0,0,1,0|2,0,0]=4 1521 B13R1.149 O=C(Cl)NCCc1cccc(Br)c1 Amb35625619 [0,1,0,0,1,0|2,0,0]=4 1522 B13R1.149 O=C(Cl)NCCc1cccc(F)c1 Amb35625483 [0,1,0,0,1,0|2,0,0]=4 1523 B13R1.149 O=C(Cl)OCCc1cccc(Br)c1 Amb33297105 [0,1,0,0,1,0|1,0,0]=3 1524 B13R1.149 O=C(O)CCCc1cc(Cl)ccn1 Amb33406498 [0,1,0,0,1,0|2,0,0]=4 1525 B13R1.149 O=C(O)CCCc1cc(F)ccn1 Amb33450179 [0,1,0,0,1,0|2,0,0]=4 1526 B13R1.149 O=C(O)CCCc1cccc(Br)c1 Amb3932918 [0,1,0,0,1,0|1,0,0]=3 1527 B13R1.149 O=C(O)CCCc1cccc(Br)n1 Amb33262823 [0,1,0,0,1,0|2,0,0]=4 1528 B13R1.149 O=C(O)CCCc1cccc(Cl)c1 Amb3932874 [0,1,0,0,1,0|1,0,0]=3 1529 B13R1.149 O=C(O)CCCc1cccc(Cl)n1 Amb33403801 [0,1,0,0,1,0|2,0,0]=4 1530 B13R1.149 O=C(O)CCCc1cccc(F)c1 Amb3932921 [0,1,0,0,1,0|1,0,0]=3 1531 B13R1.149 O=C(O)CCCc1cccc(O)c1 Amb22490497 [0,1,0,0,1,0|1,0,0]=3 1532 B13R1.149 O=C(O)CCCc1ccnc(Cl)c1 Amb33261615 [0,1,0,0,1,0|2,0,0]=4 1533 B13R1.149 O=C(O)CCCc1cncc(Br)c1 Amb33241658 [0,1,0,0,1,0|2,0,0]=4 1534 B13R1.149 O=C(O)CCCc1cncc(F)c1 Amb33172373 [0,1,0,0,1,0|2,0,0]=4 1535 B13R1.149 O=C(O)CCNc1cccc(Br)c1 Amb7766525 [0,1,0,0,1,0|2,0,0]=4 1536 B13R1.149 O=C(O)CCNc1cccc(Cl)c1 Amb2209166 [0,1,0,0,1,0|2,0,0]=4 1537 B13R1.149 O=C(O)CCNc1cccc(F)c1 Amb2209162 [0,1,0,0,1,0|2,0,0]=4 1538 B13R1.149 O=C(O)CCNc1cccc(I)c1 Amb7785453 [0,1,0,0,1,0|2,0,0]=4 1539 B13R1.149 O=C(O)CCNc1cccc(O)c1 Amb4422097 [0,1,0,0,1,0|2,0,0]=4 1540 B13R1.149 O=C(O)CCOc1cccc(Br)c1 Amb15755 [0,1,0,0,1,0|2,0,0]=4 1541 B13R1.149 O=C(O)CCOc1cccc(Cl)c1 Amb1116710 [0,1,0,0,1,0|2,0,0]=4 1542 B13R1.149 O=C(O)CCOc1cccc(I)c1 Amb8838599 [0,1,0,0,1,0|2,0,0]=4 1543 B13R1.149 O=C(O)CCOc1cccc(O)c1 Amb18192782 [0,1,0,0,1,0|2,0,0]=4 1544 B13R1.149 O=C(O)CCSc1cccc(Cl)c1 Amb5775182 [0,1,0,0,1,0|2,0,0]=4 1545 B13R1.149 O=C(O)CNCc1cccc(Br)c1 Amb1111229 [0,1,0,0,1,0|2,0,0]=4 1546 B13R1.149 O=C(O)CNCc1cccc(Cl)c1 Amb17598410 [0,1,0,0,1,0|2,0,0]=4 1547 B13R1.149 O=C(O)CNCc1cccc(Cl)c1 Amb8827651 [0,1,0,0,1,0|2,0,0]=4 1548 B13R1.149 O=C(O)CNCc1cccc(F)c1 Amb10609867 [0,1,0,0,1,0|2,0,0]=4 1549 B13R1.149 O=C(O)CNCc1cccc(F)c1 Amb2372412 [0,1,0,0,1,0|2,0,0]=4 1550 B13R1.149 O=C(O)COCc1cccc(Br)c1 Amb17472946 [0,1,0,0,1,0|2,0,0]=4 1551 B13R1.149 O=C(O)COCc1cccc(Cl)c1 Amb17470999 [0,1,0,0,1,0|2,0,0]=4 1552 B13R1.149 O=C(O)COCc1cccc(F)c1 Amb32409782 [0,1,0,0,1,0|2,0,0]=4 1553 B13R1.149 O=C(O)COCc1cccc(I)c1 Amb32661302 [0,1,0,0,1,0|2,0,0]=4 1554 B13R1.149 O=C(O)CSCc1cccc(Br)c1 Amb6372198 [0,1,0,0,1,0|2,0,0]=4 1555 B13R1.149 O=C(O)CSCc1cccc(Cl)c1 Amb1546534 [0,1,0,0,1,0|2,0,0]=4 1556 B13R1.149 O=C(O)CSCc1cccc(F)c1 Amb1137816 [0,1,0,0,1,0|2,0,0]=4 1557 B13R1.149 O=[N+]([O-])CCCc1cccc(Br)c1 Amb33433438 [0,1,0,0,1,0|2,0,0]=4 1558 B13R1.158 C=C(Br)CCCc1ccccc1C Amb13890664 [0,1,0,0,1,0|1,0,1]=4 1559 B13R1.158 C=C(C)CCNc1ccccc1C Amb27174738 [0,1,0,0,1,0|2,0,0]=4 1560 B13R1.158 C=C(C)CCNc1ccccc1N Amb27790840 [0,1,0,0,1,0|2,0,0]=4 1561 B13R1.158 C=C(C)CNCc1ccccc1Cl Amb17317898 [0,1,0,0,1,0|2,0,0]=4 1562 B13R1.158 C=C(C)CNCc1ccccc1F Amb17309099 [0,1,0,0,1,0|2,0,0]=4 1563 B13R1.158 C=C(C)CNCc1ccccc1O Amb33098597 [0,1,0,0,1,0|2,0,0]=4 1564 B13R1.158 CC(=O)CCCc1ccccc1C Amb17233198 [0,1,0,0,1,0|0,0,0]=2 1565 B13R1.158 CC(=O)CCCc1ccccc1Cl Amb17236501 [0,1,0,0,1,0|0,0,0]=2 1566 B13R1.158 CC(=O)CCCc1ccccc1F Amb17233676 [0,1,0,0,1,0|0,0,0]=2 1567 B13R1.158 CC(=O)CCNc1ccccc1O Amb28388299 [0,1,0,0,1,0|1,0,0]=3 1568 B13R1.158 CC(=O)CCOc1ccccc1C Amb7777349 [0,1,0,0,1,0|1,0,0]=3 1569 B13R1.158 CC(=O)CCOc1ccccc1Cl Amb17139723 [0,1,0,0,1,0|1,0,0]=3 1570 B13R1.158 CC(=O)CCOc1ccccc1F Amb7777344 [0,1,0,0,1,0|1,0,0]=3 1571 B13R1.158 CC(=O)CCSc1ccccc1Br Amb9229575 [0,1,0,0,1,0|1,0,0]=3 1572 B13R1.158 CC(=O)CCSc1ccccc1C Amb19051952 [0,1,0,0,1,0|1,0,0]=3 1573 B13R1.158 CC(=O)CCSc1ccccc1Cl Amb9224162 [0,1,0,0,1,0|1,0,0]=3 1574 B13R1.158 CC(=O)CCSc1ccccc1F Amb9224177 [0,1,0,0,1,0|1,0,0]=3 1575 B13R1.158 CC(=O)CSCc1ccccc1C Amb18330489 [0,1,0,0,1,0|1,0,0]=3 1576 B13R1.158 CC(=O)CSCc1ccccc1Cl Amb32683019 [0,1,0,0,1,0|1,0,0]=3 1577 B13R1.158 CC(=O)C\C=C\c1ccccc1F Amb25693688 [0,1,0,0,1,0|0,0,2]=4 1578 B13R1.158 CC(=O)C\C=C\c1ccccc1O Amb25058690 [0,1,0,0,1,0|0,0,2]=4 1579 B13R1.158 CC(=O)NCCc1ccccc1Br Amb13133608 [0,1,0,0,1,0|1,0,0]=3 1580 B13R1.158 CC(=O)NCCc1ccccc1Cl Amb25324158 [0,1,0,0,1,0|1,0,0]=3 1581 B13R1.158 CC(=O)NCCc1ccccc1N Amb27180309 [0,1,0,0,1,0|1,0,0]=3 1582 B13R1.158 CC(=O)NCCc1ccccc1O Amb16982301 [0,1,0,0,1,0|1,0,0]=3 1583 B13R1.158 CC(=O)NCCc1cccnc1Br Amb28319510 [0,1,0,0,1,0|2,0,0]=4 1584 B13R1.158 CC(=O)NCCc1ncccc1C Amb35579988 [0,1,0,0,1,0|2,0,0]=4 1585 B13R1.158 CC(=O)NOCc1ccccc1Br Amb28283840 [0,1,0,0,1,0|2,0,0]=4 1586 B13R1.158 CC(=O)\C=C\Cc1ccccc1N Amb27832813 [0,1,0,0,1,0|0,0,2]=4 1587 B13R1.158 CC(C)=CCCc1ccccc1C Amb35582933 [0,1,0,0,1,0|1,0,1]=4 1588 B13R1.158 CC(C)=CCCc1ccccc1Cl Amb35588028 [0,1,0,0,1,0|1,0,1]=4 1589 B13R1.158 CC(C)=CCCc1ccccc1F Amb35588017 [0,1,0,0,1,0|1,0,1]=4 1590 B13R1.158 CC(N)CCCc1ccccc1Cl Amb17236681 [0,1,0,0,1,0|1,0,1]=4 1591 B13R1.158 CC(N)CCCc1ccccc1F Amb17233820 [0,1,0,0,1,0|1,0,1]=4 1592 B13R1.158 CN(C)CCCc1ccccc1N Amb17050681 [0,1,0,0,1,0|2,0,0]=4 1593 B13R1.158 CS(=O)CCNc1ccccc1I Amb27855612 [0,1,0,0,1,0|2,0,0]=4 1594 B13R1.158 Cc1ccccc1CCCC(=O)O Amb3932873 [0,1,0,0,1,0|1,0,0]=3 1595 B13R1.158 Cc1ccccc1CCCC(C)N Amb17233313 [0,1,0,0,1,0|1,0,1]=4 1596 B13R1.158 Cc1ccccc1CNCC(=O)O Amb10609879 [0,1,0,0,1,0|2,0,0]=4 1597 B13R1.158 Cc1ccccc1CNCC(=O)O Amb2372498 [0,1,0,0,1,0|2,0,0]=4 1598 B13R1.158 Cc1ccccc1COCC(=O)O Amb17470623 [0,1,0,0,1,0|2,0,0]=4 1599 B13R1.158 Cc1ccccc1CSCC(=O)O Amb1125979 [0,1,0,0,1,0|2,0,0]=4 1600 B13R1.158 Cc1ccccc1NCCC(=O)O Amb382805 [0,1,0,0,1,0|2,0,0]=4 1601 B13R1.158 Cc1ccccc1NCCC(N)=O Amb8841174 [0,1,0,0,1,0|2,0,0]=4 1602 B13R1.158 Cc1ccccc1NCCS(C)=O Amb27620836 [0,1,0,0,1,0|2,0,0]=4 1603 B13R1.158 Cc1ccccc1OCCC(=O)O Amb1102807 [0,1,0,0,1,0|2,0,0]=4 1604 B13R1.158 Cc1cccnc1CCCC(=O)O Amb33359672 [0,1,0,0,1,0|2,0,0]=4 1605 B13R1.158 Cc1ccncc1CCCC(=O)O Amb32954447 [0,1,0,0,1,0|2,0,0]=4 1606 B13R1.158 Cc1cnccc1CCCC(=O)O Amb33372287 [0,1,0,0,1,0|2,0,0]=4 1607 B13R1.158 Cc1ncccc1CCCC(=O)O Amb32878341 [0,1,0,0,1,0|2,0,0]=4 1608 B13R1.158 NC(=O)CCCc1ccccc1Cl Amb22552422 [0,1,0,0,1,0|1,0,0]=3 1609 B13R1.158 NC(=O)CCNc1ccccc1Br Amb8842938 [0,1,0,0,1,0|2,0,0]=4 1610 B13R1.158 NC(=O)CCNc1ccccc1Cl Amb453182 [0,1,0,0,1,0|2,0,0]=4 1611 B13R1.158 NC(=O)CCNc1ccccc1F Amb8841827 [0,1,0,0,1,0|2,0,0]=4 1612 B13R1.158 NC(=O)CCNc1ccccc1N Amb19514743 [0,1,0,0,1,0|2,0,0]=4 1613 B13R1.158 NC(=O)CCNc1ccccc1N Amb2226251 [0,1,0,0,1,0|2,0,0]=4 1614 B13R1.158 NC(=O)CCNc1ccccc1O Amb27230062 [0,1,0,0,1,0|2,0,0]=4 1615 B13R1.158 NC(=O)CCOc1ccccc1Cl Amb8998805 [0,1,0,0,1,0|2,0,0]=4 1616 B13R1.158 NC(=O)CCOc1ccccc1F Amb8997723 [0,1,0,0,1,0|2,0,0]=4 1617 B13R1.158 NC(=O)CCOc1ccccc1N Amb8842883 [0,1,0,0,1,0|2,0,0]=4 1618 B13R1.158 NC(=O)CCSc1ccccc1Cl Amb8997756 [0,1,0,0,1,0|2,0,0]=4 1619 B13R1.158 NC(=O)CCSc1ccccc1F Amb8998280 [0,1,0,0,1,0|2,0,0]=4 1620 B13R1.158 NC(=O)CCSc1ccccc1N Amb8842981 [0,1,0,0,1,0|2,0,0]=4 1621 B13R1.158 NC(=O)NCCc1ccccc1Cl Amb24627934 [0,1,0,0,1,0|2,0,0]=4 1622 B13R1.158 NC(=O)NCCc1ccccc1O Amb28048054 [0,1,0,0,1,0|2,0,0]=4 1623 B13R1.158 Nc1ccccc1CCCC(=O)O Amb2697307 [0,1,0,0,1,0|1,0,0]=3 1624 B13R1.158 Nc1ccccc1CCCC(=O)O Amb32789702 [0,1,0,0,1,0|1,0,0]=3 1625 B13R1.158 Nc1ccccc1OCCC(=O)O Amb22728037 [0,1,0,0,1,0|2,0,0]=4 1626 B13R1.158 O=C(Cl)CCOc1ccccc1Cl Amb17143748 [0,1,0,0,1,0|2,0,0]=4 1627 B13R1.158 O=C(Cl)CCSc1ccccc1Cl Amb17144559 [0,1,0,0,1,0|2,0,0]=4 1628 B13R1.158 O=C(Cl)NCCc1ccccc1F Amb35625505 [0,1,0,0,1,0|2,0,0]=4 1629 B13R1.158 O=C(Cl)OCCc1ccccc1Br Amb33297174 [0,1,0,0,1,0|1,0,0]=3 1630 B13R1.158 O=C(O)CCCN1C=CC=CC1=O Amb18028573 [0,1,0,0,1,0|2,0,0]=4 1631 B13R1.158 O=C(O)CCCc1ccccc1Br Amb33545182 [0,1,0,0,1,0|1,0,0]=3 1632 B13R1.158 O=C(O)CCCc1ccccc1Cl Amb3932916 [0,1,0,0,1,0|1,0,0]=3 1633 B13R1.158 O=C(O)CCCc1ccccc1F Amb3932910 [0,1,0,0,1,0|1,0,0]=3 1634 B13R1.158 O=C(O)CCCc1ccccc1O Amb4009785 [0,1,0,0,1,0|1,0,0]=3 1635 B13R1.158 O=C(O)CCCc1cccnc1Br Amb33388113 [0,1,0,0,1,0|2,0,0]=4 1636 B13R1.158 O=C(O)CCCc1cccnc1Cl Amb33257386 [0,1,0,0,1,0|2,0,0]=4 1637 B13R1.158 O=C(O)CCCc1cccnc1F Amb33377146 [0,1,0,0,1,0|2,0,0]=4 1638 B13R1.158 O=C(O)CCCc1ccncc1Br Amb33478366 [0,1,0,0,1,0|2,0,0]=4 1639 B13R1.158 O=C(O)CCCc1ccncc1Cl Amb33406975 [0,1,0,0,1,0|2,0,0]=4 1640 B13R1.158 O=C(O)CCCc1ccncc1F Amb33316822 [0,1,0,0,1,0|2,0,0]=4 1641 B13R1.158 O=C(O)CCCc1ncccc1Br Amb33243031 [0,1,0,0,1,0|2,0,0]=4 1642 B13R1.158 O=C(O)CCCc1ncccc1F Amb33418426 [0,1,0,0,1,0|2,0,0]=4 1643 B13R1.158 O=C(O)CCNc1ccccc1Br Amb7766524 [0,1,0,0,1,0|2,0,0]=4 1644 B13R1.158 O=C(O)CCNc1ccccc1Cl Amb2209165 [0,1,0,0,1,0|2,0,0]=4 1645 B13R1.158 O=C(O)CCNc1ccccc1F Amb2209161 [0,1,0,0,1,0|2,0,0]=4 1646 B13R1.158 O=C(O)CCOc1ccccc1Br Amb1117859 [0,1,0,0,1,0|2,0,0]=4 1647 B13R1.158 O=C(O)CCOc1ccccc1Cl Amb1112357 [0,1,0,0,1,0|2,0,0]=4 1648 B13R1.158 O=C(O)CCOc1ccccc1F Amb1102819 [0,1,0,0,1,0|2,0,0]=4 1649 B13R1.158 O=C(O)CCOc1ccccc1I Amb9339536 [0,1,0,0,1,0|2,0,0]=4 1650 B13R1.158 O=C(O)CCSc1ccccc1Br Amb1113939 [0,1,0,0,1,0|2,0,0]=4 1651 B13R1.158 O=C(O)CCSc1ccccc1Cl Amb1102789 [0,1,0,0,1,0|2,0,0]=4 1652 B13R1.158 O=C(O)CCSc1ccccc1F Amb56946 [0,1,0,0,1,0|2,0,0]=4 1653 B13R1.158 O=C(O)CNCc1ccccc1Br Amb1111282 [0,1,0,0,1,0|2,0,0]=4 1654 B13R1.158 O=C(O)CNCc1ccccc1Cl Amb7766478 [0,1,0,0,1,0|2,0,0]=4 1655 B13R1.158 O=C(O)CNCc1ccccc1F Amb7761999 [0,1,0,0,1,0|2,0,0]=4 1656 B13R1.158 O=C(O)CNCc1ccccc1I Amb21861671 [0,1,0,0,1,0|2,0,0]=4 1657 B13R1.158 O=C(O)COCc1ccccc1Br Amb32669719 [0,1,0,0,1,0|2,0,0]=4 1658 B13R1.158 O=C(O)COCc1ccccc1Cl Amb6266832 [0,1,0,0,1,0|2,0,0]=4 1659 B13R1.158 O=C(O)COCc1ccccc1F Amb17470662 [0,1,0,0,1,0|2,0,0]=4 1660 B13R1.158 O=C(O)COCc1ccccc1I Amb32669720 [0,1,0,0,1,0|2,0,0]=4 1661 B13R1.158 O=C(O)CSCc1ccccc1Br Amb2372136 [0,1,0,0,1,0|2,0,0]=4 1662 B13R1.158 O=C(O)CSCc1ccccc1Cl Amb1551137 [0,1,0,0,1,0|2,0,0]=4 1663 B13R1.158 O=C(O)CSCc1ccccc1F Amb844941 [0,1,0,0,1,0|2,0,0]=4 1664 B13R1.158 O=C(O)CSCc1ccccc1I Amb24089653 [0,1,0,0,1,0|2,0,0]=4 1665 B13R1.158 O=C([O-])CCSc1ccccc1F Amb34916627 [0,1,0,0,1,0|2,0,0]=4 1666 B13R1.348 CC(=N)NC(C)Cc1ccccc1 Amb27460929 [0,1,0,0,1,0|2,0,0]=4 1667 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 Amb15692856 [0,1,0,0,1,0|0,0,1]=3 1668 B13R1.348 CC(=O)CC(=O)Nc1ccccc1 Amb1210069 [0,1,0,0,1,0|1,0,1]=4 1669 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,1,0,0,1,0|1,0,1]=4 1670 B13R1.348 CC(=O)CC(=S)Nc1ccccc1 Amb25190045 [0,1,0,0,1,0|1,0,1]=4 1671 B13R1.348 CC(=O)CC(C)Sc1ccccc1 Amb32683051 [0,1,0,0,1,0|1,0,0]=3 1672 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,1,0,0,1,0|1,0,0]=3 1673 B13R1.348 CC(=O)C\C(C)=C\c1ccccc1 Amb17778970 [0,1,0,0,1,0|0,0,2]=4 1674 B13R1.348 CC(=O)C\C(C)=N/c1ccccc1 Amb2610547 [0,1,0,0,1,0|1,0,1]=4 1675 B13R1.348 CC(=O)NC(C)Cc1ccccc1 Amb8503527 [0,1,0,0,1,0|1,0,0]=3 1676 B13R1.348 CC(=O)NC(C)Cc1ccccn1 Amb35596262 [0,1,0,0,1,0|2,0,0]=4 1677 B13R1.348 CC(=O)NC(O)Cc1ccccc1 Amb28132759 [0,1,0,0,1,0|1,0,0]=3 1678 B13R1.348 CC(=O)\C=C(/C)Cc1ccccc1 Amb17778969 [0,1,0,0,1,0|0,0,2]=4 1679 B13R1.348 CC(C)=CC(O)Cc1ccccc1 Amb27262321 [0,1,0,0,1,0|1,0,1]=4 1680 B13R1.348 CC(C)CC(Br)Cc1ccccc1 Amb18049557 [0,1,0,0,1,0|1,0,1]=4 1681 B13R1.348 CC(C)CC(N)Cc1ccccc1 Amb2237290 [0,1,0,0,1,0|1,0,1]=4 1682 B13R1.348 CC(C)CC(N)Cc1ccccc1 Amb2592669 [0,1,0,0,1,0|1,0,1]=4 1683 B13R1.348 CC(CC(=O)O)Cc1ccccc1 Amb17233403 [0,1,0,0,1,0|1,0,0]=3 1684 B13R1.348 CC(CC(=O)O)Cc1ccccn1 Amb17335285 [0,1,0,0,1,0|2,0,0]=4 1685 B13R1.348 CC(CC(=O)O)Cc1cccnc1 Amb17335287 [0,1,0,0,1,0|2,0,0]=4 1686 B13R1.348 CC(CC(=O)O)Cc1ccncc1 Amb17335288 [0,1,0,0,1,0|2,0,0]=4 1687 B13R1.348 CC(CC(=O)O)Nc1ccccc1 Amb9398389 [0,1,0,0,1,0|2,0,0]=4 1688 B13R1.348 CC(CC(=O)O)Oc1ccccc1 Amb9397751 [0,1,0,0,1,0|2,0,0]=4 1689 B13R1.348 CC(CC(N)=O)Nc1ccccc1 Amb17233441 [0,1,0,0,1,0|2,0,0]=4 1690 B13R1.348 CC(CC(N)=O)Oc1ccccc1 Amb17233539 [0,1,0,0,1,0|2,0,0]=4 1691 B13R1.348 CC(Cc1ccccc1)NC(=O)Cl Amb35625792 [0,1,0,0,1,0|2,0,0]=4 1692 B13R1.348 CC(Cc1ccccc1)OC(=O)Cl Amb33297088 [0,1,0,0,1,0|1,0,0]=3 1693 B13R1.348 CC(Cc1ccccn1)OC(=O)Cl Amb33297149 [0,1,0,0,1,0|2,0,0]=4 1694 B13R1.348 CN(C)CC(N)Cc1ccccc1 Amb34913780 [0,1,0,0,1,0|2,0,0]=4 1695 B13R1.348 CN(C)CC(N)Cc1ccccc1 Amb5493964 [0,1,0,0,1,0|2,0,0]=4 1696 B13R1.348 CN(C)C[C@@H](N)Cc1ccccc1 Amb34198855 [0,1,0,0,1,0|2,0,0]=4 1697 B13R1.348 CN(C)C[C@H](N)Cc1ccccc1 Amb34198854 [0,1,0,0,1,0|2,0,0]=4 1698 B13R1.348 CN(CC(=O)O)Cc1ccccc1 Amb33551957 [0,1,0,0,1,0|2,0,0]=4 1699 B13R1.348 CN(CC(=O)O)Cc1ccccc1 Amb5768759 [0,1,0,0,1,0|2,0,0]=4 1700 B13R1.348 C[C@@H](CC(=O)O)Nc1ccccc1 Amb26519867 [0,1,0,0,1,0|2,0,0]=4 1701 B13R1.348 C[C@H](CC(=O)O)Nc1ccccc1 Amb8397199 [0,1,0,0,1,0|2,0,0]=4 1702 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [0,1,0,0,1,0|2,0,0]=4 1703 B13R1.348 NC(=O)CC(N)Cc1ccccc1 Amb32787647 [0,1,0,0,1,0|1,0,0]=3 1704 B13R1.348 NC(=O)CN(N)Cc1ccccc1 Amb27268266 [0,1,0,0,1,0|2,0,0]=4 1705 B13R1.348 NC(CC(=O)O)Cc1ccccc1 Amb20623358 [0,1,0,0,1,0|1,0,0]=3 1706 B13R1.348 NC(CC(=O)O)Cc1ccccc1 Amb8631754 [0,1,0,0,1,0|1,0,0]=3 1707 B13R1.348 NC(CC(=O)O)Cc1ccccn1 Amb17470627 [0,1,0,0,1,0|2,0,0]=4 1708 B13R1.348 NC(CC(=O)O)Cc1cccnc1 Amb17470630 [0,1,0,0,1,0|2,0,0]=4 1709 B13R1.348 NC(CC(=O)O)Cc1ccncc1 Amb17470634 [0,1,0,0,1,0|2,0,0]=4 1710 B13R1.348 N[C@@H](CC(=O)O)Cc1ccccc1 Amb16184010 [0,1,0,0,1,0|1,0,0]=3 1711 B13R1.348 N[C@@H](CC(=O)O)Cc1ccccc1 Amb2697591 [0,1,0,0,1,0|1,0,0]=3 1712 B13R1.348 N[C@@H](CC(=O)O)Cc1cccnc1 Amb33933974 [0,1,0,0,1,0|2,0,0]=4 1713 B13R1.348 N[C@@H](CC(=O)O)Cc1ccncc1 Amb33726055 [0,1,0,0,1,0|2,0,0]=4 1714 B13R1.348 N[C@H](CC(=O)O)Cc1ccccc1 Amb2699235 [0,1,0,0,1,0|1,0,0]=3 1715 B13R1.348 N[C@H](CC(=O)O)Cc1ccccc1 Amb8629294 [0,1,0,0,1,0|1,0,0]=3 1716 B13R1.348 N[C@H](CC(=O)O)Cc1cccnc1 Amb22746342 [0,1,0,0,1,0|2,0,0]=4 1717 B13R1.348 N[C@H](CC(=O)O)Cc1ccncc1 Amb22746344 [0,1,0,0,1,0|2,0,0]=4 1718 B13R1.348 O=C(O)CC(Br)Cc1ccccc1 Amb18111137 [0,1,0,0,1,0|1,0,0]=3 1719 B13R1.348 O=C(O)CC(Cl)Cc1ccccc1 Amb18111136 [0,1,0,0,1,0|1,0,0]=3 1720 B13R1.348 O=C(O)CC(O)Cc1ccccc1 Amb17233662 [0,1,0,0,1,0|1,0,0]=3 1721 B13R1.348 O=C(O)C[C@@H](O)Cc1ccccc1 Amb32951764 [0,1,0,0,1,0|1,0,0]=3 1722 B13R1.348 O=C(O)C[C@H](O)Cc1ccccc1 Amb33082324 [0,1,0,0,1,0|1,0,0]=3 1723 B13R1.348 [2H]C(C=C(C)C)Cc1ccccc1 Amb22546630 [0,1,0,0,1,0|1,0,1]=4 1724 B13R1.351 C=C(C)C(O)CNc1ccccc1 Amb29875610 [0,1,0,0,1,0|2,0,0]=4 1725 B13R1.351 C=C(CCc1ccccc1)C(=O)O Amb18127719 [0,1,0,0,1,0|1,0,1]=4 1726 B13R1.351 CC(=O)C(=O)NCc1ccccc1 Amb17400597 [0,1,0,0,1,0|1,0,1]=4 1727 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,1,0,0,1,0|1,0,1]=4 1728 B13R1.351 CC(=O)C(C)OCc1ccccc1 Amb16231123 [0,1,0,0,1,0|1,0,0]=3 1729 B13R1.351 CC(=O)C(C)SCc1ccccc1 Amb9216163 [0,1,0,0,1,0|1,0,0]=3 1730 B13R1.351 CC(=O)C(O)\C=C\c1ccccc1 Amb27861376 [0,1,0,0,1,0|0,0,2]=4 1731 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 Amb24492590 [0,1,0,0,1,0|1,0,0]=3 1732 B13R1.351 CC(=O)\C(C)=N\Cc1ccccc1 Amb25130600 [0,1,0,0,1,0|1,0,1]=4 1733 B13R1.351 CC(C)C(N)CCc1ccccc1 Amb8869744 [0,1,0,0,1,0|1,0,1]=4 1734 B13R1.351 CC(C)C(O)CCc1ccccc1 Amb18034016 [0,1,0,0,1,0|1,0,1]=4 1735 B13R1.351 CC(CCc1ccccc1)C(=O)O Amb4011190 [0,1,0,0,1,0|1,0,0]=3 1736 B13R1.351 CC(CCc1ccccn1)C(=O)O Amb17335286 [0,1,0,0,1,0|2,0,0]=4 1737 B13R1.351 CC(CCc1cccnc1)C(=O)O Amb17233532 [0,1,0,0,1,0|2,0,0]=4 1738 B13R1.351 CC(CCc1ccncc1)C(=O)O Amb17335289 [0,1,0,0,1,0|2,0,0]=4 1739 B13R1.351 CC(CNc1ccccc1)C(=O)O Amb9400301 [0,1,0,0,1,0|2,0,0]=4 1740 B13R1.351 CC(CNc1ccccc1)C(N)=O Amb8944556 [0,1,0,0,1,0|2,0,0]=4 1741 B13R1.351 CC(COc1ccccc1)C(=O)O Amb9394526 [0,1,0,0,1,0|2,0,0]=4 1742 B13R1.351 CC(COc1ccccc1)C(N)=O Amb17233540 [0,1,0,0,1,0|2,0,0]=4 1743 B13R1.351 CC(CSc1ccccc1)C(=O)O Amb9400034 [0,1,0,0,1,0|2,0,0]=4 1744 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb10199880 [0,1,0,0,1,0|2,0,0]=4 1745 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb9704488 [0,1,0,0,1,0|2,0,0]=4 1746 B13R1.351 CC(O)C(C)CCc1ccccc1 Amb32944830 [0,1,0,0,1,0|0,0,2]=4 1747 B13R1.351 CC(OCc1ccccc1)C(=O)O Amb6280663 [0,1,0,0,1,0|2,0,0]=4 1748 B13R1.351 CC(OCc1ccccc1)C(N)=O Amb9004024 [0,1,0,0,1,0|2,0,0]=4 1749 B13R1.351 CC(SCc1ccccc1)C(=O)O Amb9710523 [0,1,0,0,1,0|2,0,0]=4 1750 B13R1.351 CN(CCc1ccccc1)C(=O)Cl Amb33620302 [0,1,0,0,1,0|2,0,0]=4 1751 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)O Amb16185448 [0,1,0,0,1,0|2,0,0]=4 1752 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)O Amb6357814 [0,1,0,0,1,0|2,0,0]=4 1753 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O Amb26326642 [0,1,0,0,1,0|2,0,0]=4 1754 B13R1.351 C[C@H](OCc1ccccc1)C(=O)O Amb25072743 [0,1,0,0,1,0|2,0,0]=4 1755 B13R1.351 C[C@H](OCc1ccccc1)C(N)=O Amb27411933 [0,1,0,0,1,0|2,0,0]=4 1756 B13R1.351 NC(=O)C(N)CCc1ccccc1 Amb19035976 [0,1,0,0,1,0|1,0,0]=3 1757 B13R1.351 NC(=O)C(N)CCc1ccccn1 Amb33036746 [0,1,0,0,1,0|2,0,0]=4 1758 B13R1.351 NC(=O)C(N)CCc1cccnc1 Amb32796900 [0,1,0,0,1,0|2,0,0]=4 1759 B13R1.351 NC(=O)C(N)CCc1ccncc1 Amb33309222 [0,1,0,0,1,0|2,0,0]=4 1760 B13R1.351 NC(=O)C(N)CNc1ccccc1 Amb28324229 [0,1,0,0,1,0|2,0,0]=4 1761 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb33309501 [0,1,0,0,1,0|1,0,0]=3 1762 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb4134816 [0,1,0,0,1,0|1,0,0]=3 1763 B13R1.351 NC(CCc1ccccn1)C(=O)O Amb1101108 [0,1,0,0,1,0|2,0,0]=4 1764 B13R1.351 NC(CCc1ccccn1)C(=O)O Amb24117831 [0,1,0,0,1,0|2,0,0]=4 1765 B13R1.351 NC(CCc1cccnc1)C(=O)O Amb8385705 [0,1,0,0,1,0|2,0,0]=4 1766 B13R1.351 NC(CCc1ccncc1)C(=O)O Amb17470633 [0,1,0,0,1,0|2,0,0]=4 1767 B13R1.351 NC(CCc1ccncc1)C(=O)O Amb32795038 [0,1,0,0,1,0|2,0,0]=4 1768 B13R1.351 NC(CSc1ccccc1)C(=O)O Amb18325246 [0,1,0,0,1,0|2,0,0]=4 1769 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb6295860 [0,1,0,0,1,0|1,0,0]=3 1770 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb8393714 [0,1,0,0,1,0|1,0,0]=3 1771 B13R1.351 N[C@@H](CCc1ccccn1)C(=O)O Amb33065409 [0,1,0,0,1,0|2,0,0]=4 1772 B13R1.351 N[C@@H](CCc1cccnc1)C(=O)O Amb33066201 [0,1,0,0,1,0|2,0,0]=4 1773 B13R1.351 N[C@@H](CCc1ccncc1)C(=O)O Amb33036545 [0,1,0,0,1,0|2,0,0]=4 1774 B13R1.351 N[C@@H](CNc1ccccc1)C(=O)O Amb26880836 [0,1,0,0,1,0|2,0,0]=4 1775 B13R1.351 N[C@@H](CSc1ccccc1)C(=O)O Amb6357272 [0,1,0,0,1,0|2,0,0]=4 1776 B13R1.351 N[C@H](CCc1ccccc1)C(=O)O Amb6357139 [0,1,0,0,1,0|1,0,0]=3 1777 B13R1.351 N[C@H](CCc1ccccn1)C(=O)O Amb33036457 [0,1,0,0,1,0|2,0,0]=4 1778 B13R1.351 N[C@H](CCc1cccnc1)C(=O)O Amb33308822 [0,1,0,0,1,0|2,0,0]=4 1779 B13R1.351 N[C@H](CCc1ccncc1)C(=O)O Amb32941145 [0,1,0,0,1,0|2,0,0]=4 1780 B13R1.351 O=C(O)C(=O)CCc1ccccc1 Amb8391159 [0,1,0,0,1,0|1,0,1]=4 1781 B13R1.351 O=C(O)C(Br)CCc1ccccc1 Amb18662872 [0,1,0,0,1,0|1,0,0]=3 1782 B13R1.351 O=C(O)C(O)CCc1ccccc1 Amb2718777 [0,1,0,0,1,0|1,0,0]=3 1783 B13R1.351 O=C(O)C(O)CNc1ccccc1 Amb27179092 [0,1,0,0,1,0|2,0,0]=4 1784 B13R1.351 O=C(O)[C@@H](O)CCc1ccccc1 Amb10603260 [0,1,0,0,1,0|1,0,0]=3 1785 B13R1.351 O=C(O)[C@H](O)CCc1ccccc1 Amb8628145 [0,1,0,0,1,0|1,0,0]=3 1786 B13R1.351 O=C([O-])C(=O)CCc1ccccc1 Amb32662535 [0,1,0,0,1,0|1,0,1]=4 1787 B13R1.513 C=C(C)CCCc1ccc(C)cc1 Amb13890673 [0,1,0,0,1,0|1,0,0]=3 1788 B13R1.513 C=C(C)CCNc1ccc(N)cc1 Amb27211534 [0,1,0,0,1,0|2,0,0]=4 1789 B13R1.513 C=C(C)CNCc1ccc(C)cc1 Amb17308891 [0,1,0,0,1,0|2,0,0]=4 1790 B13R1.513 C=C(C)CNCc1ccc(Cl)cc1 Amb17309084 [0,1,0,0,1,0|2,0,0]=4 1791 B13R1.513 C=C(C)CNCc1ccc(F)cc1 Amb17308876 [0,1,0,0,1,0|2,0,0]=4 1792 B13R1.513 C=C(C)CSCc1ccc(N)cc1 Amb17498611 [0,1,0,0,1,0|2,0,0]=4 1793 B13R1.513 C=C(Cl)CCCc1ccc(F)cc1 Amb13890683 [0,1,0,0,1,0|1,0,1]=4 1794 B13R1.513 CC(=N)NCCc1ccc(Br)cc1 Amb27826811 [0,1,0,0,1,0|2,0,0]=4 1795 B13R1.513 CC(=O)CCCc1ccc(Br)cc1 Amb17255478 [0,1,0,0,1,0|0,0,0]=2 1796 B13R1.513 CC(=O)CCCc1ccc(C)cc1 Amb17233200 [0,1,0,0,1,0|0,0,0]=2 1797 B13R1.513 CC(=O)CCCc1ccc(Cl)cc1 Amb17236503 [0,1,0,0,1,0|0,0,0]=2 1798 B13R1.513 CC(=O)CCCc1ccc(F)cc1 Amb17233677 [0,1,0,0,1,0|0,0,0]=2 1799 B13R1.513 CC(=O)CCNc1ccc(Cl)cc1 Amb27415740 [0,1,0,0,1,0|1,0,0]=3 1800 B13R1.513 CC(=O)CCOc1ccc(C)cc1 Amb7777317 [0,1,0,0,1,0|1,0,0]=3 1801 B13R1.513 CC(=O)CCOc1ccc(Cl)cc1 Amb17139725 [0,1,0,0,1,0|1,0,0]=3 1802 B13R1.513 CC(=O)CCOc1ccc(F)cc1 Amb7777350 [0,1,0,0,1,0|1,0,0]=3 1803 B13R1.513 CC(=O)CCSc1ccc(Br)cc1 Amb9224166 [0,1,0,0,1,0|1,0,0]=3 1804 B13R1.513 CC(=O)CCSc1ccc(C)cc1 Amb9224163 [0,1,0,0,1,0|1,0,0]=3 1805 B13R1.513 CC(=O)CCSc1ccc(Cl)cc1 Amb9224160 [0,1,0,0,1,0|1,0,0]=3 1806 B13R1.513 CC(=O)CCSc1ccc(F)cc1 Amb9224174 [0,1,0,0,1,0|1,0,0]=3 1807 B13R1.513 CC(=O)CSCc1ccc(Cl)cc1 Amb24064340 [0,1,0,0,1,0|1,0,0]=3 1808 B13R1.513 CC(=O)C\C=C\c1ccc(F)cc1 Amb33448623 [0,1,0,0,1,0|0,0,2]=4 1809 B13R1.513 CC(=O)C\C=C\c1ccc(O)cc1 Amb24747691 [0,1,0,0,1,0|0,0,2]=4 1810 B13R1.513 CC(=O)C\C=N\c1ccc(C)cc1 Amb26840629 [0,1,0,0,1,0|1,0,1]=4 1811 B13R1.513 CC(=O)NCCc1ccc(Br)cc1 Amb24451176 [0,1,0,0,1,0|1,0,0]=3 1812 B13R1.513 CC(=O)NCCc1ccc(Br)cn1 Amb24436674 [0,1,0,0,1,0|2,0,0]=4 1813 B13R1.513 CC(=O)NCCc1ccc(C)cn1 Amb29857589 [0,1,0,0,1,0|2,0,0]=4 1814 B13R1.513 CC(=O)NCCc1ccc(Cl)cc1 Amb22227659 [0,1,0,0,1,0|1,0,0]=3 1815 B13R1.513 CC(=O)NCCc1ccc(F)cn1 Amb27753652 [0,1,0,0,1,0|2,0,0]=4 1816 B13R1.513 CC(=O)NCCc1ccc(N)cc1 Amb17138877 [0,1,0,0,1,0|1,0,0]=3 1817 B13R1.513 CC(=O)NCCc1ccc(O)cc1 Amb5797418 [0,1,0,0,1,0|1,0,0]=3 1818 B13R1.513 CC(=O)NOCc1ccc(C)cc1 Amb27802096 [0,1,0,0,1,0|2,0,0]=4 1819 B13R1.513 CC(=O)OCCc1ccc(C)cc1 Amb24100708 [0,1,0,0,1,0|0,0,0]=2 1820 B13R1.513 CC(=O)O\N=C\c1ccc(O)cc1 Amb25302268 [0,1,0,0,1,0|1,0,1]=4 1821 B13R1.513 CC(Br)CCCc1ccc(F)cc1 Amb33240208 [0,1,0,0,1,0|1,0,1]=4 1822 B13R1.513 CC(C)=CCCc1ccc(Br)cc1 Amb35623557 [0,1,0,0,1,0|1,0,1]=4 1823 B13R1.513 CC(C)=CCCc1ccc(C)cc1 Amb35582932 [0,1,0,0,1,0|1,0,1]=4 1824 B13R1.513 CC(C)=CCCc1ccc(Cl)cc1 Amb35588026 [0,1,0,0,1,0|1,0,1]=4 1825 B13R1.513 CC(C)=CCCc1ccc(F)cc1 Amb35588016 [0,1,0,0,1,0|1,0,1]=4 1826 B13R1.513 CC(C)=CCCc1ccc(O)cc1 Amb28202351 [0,1,0,0,1,0|1,0,1]=4 1827 B13R1.513 CC(N)CCCc1ccc(Br)cc1 Amb17255967 [0,1,0,0,1,0|1,0,1]=4 1828 B13R1.513 CC(N)CCCc1ccc(Cl)cc1 Amb17236683 [0,1,0,0,1,0|1,0,1]=4 1829 B13R1.513 CC(N)CCCc1ccc(F)cc1 Amb17233821 [0,1,0,0,1,0|1,0,1]=4 1830 B13R1.513 CC(O)CCCc1ccc(Br)cc1 Amb33482108 [0,1,0,0,1,0|0,0,2]=4 1831 B13R1.513 CC(O)CCCc1ccc(F)cc1 Amb33172158 [0,1,0,0,1,0|0,0,2]=4 1832 B13R1.513 CN(C)CCCc1ccc(N)cc1 Amb2691374 [0,1,0,0,1,0|2,0,0]=4 1833 B13R1.513 CN(O)CCCc1ccc(Br)cc1 Amb33332172 [0,1,0,0,1,0|1,0,1]=4 1834 B13R1.513 CN(O)CCCc1ccc(F)cc1 Amb33320033 [0,1,0,0,1,0|1,0,1]=4 1835 B13R1.513 CS(=O)CCNc1ccc(N)cc1 Amb27414824 [0,1,0,0,1,0|2,0,0]=4 1836 B13R1.513 C[C@@H](N)CCCc1ccc(Br)cc1 Amb33332205 [0,1,0,0,1,0|1,0,1]=4 1837 B13R1.513 C[C@@H](N)CCCc1ccc(F)cc1 Amb33319658 [0,1,0,0,1,0|1,0,1]=4 1838 B13R1.513 C[C@@H](O)CCCc1ccc(Br)cc1 Amb33482146 [0,1,0,0,1,0|0,0,2]=4 1839 B13R1.513 C[C@@H](O)CCCc1ccc(F)cc1 Amb33319655 [0,1,0,0,1,0|0,0,2]=4 1840 B13R1.513 C[C@H](N)CCCc1ccc(Br)cc1 Amb33332206 [0,1,0,0,1,0|1,0,1]=4 1841 B13R1.513 C[C@H](N)CCCc1ccc(F)cc1 Amb33319657 [0,1,0,0,1,0|1,0,1]=4 1842 B13R1.513 C[C@H](O)CCCc1ccc(Br)cc1 Amb33332208 [0,1,0,0,1,0|0,0,2]=4 1843 B13R1.513 C[C@H](O)CCCc1ccc(F)cc1 Amb33319656 [0,1,0,0,1,0|0,0,2]=4 1844 B13R1.513 Cc1ccc(CCCC(=O)Cl)cc1 Amb5739916 [0,1,0,0,1,0|1,0,0]=3 1845 B13R1.513 Cc1ccc(CCCC(=O)O)cc1 Amb2568475 [0,1,0,0,1,0|1,0,0]=3 1846 B13R1.513 Cc1ccc(CCCC(=O)O)cn1 Amb33449519 [0,1,0,0,1,0|2,0,0]=4 1847 B13R1.513 Cc1ccc(CCCC(=O)O)nc1 Amb33429861 [0,1,0,0,1,0|2,0,0]=4 1848 B13R1.513 Cc1ccc(CCCC(C)N)cc1 Amb17233315 [0,1,0,0,1,0|1,0,1]=4 1849 B13R1.513 Cc1ccc(CCCC(N)=O)cc1 Amb17233276 [0,1,0,0,1,0|1,0,0]=3 1850 B13R1.513 Cc1ccc(CCCC(N)=S)cc1 Amb18626184 [0,1,0,0,1,0|1,1,0]=4 1851 B13R1.513 Cc1ccc(CCC[C@@H](C)N)cc1 Amb33729218 [0,1,0,0,1,0|1,0,1]=4 1852 B13R1.513 Cc1ccc(CCC[C@H](C)N)cc1 Amb33727897 [0,1,0,0,1,0|1,0,1]=4 1853 B13R1.513 Cc1ccc(CNCC(=O)O)cc1 Amb7766541 [0,1,0,0,1,0|2,0,0]=4 1854 B13R1.513 Cc1ccc(CNCC(N)=O)cc1 Amb1112534 [0,1,0,0,1,0|2,0,0]=4 1855 B13R1.513 Cc1ccc(COCC(=O)O)cc1 Amb17470625 [0,1,0,0,1,0|2,0,0]=4 1856 B13R1.513 Cc1ccc(CSCC(=O)O)cc1 Amb1211907 [0,1,0,0,1,0|2,0,0]=4 1857 B13R1.513 Cc1ccc(NCCC(=O)O)cc1 Amb2209164 [0,1,0,0,1,0|2,0,0]=4 1858 B13R1.513 Cc1ccc(NCCC(=O)[O-])cc1 Amb2332620 [0,1,0,0,1,0|2,0,0]=4 1859 B13R1.513 Cc1ccc(NCCC(N)=O)cc1 Amb8841172 [0,1,0,0,1,0|2,0,0]=4 1860 B13R1.513 Cc1ccc(NCCS(C)=O)cc1 Amb27785320 [0,1,0,0,1,0|2,0,0]=4 1861 B13R1.513 Cc1ccc(OCCC(=O)Cl)cc1 Amb17143210 [0,1,0,0,1,0|2,0,0]=4 1862 B13R1.513 Cc1ccc(OCCC(=O)O)cc1 Amb6332253 [0,1,0,0,1,0|2,0,0]=4 1863 B13R1.513 Cc1ccc(OCCC(N)=O)cc1 Amb8858351 [0,1,0,0,1,0|2,0,0]=4 1864 B13R1.513 Cc1ccc(SCCC(=O)O)cc1 Amb1102788 [0,1,0,0,1,0|2,0,0]=4 1865 B13R1.513 N=C(N)CCCc1ccc(Br)cc1 Amb33334095 [0,1,0,0,1,0|2,0,0]=4 1866 B13R1.513 N=C(N)CCCc1ccc(F)cc1 Amb33319179 [0,1,0,0,1,0|2,0,0]=4 1867 B13R1.513 NC(=O)CCCc1ccc(Br)cc1 Amb4005054 [0,1,0,0,1,0|1,0,0]=3 1868 B13R1.513 NC(=O)CCCc1ccc(Cl)cc1 Amb17236667 [0,1,0,0,1,0|1,0,0]=3 1869 B13R1.513 NC(=O)CCCc1ccc(F)cc1 Amb17233787 [0,1,0,0,1,0|1,0,0]=3 1870 B13R1.513 NC(=O)CCNc1ccc(Br)cc1 Amb8841798 [0,1,0,0,1,0|2,0,0]=4 1871 B13R1.513 NC(=O)CCNc1ccc(Cl)cc1 Amb8841806 [0,1,0,0,1,0|2,0,0]=4 1872 B13R1.513 NC(=O)CCNc1ccc(F)cc1 Amb1670561 [0,1,0,0,1,0|2,0,0]=4 1873 B13R1.513 NC(=O)CCNc1ccc(N)cc1 Amb19373175 [0,1,0,0,1,0|2,0,0]=4 1874 B13R1.513 NC(=O)CCNc1ccc(N)cc1 Amb9415702 [0,1,0,0,1,0|2,0,0]=4 1875 B13R1.513 NC(=O)CCOc1ccc(F)cc1 Amb8999025 [0,1,0,0,1,0|2,0,0]=4 1876 B13R1.513 NC(=O)CCOc1ccc(N)cc1 Amb8842882 [0,1,0,0,1,0|2,0,0]=4 1877 B13R1.513 NC(=O)CCSc1ccc(Cl)cc1 Amb1539927 [0,1,0,0,1,0|2,0,0]=4 1878 B13R1.513 NC(=O)CCSc1ccc(F)cc1 Amb8997701 [0,1,0,0,1,0|2,0,0]=4 1879 B13R1.513 NC(=O)CNCc1ccc(Br)cc1 Amb1120953 [0,1,0,0,1,0|2,0,0]=4 1880 B13R1.513 NC(=O)CNCc1ccc(F)cc1 Amb1118480 [0,1,0,0,1,0|2,0,0]=4 1881 B13R1.513 NC(=O)CSCc1ccc(N)cc1 Amb17497163 [0,1,0,0,1,0|2,0,0]=4 1882 B13R1.513 NC(=O)NCCc1ccc(Br)cc1 Amb28242686 [0,1,0,0,1,0|2,0,0]=4 1883 B13R1.513 NC(=O)NCCc1ccc(Cl)cc1 Amb12806713 [0,1,0,0,1,0|2,0,0]=4 1884 B13R1.513 NC(=S)CCCc1ccc(Br)cc1 Amb33334089 [0,1,0,0,1,0|1,1,0]=4 1885 B13R1.513 NC(=S)CCCc1ccc(Cl)cc1 Amb18107322 [0,1,0,0,1,0|1,1,0]=4 1886 B13R1.513 NC(=S)CCCc1ccc(F)cc1 Amb33319178 [0,1,0,0,1,0|1,1,0]=4 1887 B13R1.513 Nc1ccc(CCCC(=O)O)cc1 Amb3940777 [0,1,0,0,1,0|1,0,0]=3 1888 B13R1.513 Nc1ccc(COCC(=O)O)cc1 Amb6739977 [0,1,0,0,1,0|2,0,0]=4 1889 B13R1.513 Nc1ccc(CSCC(=O)O)cc1 Amb17497517 [0,1,0,0,1,0|2,0,0]=4 1890 B13R1.513 Nc1ccc(NCCC(=O)O)cc1 Amb25060675 [0,1,0,0,1,0|2,0,0]=4 1891 B13R1.513 Nc1ccc(OCCC(=O)O)cc1 Amb19348346 [0,1,0,0,1,0|2,0,0]=4 1892 B13R1.513 Nc1ccc(OCCC(=O)O)cc1 Amb33536339 [0,1,0,0,1,0|2,0,0]=4 1893 B13R1.513 Nc1ccc(SCCC(=O)O)cc1 Amb19014210 [0,1,0,0,1,0|2,0,0]=4 1894 B13R1.513 O=C(Cl)CCCc1ccc(F)cc1 Amb5739923 [0,1,0,0,1,0|1,0,0]=3 1895 B13R1.513 O=C(Cl)CCOc1ccc(Cl)cc1 Amb17143749 [0,1,0,0,1,0|2,0,0]=4 1896 B13R1.513 O=C(Cl)CCSc1ccc(Cl)cc1 Amb17144561 [0,1,0,0,1,0|2,0,0]=4 1897 B13R1.513 O=C(Cl)CCSc1ccc(F)cc1 Amb22642142 [0,1,0,0,1,0|2,0,0]=4 1898 B13R1.513 O=C(Cl)NCCc1ccc(Br)cc1 Amb35625646 [0,1,0,0,1,0|2,0,0]=4 1899 B13R1.513 O=C(Cl)NCCc1ccc(Cl)cc1 Amb35637085 [0,1,0,0,1,0|2,0,0]=4 1900 B13R1.513 O=C(Cl)NCCc1ccc(F)cc1 Amb35637103 [0,1,0,0,1,0|2,0,0]=4 1901 B13R1.513 O=C(Cl)OCCc1ccc(Cl)cc1 Amb33297197 [0,1,0,0,1,0|1,0,0]=3 1902 B13R1.513 O=C(O)CCCc1ccc(Br)cc1 Amb2724902 [0,1,0,0,1,0|1,0,0]=3 1903 B13R1.513 O=C(O)CCCc1ccc(Br)cn1 Amb33430085 [0,1,0,0,1,0|2,0,0]=4 1904 B13R1.513 O=C(O)CCCc1ccc(Br)nc1 Amb33388873 [0,1,0,0,1,0|2,0,0]=4 1905 B13R1.513 O=C(O)CCCc1ccc(Cl)cc1 Amb3932917 [0,1,0,0,1,0|1,0,0]=3 1906 B13R1.513 O=C(O)CCCc1ccc(Cl)cn1 Amb33390742 [0,1,0,0,1,0|2,0,0]=4 1907 B13R1.513 O=C(O)CCCc1ccc(Cl)nc1 Amb33261752 [0,1,0,0,1,0|2,0,0]=4 1908 B13R1.513 O=C(O)CCCc1ccc(F)cc1 Amb2719687 [0,1,0,0,1,0|1,0,0]=3 1909 B13R1.513 O=C(O)CCCc1ccc(F)cn1 Amb33449321 [0,1,0,0,1,0|2,0,0]=4 1910 B13R1.513 O=C(O)CCCc1ccc(F)nc1 Amb33425483 [0,1,0,0,1,0|2,0,0]=4 1911 B13R1.513 O=C(O)CCCc1ccc(I)cc1 Amb6740420 [0,1,0,0,1,0|1,0,0]=3 1912 B13R1.513 O=C(O)CCCc1ccc(O)cc1 Amb10602364 [0,1,0,0,1,0|1,0,0]=3 1913 B13R1.513 O=C(O)CCNc1ccc(Br)cc1 Amb2209168 [0,1,0,0,1,0|2,0,0]=4 1914 B13R1.513 O=C(O)CCNc1ccc(Cl)cc1 Amb2209167 [0,1,0,0,1,0|2,0,0]=4 1915 B13R1.513 O=C(O)CCNc1ccc(F)cc1 Amb2209163 [0,1,0,0,1,0|2,0,0]=4 1916 B13R1.513 O=C(O)CCOc1ccc(Br)cc1 Amb1118334 [0,1,0,0,1,0|2,0,0]=4 1917 B13R1.513 O=C(O)CCOc1ccc(Cl)cc1 Amb1115231 [0,1,0,0,1,0|2,0,0]=4 1918 B13R1.513 O=C(O)CCOc1ccc(F)cc1 Amb1119259 [0,1,0,0,1,0|2,0,0]=4 1919 B13R1.513 O=C(O)CCSc1ccc(Br)cc1 Amb1118833 [0,1,0,0,1,0|2,0,0]=4 1920 B13R1.513 O=C(O)CCSc1ccc(Cl)cc1 Amb1102804 [0,1,0,0,1,0|2,0,0]=4 1921 B13R1.513 O=C(O)CCSc1ccc(F)cc1 Amb1215312 [0,1,0,0,1,0|2,0,0]=4 1922 B13R1.513 O=C(O)CNCc1ccc(Br)cc1 Amb9204138 [0,1,0,0,1,0|2,0,0]=4 1923 B13R1.513 O=C(O)CNCc1ccc(Cl)cc1 Amb1111327 [0,1,0,0,1,0|2,0,0]=4 1924 B13R1.513 O=C(O)CNCc1ccc(Cl)cc1 Amb15740982 [0,1,0,0,1,0|2,0,0]=4 1925 B13R1.513 O=C(O)CNCc1ccc(F)cc1 Amb10610178 [0,1,0,0,1,0|2,0,0]=4 1926 B13R1.513 O=C(O)CNCc1ccc(F)cc1 Amb2372201 [0,1,0,0,1,0|2,0,0]=4 1927 B13R1.513 O=C(O)CNCc1ccc(O)cc1 Amb33802292 [0,1,0,0,1,0|2,0,0]=4 1928 B13R1.513 O=C(O)COCc1ccc(Br)cc1 Amb2745250 [0,1,0,0,1,0|2,0,0]=4 1929 B13R1.513 O=C(O)COCc1ccc(Cl)cc1 Amb17471000 [0,1,0,0,1,0|2,0,0]=4 1930 B13R1.513 O=C(O)COCc1ccc(F)cc1 Amb17470663 [0,1,0,0,1,0|2,0,0]=4 1931 B13R1.513 O=C(O)COCc1ccc(I)cc1 Amb32669721 [0,1,0,0,1,0|2,0,0]=4 1932 B13R1.513 O=C(O)CSCc1ccc(Br)cc1 Amb6337639 [0,1,0,0,1,0|2,0,0]=4 1933 B13R1.513 O=C(O)CSCc1ccc(Cl)cc1 Amb6457724 [0,1,0,0,1,0|2,0,0]=4 1934 B13R1.513 O=C(O)CSCc1ccc(F)cc1 Amb1210139 [0,1,0,0,1,0|2,0,0]=4 1935 B13R1.513 O=C1C=CN(CCCC(=O)O)C=C1 Amb18029469 [0,1,0,0,1,0|2,0,0]=4 1936 B13R1.513 O=[N+]([O-])CCCc1ccc(Br)cc1 Amb33332477 [0,1,0,0,1,0|2,0,0]=4 1937 B13R1.513 O=[N+]([O-])CCCc1ccc(F)cc1 Amb33319639 [0,1,0,0,1,0|2,0,0]=4 1938 B13R1.3523 CC(C)(N)CCCc1ccccc1 Amb17400637 [0,1,0,0,1,0|1,0,1]=4 1939 B13R1.3523 CC(C)(O)CCCc1ccccc1 Amb17400670 [0,1,0,0,1,0|0,0,2]=4 1940 B13R1.3523 CS(=O)(=O)NCCc1ccccc1 Amb6404938 [0,1,0,0,1,0|2,0,0]=4 1941 B13R1.3523 CS(=O)(=O)OCCc1ccccc1 Amb22493888 [0,1,0,0,1,0|1,0,0]=3 1942 B13R1.3523 CS(=O)(=O)OCCc1cccnc1 Amb24496386 [0,1,0,0,1,0|2,0,0]=4 1943 B13R1.3523 NS(=O)(=O)CCCc1ccccc1 Amb18322199 [0,1,0,0,1,0|2,0,0]=4 1944 B13R1.3523 NS(=O)(=O)OCCc1ccccc1 Amb33081457 [0,1,0,0,1,0|2,0,0]=4 1945 B13R1.3523 O=S(=O)(Cl)CCCc1ccccc1 Amb5723610 [0,1,0,0,1,0|2,0,0]=4 1946 B13R1.3523 O=S(=O)(F)CCCc1ccccc1 Amb32719213 [0,1,0,0,1,0|2,0,0]=4 1947 B13R1.536 O=C(CCl)NCCCc1cccs1 Amb31176171 [0,1,0,0,1,0|2,0,0]=4 1948 B15R1.119 CC(=O)CCCCOc1cccc(F)c1 Amb9659941 [0,1,0,0,0,1|1,0,0]=3 1949 B15R1.119 CC(=O)CCCCSc1cccc(Br)c1 Amb32682846 [0,1,0,0,0,1|1,0,0]=3 1950 B15R1.119 CC(=O)CCCCSc1cccc(C)c1 Amb32682848 [0,1,0,0,0,1|1,0,0]=3 1951 B15R1.119 CC(=O)CCCCSc1cccc(Cl)c1 Amb32682847 [0,1,0,0,0,1|1,0,0]=3 1952 B15R1.119 CC(=O)CCCCSc1cccc(F)c1 Amb32682835 [0,1,0,0,0,1|1,0,0]=3 1953 B15R1.119 CC(=O)CCCSCc1cccc(C)c1 Amb32682854 [0,1,0,0,0,1|1,0,0]=3 1954 B15R1.119 CC(=O)\C=C\CCOc1cccc(F)c1 Amb33417029 [0,1,0,0,0,1|1,0,1]=4 1955 B15R1.119 CC(C)OCCOCc1cccc(N)c1 Amb6246997 [0,1,0,0,0,1|1,0,1]=4 1956 B15R1.119 Cc1cccc(CNCCCC(=O)O)c1 Amb1109830 [0,1,0,0,0,1|2,0,0]=4 1957 B15R1.119 Cc1cccc(OCCCCC(=O)O)c1 Amb7782821 [0,1,0,0,0,1|2,0,0]=4 1958 B15R1.119 Nc1cccc(CCNCCC(=O)O)c1 Amb18550410 [0,1,0,0,0,1|2,0,0]=4 1959 B15R1.119 O=C(O)CCCCOc1cccc(Cl)c1 Amb7782830 [0,1,0,0,0,1|2,0,0]=4 1960 B15R1.119 O=C(O)CCCCOc1cccc(F)c1 Amb7782837 [0,1,0,0,0,1|2,0,0]=4 1961 B15R1.119 O=C(O)CCCNCc1cccc(Cl)c1 Amb1110592 [0,1,0,0,0,1|2,0,0]=4 1962 B15R1.119 O=C(O)CCCNCc1cccc(Cl)c1 Amb33551442 [0,1,0,0,0,1|2,0,0]=4 1963 B15R1.119 O=C(O)CCCNCc1cccc(F)c1 Amb1111030 [0,1,0,0,0,1|2,0,0]=4 1964 B15R1.119 O=C(O)CCCNCc1cccc(F)c1 Amb33549259 [0,1,0,0,0,1|2,0,0]=4 1965 B15R1.119 O=C(O)COCCOc1cccc(F)c1 Amb17241639 [0,1,0,0,0,1|2,0,0]=4 1966 B15R1.131 CC(=O)CCCCSc1ccccc1Br Amb9660234 [0,1,0,0,0,1|1,0,0]=3 1967 B15R1.131 CC(=O)CCCCSc1ccccc1C Amb32682837 [0,1,0,0,0,1|1,0,0]=3 1968 B15R1.131 CC(=O)CCCCSc1ccccc1Cl Amb9660354 [0,1,0,0,0,1|1,0,0]=3 1969 B15R1.131 CC(=O)CCCCSc1ccccc1F Amb9660342 [0,1,0,0,0,1|1,0,0]=3 1970 B15R1.131 CC(=O)CCCSCc1ccccc1C Amb32682855 [0,1,0,0,0,1|1,0,0]=3 1971 B15R1.131 CC(=O)CCCSCc1ccccc1Cl Amb32682851 [0,1,0,0,0,1|1,0,0]=3 1972 B15R1.131 CC(=O)NCCNCc1ccccc1Br Amb6732676 [0,1,0,0,0,1|1,0,0]=3 1973 B15R1.131 CC(=O)NCCNCc1ccccc1C Amb6732478 [0,1,0,0,0,1|1,0,0]=3 1974 B15R1.131 CC(=O)NCCNCc1ccccc1Cl Amb6732452 [0,1,0,0,0,1|1,0,0]=3 1975 B15R1.131 CC(=O)NCCNCc1ccccc1F Amb6732653 [0,1,0,0,0,1|1,0,0]=3 1976 B15R1.131 Cc1ccccc1CNCCCC(=O)O Amb10609179 [0,1,0,0,0,1|2,0,0]=4 1977 B15R1.131 Cc1ccccc1CNCCCC(=O)O Amb1111398 [0,1,0,0,0,1|2,0,0]=4 1978 B15R1.131 O=C(O)CCCNCc1ccccc1Cl Amb1111360 [0,1,0,0,0,1|2,0,0]=4 1979 B15R1.131 O=C(O)CCCNCc1ccccc1Cl Amb13951558 [0,1,0,0,0,1|2,0,0]=4 1980 B15R1.131 O=C(O)CCCNCc1ccccc1F Amb8961061 [0,1,0,0,0,1|2,0,0]=4 1981 B15R1.497 CC(=O)NCCNC(C)c1ccccc1 Amb6732540 [0,1,0,0,0,1|1,0,0]=3 1982 B15R1.497 CC(CNCCC(=O)O)c1ccccc1 Amb8833762 [0,1,0,0,0,1|2,0,0]=4 1983 B15R1.497 NC(CCCCC(=O)O)c1ccccc1 Amb19435643 [0,1,0,0,0,1|2,0,0]=4 1984 B15R1.497 NC(CCCCC(=O)O)c1ccccc1 Amb9306188 [0,1,0,0,0,1|2,0,0]=4 1985 B15R1.497 O=C(O)CCCCC(=O)c1ccccc1 Amb2774290 [0,1,0,0,0,1|2,0,0]=4 1986 B15R1.497 O=C(O)CSCCC(O)c1ccccc1 Amb21984426 [0,1,0,0,0,1|1,1,0]=4 1987 B15R1.871 CC(=O)CCCCSc1ccc(Br)cc1 Amb9660227 [0,1,0,0,0,1|1,0,0]=3 1988 B15R1.871 CC(=O)CCCCSc1ccc(C)cc1 Amb9660336 [0,1,0,0,0,1|1,0,0]=3 1989 B15R1.871 CC(=O)CCCCSc1ccc(Cl)cc1 Amb9660311 [0,1,0,0,0,1|1,0,0]=3 1990 B15R1.871 CC(=O)CCCCSc1ccc(F)cc1 Amb9660360 [0,1,0,0,0,1|1,0,0]=3 1991 B15R1.871 CC(=O)CCCSCc1ccc(Cl)cc1 Amb32682852 [0,1,0,0,0,1|1,0,0]=3 1992 B15R1.871 CC(=O)CSCCOc1ccc(N)cc1 Amb17504113 [0,1,0,0,0,1|1,1,0]=4 1993 B15R1.871 CC(=O)NCCCNc1ccc(N)nc1 Amb18101761 [0,1,0,0,0,1|2,0,0]=4 1994 B15R1.871 CC(=O)NCCCOc1ccc(N)cc1 Amb17131786 [0,1,0,0,0,1|1,0,0]=3 1995 B15R1.871 CC(=O)NCCNCc1ccc(Br)cc1 Amb6732455 [0,1,0,0,0,1|1,0,0]=3 1996 B15R1.871 CC(=O)NCCNCc1ccc(C)cc1 Amb6732479 [0,1,0,0,0,1|1,0,0]=3 1997 B15R1.871 CC(=O)NCCNCc1ccc(Cl)cc1 Amb6732456 [0,1,0,0,0,1|1,0,0]=3 1998 B15R1.871 CC(=O)OCCCOc1ccc(Br)cc1 Amb22504602 [0,1,0,0,0,1|0,0,0]=2 1999 B15R1.871 CC(=O)OCCNCc1ccc(C)cc1 Amb18929213 [0,1,0,0,0,1|0,0,0]=2 2000 B15R1.871 CC(=O)OCCNCc1ccc(Cl)cc1 Amb18929160 [0,1,0,0,0,1|0,0,0]=2 2001 B15R1.871 CC(C)OCCOCc1ccc(O)cc1 Amb8387109 [0,1,0,0,0,1|1,0,1]=4 2002 B15R1.871 Cc1ccc(CNCCCC(=O)O)cc1 Amb6254100 [0,1,0,0,0,1|2,0,0]=4 2003 B15R1.871 Nc1ccc(CCNCCC(=O)O)cc1 Amb18550359 [0,1,0,0,0,1|2,0,0]=4 2004 B15R1.871 Nc1ccc(CSCCCC(=O)O)cc1 Amb17498969 [0,1,0,0,0,1|2,0,0]=4 2005 B15R1.871 O=C(O)CCCCCc1ccc(F)cc1 Amb9306098 [0,1,0,0,0,1|2,0,0]=4 2006 B15R1.871 O=C(O)CCCCCc1ccc(I)cc1 Amb9306112 [0,1,0,0,0,1|2,0,0]=4 2007 B15R1.871 O=C(O)CCCCCc1ccc(O)cc1 Amb19132681 [0,1,0,0,0,1|2,0,0]=4 2008 B15R1.871 O=C(O)CCCCOc1ccc(Br)cc1 Amb7782807 [0,1,0,0,0,1|2,0,0]=4 2009 B15R1.871 O=C(O)CCCCOc1ccc(Cl)cc1 Amb2032059 [0,1,0,0,0,1|2,0,0]=4 2010 B15R1.871 O=C(O)CCCCOc1ccc(F)cc1 Amb7764654 [0,1,0,0,0,1|2,0,0]=4 2011 B15R1.871 O=C(O)CCCNCc1ccc(Cl)cc1 Amb10609858 [0,1,0,0,0,1|2,0,0]=4 2012 B15R1.871 O=C(O)CCCNCc1ccc(Cl)cc1 Amb1109631 [0,1,0,0,0,1|2,0,0]=4 2013 B15R1.871 O=C(O)CCCNCc1ccc(F)cc1 Amb1111469 [0,1,0,0,0,1|2,0,0]=4 2014 B15R1.871 O=C(O)CCCNCc1ccc(F)cc1 Amb33548175 [0,1,0,0,0,1|2,0,0]=4 2015 B15R1.871 O=C(O)CCNCCc1ccc(F)cc1 Amb7755654 [0,1,0,0,0,1|2,0,0]=4 2016 B15R1.871 O=C(O)CCOCCc1ccc(F)cc1 Amb17471451 [0,1,0,0,0,1|2,0,0]=4 2017 B15R1.962 BrC\C(Br)=C\CCOCc1ccccc1 Amb25678545 [0,1,0,0,0,1|2,0,0]=4 2018 B15R1.962 C=CC(=O)NCCOCc1ccccc1 Amb28292743 [0,1,0,0,0,1|1,0,1]=4 2019 B15R1.962 CC(C=O)CCCOCc1ccccc1 Amb27245209 [0,1,0,0,0,1|1,0,1]=4 2020 B15R1.962 CC(CO)OCCOCc1ccccc1 Amb27495501 [0,1,0,0,0,1|0,0,2]=4 2021 B15R1.962 CCC(=O)CCCSCc1ccccc1 Amb32682994 [0,1,0,0,0,1|1,0,0]=3 2022 B15R1.962 CCC(=O)OCCNCc1ccccc1 Amb18266491 [0,1,0,0,0,1|0,0,0]=2 2023 B15R1.962 CN(C=O)CCCOCc1ccccc1 Amb27452746 [0,1,0,0,0,1|2,0,0]=4 2024 B15R1.962 CNC(=N)NCCOCc1ccccc1 Amb27200914 [0,1,0,0,0,1|2,0,0]=4 2025 B15R1.962 CNC(=O)NCCNCc1ccccc1 Amb28067934 [0,1,0,0,0,1|1,0,0]=3 2026 B15R1.962 CNC(=O)NCCOCc1ccccc1 Amb27435823 [0,1,0,0,0,1|1,0,0]=3 2027 B15R1.962 COC(=O)CCCNCc1ccccc1 Amb33549509 [0,1,0,0,0,1|1,0,0]=3 2028 B15R1.962 COC(=O)CCCNCc1ccccc1 Amb8951848 [0,1,0,0,0,1|1,0,0]=3 2029 B15R1.962 COC(=O)CCCOCc1ccccc1 Amb8961276 [0,1,0,0,0,1|1,0,0]=3 2030 B15R1.962 COC(=O)CCNOCc1ccccc1 Amb28118387 [0,1,0,0,0,1|2,0,0]=4 2031 B15R1.962 COC(=O)COCCOc1ccccc1 Amb9206367 [0,1,0,0,0,1|1,0,0]=3 2032 B15R1.962 COC(=O)\C=C\COCc1ccccc1 Amb2697688 [0,1,0,0,0,1|1,0,1]=4 2033 B15R1.962 C\C(=C\CCOCc1ccccc1)CN Amb28191612 [0,1,0,0,0,1|2,0,0]=4 2034 B15R1.962 NCC(=O)CCCOCc1ccccc1 Amb25854482 [0,1,0,0,0,1|1,0,0]=3 2035 B15R1.962 O=C(CCl)NCCCCc1ccccc1 Amb7969392 [0,1,0,0,0,1|1,0,0]=3 2036 B15R1.962 O=C(CCl)NCCCSc1ccccc1 Amb1672011 [0,1,0,0,0,1|1,0,0]=3 2037 B15R1.962 O=C(CCl)NCCSCc1ccccc1 Amb1656481 [0,1,0,0,0,1|1,0,0]=3 2038 B15R1.962 O=C(CS)NCCOCc1ccccc1 Amb27781246 [0,1,0,0,0,1|1,0,0]=3 2039 B15R1.1081 CC(=O)NCCN(C)Cc1ccccc1 Amb33068988 [0,1,0,0,0,1|1,0,0]=3 2040 B15R1.1081 CN(CCCC(=O)O)Cc1ccccc1 Amb15740947 [0,1,0,0,0,1|2,0,0]=4 2041 B15R1.1081 CN(CCCC(=O)O)Cc1ccccc1 Amb5761683 [0,1,0,0,0,1|2,0,0]=4 2042 B15R1.1081 CN(CCCC(N)=O)Cc1ccccc1 Amb17143360 [0,1,0,0,0,1|2,0,0]=4 2043 B15R1.3664 C=C(C)C(=O)CCNCc1ccccc1 Amb33131467 [0,1,0,0,0,1|2,0,0]=4 2044 B15R1.3664 C=C(C)C(=O)OCCCc1ccccc1 Amb17934136 [0,1,0,0,0,1|1,0,0]=3 2045 B15R1.3664 C=C(C)C(N)CCOCc1ccccc1 Amb27433744 [0,1,0,0,0,1|2,0,0]=4 2046 B15R1.3664 C=C(C)C(O)CCOCc1ccccc1 Amb27262825 [0,1,0,0,0,1|2,0,0]=4 2047 B15R1.3664 CC(=N)N(C)CCOCc1ccccc1 Amb27967002 [0,1,0,0,0,1|2,0,0]=4 2048 B15R1.3664 CC(=O)N(C)CCOCc1ccccc1 Amb27980258 [0,1,0,0,0,1|1,0,0]=3 2049 B15R1.3664 CC(=O)[C@@H](C)CCOCc1ccccc1 Amb27478452 [0,1,0,0,0,1|1,0,0]=3 2050 B15R1.3664 CC(CCNCc1ccccc1)C(=O)O Amb28056537 [0,1,0,0,0,1|2,0,0]=4 2051 B15R1.3664 CC(CCNCc1ccccc1)S(C)=O Amb27611198 [0,1,0,0,0,1|2,0,0]=4 2052 B15R1.3664 CC(OCCOc1ccccc1)C(=O)O Amb6269260 [0,1,0,0,0,1|2,0,0]=4 2053 B15R1.3664 CC(SCCCc1ccccc1)C(=O)O Amb6275248 [0,1,0,0,0,1|1,1,0]=4 2054 B15R1.3664 CN(CCOCc1ccccc1)C(N)=O Amb27193686 [0,1,0,0,0,1|2,0,0]=4 2055 B15R1.3664 NC(=O)C(N)CCOCc1ccccc1 Amb27767131 [0,1,0,0,0,1|2,0,0]=4 2056 B15R1.3664 NC(CCOCc1ccccc1)C(=O)O Amb25857076 [0,1,0,0,0,1|2,0,0]=4 2057 B15R1.3664 NC(CSCCc1ccccc1)C(=O)O Amb9726827 [0,1,0,0,0,1|2,0,0]=4 2058 B15R1.3664 N[C@@H](CCCCc1ccccc1)C(=O)O Amb34157766 [0,1,0,0,0,1|2,0,0]=4 2059 B15R1.3664 N[C@@H](CCOCc1ccccc1)C(=O)O Amb16183871 [0,1,0,0,0,1|2,0,0]=4 2060 B15R1.3664 N[C@H](CCCCc1ccccc1)C(=O)O Amb34912486 [0,1,0,0,0,1|2,0,0]=4 2061 B15R1.3664 N[C@H](CCOCc1ccccc1)C(=O)O Amb16183869 [0,1,0,0,0,1|2,0,0]=4 2062 B15R1.3664 O=C(O)C(=O)NCCCc1ccccc1 Amb18529576 [0,1,0,0,0,1|2,0,0]=4 2063 B15R1.3664 O=C(O)C(O)CCNCc1ccccc1 Amb27463322 [0,1,0,0,0,1|2,0,0]=4 2064 B15R1.3890 CC(C)(N)COCCCc1ccccc1 Amb18630804 [0,1,0,0,0,1|1,0,1]=4 2065 B15R1.3890 CS(=O)(=O)OCCOCc1ccccc1 Amb27649219 [0,1,0,0,0,1|1,0,0]=3 2066 B15R1.3890 O=S(=O)(O)OCCNCc1ccccc1 Amb21858586 [0,1,0,0,0,1|2,0,0]=4 2067 B15R1.5919 CC(=O)CCC(=O)NCc1ccccc1 Amb16886463 [0,1,0,0,0,1|1,0,1]=4 2068 B15R1.5919 CC(=O)CCC(=O)OCc1ccccc1 Amb6357593 [0,1,0,0,0,1|1,0,1]=4 2069 B15R1.5919 CC(=O)NCC(=O)OCc1ccccc1 Amb25277285 [0,1,0,0,0,1|1,0,1]=4 2070 B15R1.5919 CC(=O)OCC(=O)NCc1ccccc1 Amb3623988 [0,1,0,0,0,1|0,0,1]=3 2071 B15R1.5919 CC(=O)OCC(C)NCc1ccccc1 Amb28203978 [0,1,0,0,0,1|0,0,0]=2 2072 B15R1.5919 CC(=O)ONC(=O)OCc1ccccc1 Amb24323244 [0,1,0,0,0,1|1,0,1]=4 2073 B15R1.5919 CC(CCC(=O)O)OCc1ccccc1 Amb28044418 [0,1,0,0,0,1|2,0,0]=4 2074 B15R1.5919 CN(CCC(=O)O)CCc1ccccc1 Amb17338828 [0,1,0,0,0,1|2,0,0]=4 2075 B15R1.9084 CC(=O)CC(=O)NCCc1ccccc1 Amb1871453 [0,1,0,0,0,1|1,0,1]=4 2076 B15R1.9084 CC(=O)CC(C)COCc1ccccc1 Amb35781833 [0,1,0,0,0,1|1,0,0]=3 2077 B15R1.9084 CC(=O)C[C@H](O)COCc1ccccc1 Amb27405000 [0,1,0,0,0,1|1,0,0]=3 2078 B15R1.9084 CC(=O)OC(C)CNCc1ccccc1 Amb18929272 [0,1,0,0,0,1|0,0,0]=2 2079 B15R1.9084 CC(CNCc1ccccc1)CC(=O)O Amb27852616 [0,1,0,0,0,1|2,0,0]=4 2080 B15R1.9084 CC(COCc1ccccc1)CC(=O)O Amb4476984 [0,1,0,0,0,1|2,0,0]=4 2081 B15R1.9084 CN(CCCc1ccccc1)CC(=O)O Amb9301026 [0,1,0,0,0,1|2,0,0]=4 2082 B15R1.9084 CS(=O)CC(=O)CCCc1ccccc1 Amb33129311 [0,1,0,0,0,1|2,0,0]=4 2083 B15R1.9084 CS(=O)CC(N)CCCc1ccccc1 Amb33128527 [0,1,0,0,0,1|2,0,0]=4 2084 B15R1.9084 NC(COCc1ccccc1)CC(=O)O Amb2697627 [0,1,0,0,0,1|2,0,0]=4 2085 B15R1.9084 N[C@@H](COCc1ccccc1)CC(=O)O Amb33330243 [0,1,0,0,0,1|2,0,0]=4 2086 B15R1.9084 N[C@@H](COCc1ccccc1)CC(=O)O Amb33457777 [0,1,0,0,0,1|2,0,0]=4 2087 B15R1.9084 N[C@H](COCc1ccccc1)CC(=O)O Amb27153690 [0,1,0,0,0,1|2,0,0]=4 2088 B15R1.9084 N[C@H](COCc1ccccc1)CC(=O)O Amb33330157 [0,1,0,0,0,1|2,0,0]=4 2089 B15R1.9084 O=C(O)CC(O)COCc1ccccc1 Amb27488040 [0,1,0,0,0,1|2,0,0]=4 2090 B15R1.64 COc1cccc(CCCCC(=O)O)c1 Amb18049846 [0,2,0,0,0,0|2,0,0]=4 2091 B15R1.64 COc1cccc(NCCNC(C)=O)c1 Amb18270415 [0,2,0,0,0,0|2,0,0]=4 2092 B15R1.64 COc1cccc(SCCCC(C)=O)c1 Amb9284044 [0,2,0,0,0,0|2,0,0]=4 2093 B15R1.121 CC(CCCc1cccc(Br)c1)C(=O)O Amb17275304 [0,2,0,0,0,0|2,0,0]=4 2094 B15R1.121 NC(CCCc1cccc(Br)c1)C(=O)O Amb33005038 [0,2,0,0,0,0|2,0,0]=4 2095 B15R1.121 O=C(O)C(=O)CCCc1cccc(Br)c1 Amb33006695 [0,2,0,0,0,0|2,0,0]=4 2096 B15R1.121 O=C(O)C(O)CCCc1cccc(Br)c1 Amb33006648 [0,2,0,0,0,0|2,0,0]=4 2097 B15R1.123 CC(=O)NCCNc1cccc(Cl)c1C Amb18270433 [0,2,0,0,0,0|2,0,0]=4 2098 B15R1.123 CC(=O)NCCOc1cccc(C)c1C Amb13949289 [0,2,0,0,0,0|2,0,0]=4 2099 B15R1.888 CC(=O)CCCOc1ccc(Cl)c(C)c1 Amb17247540 [0,2,0,0,0,0|2,0,0]=4 2100 B15R1.888 CC(=O)CCCSc1ccc(C)c(C)c1 Amb9283502 [0,2,0,0,0,0|2,0,0]=4 2101 B15R1.888 CC(=O)CCCSc1ccc(Cl)c(Cl)c1 Amb32682849 [0,2,0,0,0,0|2,0,0]=4 2102 B15R1.888 CC(=O)CCCSc1ccc(F)c(F)c1 Amb9283516 [0,2,0,0,0,0|2,0,0]=4 2103 B15R1.888 CC(=O)NCCCc1ccc(O)c(O)c1 Amb24073142 [0,2,0,0,0,0|1,0,0]=3 2104 B15R1.888 CC(=O)NCCNc1ccc(C)c(C)c1 Amb18933373 [0,2,0,0,0,0|2,0,0]=4 2105 B15R1.888 CC(=O)NCCNc1ccc(F)c(F)c1 Amb18933369 [0,2,0,0,0,0|2,0,0]=4 2106 B15R1.888 CC(=O)NCCOc1ccc(C)c(N)c1 Amb22524412 [0,2,0,0,0,0|2,0,0]=4 2107 B15R1.888 CC(=O)NCCOc1ccc(Cl)c(C)c1 Amb1089480 [0,2,0,0,0,0|2,0,0]=4 2108 B15R1.888 CC(=O)NCCOc1ccc(N)c(C)c1 Amb17132075 [0,2,0,0,0,0|2,0,0]=4 2109 B15R1.888 CC(C)=CCCCc1ccc(Cl)c(C)c1 Amb33252740 [0,2,0,0,0,0|2,0,0]=4 2110 B15R1.888 Cc1cc(CCCCC(=O)O)ccc1Cl Amb18049837 [0,2,0,0,0,0|2,0,0]=4 2111 B15R1.888 O=C(O)CCCCc1ccc(Cl)c(Cl)c1 Amb5739988 [0,2,0,0,0,0|2,0,0]=4 2112 B15R1.888 O=C(O)CCCCc1ccc(O)c(O)c1 Amb20668452 [0,2,0,0,0,0|2,0,0]=4 2113 B15R1.942 CCC(=O)CCCSc1cccc(Br)c1 Amb32682979 [0,2,0,0,0,0|2,0,0]=4 2114 B15R1.942 CCC(=O)CCCSc1cccc(C)c1 Amb32682954 [0,2,0,0,0,0|2,0,0]=4 2115 B15R1.942 CCC(=O)CCCSc1cccc(Cl)c1 Amb32682989 [0,2,0,0,0,0|2,0,0]=4 2116 B15R1.942 CCC(=O)CCCSc1cccc(F)c1 Amb32682993 [0,2,0,0,0,0|2,0,0]=4 2117 B15R1.942 COC(=O)CCNCc1cccc(Br)c1 Amb32729433 [0,2,0,0,0,0|2,0,0]=4 2118 B15R1.942 COC(=O)CCNCc1cccc(C)c1 Amb8831552 [0,2,0,0,0,0|2,0,0]=4 2119 B15R1.942 COC(=O)CCOCc1cccc(Br)c1 Amb28905992 [0,2,0,0,0,0|2,0,0]=4 2120 B15R1.942 COC(=O)CCSCc1cccc(N)c1 Amb9482068 [0,2,0,0,0,0|2,0,0]=4 2121 B15R1.942 Cc1cccc(CCCNC(=O)CCl)c1 Amb31176180 [0,2,0,0,0,0|1,0,0]=3 2122 B15R1.942 Cc1cccc(OCCNC(=O)CCl)c1 Amb2319400 [0,2,0,0,0,0|2,0,0]=4 2123 B15R1.942 O=C(CCl)NCCCc1cccc(Br)c1 Amb31176188 [0,2,0,0,0,0|1,0,0]=3 2124 B15R1.942 O=C(CCl)NCCCc1cccc(Cl)c1 Amb31176186 [0,2,0,0,0,0|1,0,0]=3 2125 B15R1.942 O=C(CCl)NCCCc1cccc(F)c1 Amb31176183 [0,2,0,0,0,0|1,0,0]=3 2126 B15R1.942 O=C(CCl)NCCOc1cccc(Cl)c1 Amb18538928 [0,2,0,0,0,0|2,0,0]=4 2127 B15R1.942 O=C(CCl)NCCOc1cccc(F)c1 Amb18538747 [0,2,0,0,0,0|2,0,0]=4 2128 B15R1.5448 CC(=O)CCCSc1cc(Cl)cc(Cl)c1 Amb32682850 [0,2,0,0,0,0|2,0,0]=4 2129 B15R1.5448 CC(=O)CCSCc1cc(C)cc(C)c1 Amb32682887 [0,2,0,0,0,0|2,0,0]=4 2130 B15R1.5448 CC(=O)NCCNc1cc(Cl)cc(Cl)c1 Amb18270413 [0,2,0,0,0,0|2,0,0]=4 2131 B15R1.5448 CC(=O)NCCOc1cc(C)cc(Br)c1 Amb23591089 [0,2,0,0,0,0|2,0,0]=4 2132 B15R1.5448 O=C(O)CCCCc1cc(O)cc(O)c1 Amb18656788 [0,2,0,0,0,0|2,0,0]=4 2133 B15R1.8263 CC(=O)CC(C)SCc1cccc(C)c1 Amb32683047 [0,2,0,0,0,0|2,0,0]=4 2134 B15R1.8263 CC(CCc1cccc(Br)c1)CC(=O)O Amb33006703 [0,2,0,0,0,0|2,0,0]=4 2135 B15R1.8263 NC(CCc1cccc(Br)c1)CC(=O)O Amb33006699 [0,2,0,0,0,0|2,0,0]=4 2136 B15R1.8263 O=C(O)CC(O)CCc1cccc(Br)c1 Amb17276795 [0,2,0,0,0,0|2,0,0]=4 2137 B15R1.8263 O=C(O)C[C@@H](O)CCc1cccc(Br)c1 Amb33006652 [0,2,0,0,0,0|2,0,0]=4 2138 B15R1.8263 O=C(O)C[C@H](O)CCc1cccc(Br)c1 Amb33006650 [0,2,0,0,0,0|2,0,0]=4 2139 B15R1.8300 Cc1cccc(OCCOS(C)(=O)=O)c1 Amb24309263 [0,2,0,0,0,0|2,0,0]=4 2140 B15R1.8448 CC(=O)CCCSc1cc(C)ccc1C Amb9283503 [0,2,0,0,0,0|2,0,0]=4 2141 B15R1.8448 CC(=O)CCCSc1cc(Cl)ccc1Cl Amb9283505 [0,2,0,0,0,0|2,0,0]=4 2142 B15R1.8448 CC(=O)CCCSc1cc(F)ccc1F Amb9283518 [0,2,0,0,0,0|2,0,0]=4 2143 B15R1.8448 CC(=O)NCCNc1cc(F)ccc1F Amb18270420 [0,2,0,0,0,0|2,0,0]=4 2144 B15R1.8448 CC(=O)NCCOc1cc(C)ccc1Cl Amb16229455 [0,2,0,0,0,0|2,0,0]=4 2145 B15R1.8448 CC(=O)NCCOc1cc(Cl)ccc1Cl Amb13950931 [0,2,0,0,0,0|2,0,0]=4 2146 B15R1.84 COc1ccccc1CCCCC(=O)O Amb18049848 [0,2,0,0,0,0|2,0,0]=4 2147 B15R1.84 COc1ccccc1OCCNC(C)=O Amb1089434 [0,2,0,0,0,0|2,0,0]=4 2148 B15R1.84 COc1ccccc1SCCCC(C)=O Amb32682853 [0,2,0,0,0,0|2,0,0]=4 2149 B15R1.130 CC(=O)CC(C)SCc1ccccc1C Amb32683050 [0,2,0,0,0,0|2,0,0]=4 2150 B15R1.130 CC(=O)CC(C)SCc1ccccc1Cl Amb32683037 [0,2,0,0,0,0|2,0,0]=4 2151 B15R1.1091 CCC(=O)CCCSc1ccccc1Br Amb32682985 [0,2,0,0,0,0|2,0,0]=4 2152 B15R1.1091 CCC(=O)CCCSc1ccccc1C Amb32682960 [0,2,0,0,0,0|2,0,0]=4 2153 B15R1.1091 CCC(=O)CCCSc1ccccc1Cl Amb32682987 [0,2,0,0,0,0|2,0,0]=4 2154 B15R1.1091 CCC(=O)CCCSc1ccccc1F Amb32682991 [0,2,0,0,0,0|2,0,0]=4 2155 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl Amb20171988 [0,2,0,0,0,0|2,0,0]=4 2156 B15R1.1091 COC(=O)CCCOc1ccccc1Br Amb8961271 [0,2,0,0,0,0|2,0,0]=4 2157 B15R1.1091 COC(=O)CCCOc1ccccc1C Amb8952306 [0,2,0,0,0,0|2,0,0]=4 2158 B15R1.1091 COC(=O)CCCOc1ccccc1Cl Amb8961212 [0,2,0,0,0,0|2,0,0]=4 2159 B15R1.1091 COC(=O)CCCOc1ccccc1F Amb8961211 [0,2,0,0,0,0|2,0,0]=4 2160 B15R1.1091 COC(=O)CCCSc1ccccc1Br Amb8961489 [0,2,0,0,0,0|2,0,0]=4 2161 B15R1.1091 Cc1ccccc1CCCNC(=O)CCl Amb31176178 [0,2,0,0,0,0|1,0,0]=3 2162 B15R1.1091 O=C(CBr)NCCOc1ccccc1Br Amb17326597 [0,2,0,0,0,0|2,0,0]=4 2163 B15R1.1091 O=C(CBr)NCCOc1ccccc1Cl Amb17330270 [0,2,0,0,0,0|2,0,0]=4 2164 B15R1.1091 O=C(CCl)NCCCc1ccccc1Cl Amb31176185 [0,2,0,0,0,0|1,0,0]=3 2165 B15R1.1091 O=C(CCl)NCCCc1ccccc1F Amb31176182 [0,2,0,0,0,0|1,0,0]=3 2166 B15R1.5821 CC(=O)CCCSc1ccc(C)cc1C Amb9283504 [0,2,0,0,0,0|2,0,0]=4 2167 B15R1.5821 CC(=O)CCCSc1ccc(Cl)cc1Cl Amb32682734 [0,2,0,0,0,0|2,0,0]=4 2168 B15R1.5821 CC(=O)CCCSc1ccc(F)cc1F Amb9283517 [0,2,0,0,0,0|2,0,0]=4 2169 B15R1.490 CC(O)(CCCC(=O)O)c1ccccc1 Amb24118040 [0,2,0,0,0,0|2,0,0]=4 2170 B15R1.882 CC(CCCC(=O)O)c1ccc(F)cc1 Amb18569059 [0,2,0,0,0,0|2,0,0]=4 2171 B15R1.882 O=C(O)CCCC(O)c1ccc(F)cc1 Amb5740038 [0,2,0,0,0,0|2,0,0]=4 2172 B15R1.882 O=C(O)CCC[C@H](O)c1ccc(F)cc1 Amb33172816 [0,2,0,0,0,0|2,0,0]=4 2173 B15R1.882 O=C([O-])CCCC(O)c1ccc(F)cc1 Amb32666210 [0,2,0,0,0,0|2,0,0]=4 2174 B15R1.882 O=C([O-])CCC[C@H](O)c1ccc(F)cc1 Amb33473729 [0,2,0,0,0,0|2,0,0]=4 2175 B15R1.959 CC(CCNC(=O)CBr)c1ccccc1 Amb17329990 [0,2,0,0,0,0|1,0,0]=3 2176 B15R1.959 CNC(=O)CCNC(C)c1ccccc1 Amb20171951 [0,2,0,0,0,0|2,0,0]=4 2177 B15R1.959 COC(=O)CCCC(=O)c1ccccc1 Amb2720741 [0,2,0,0,0,0|1,0,1]=4 2178 B15R1.959 COC(=O)CCCC(N)c1ccccc1 Amb32653382 [0,2,0,0,0,0|1,0,0]=3 2179 B15R1.959 COC(=O)CCCC(N)c1ccccc1 Amb33552526 [0,2,0,0,0,0|1,0,0]=3 2180 B15R1.959 COC(=O)CCCC(O)c1ccccc1 Amb18627401 [0,2,0,0,0,0|1,0,0]=3 2181 B15R1.959 COC(=O)CCNC(C)c1ccccc1 Amb22586709 [0,2,0,0,0,0|2,0,0]=4 2182 B15R1.959 COC(=O)CCNC(C)c1ccccc1 Amb842474 [0,2,0,0,0,0|2,0,0]=4 2183 B15R1.1078 CC(=O)OCC(=O)N(N)c1ccccc1 Amb33191331 [0,2,0,0,0,0|1,0,1]=4 2184 B15R1.5331 CCN(CCOC(C)=O)c1ccccc1 Amb4011956 [0,2,0,0,0,0|1,0,0]=3 2185 B15R1.111 CC(=O)OCC(=O)Cc1ccc(Cl)cc1 Amb32405730 [0,2,0,0,0,0|0,0,1]=3 2186 B15R1.111 CC(C)OCC(N)Cc1ccc(F)cc1 Amb32675925 [0,2,0,0,0,0|1,0,1]=4 2187 B15R1.964 CNC(=O)CCN(C)Cc1ccccc1 Amb19558615 [0,2,0,0,0,0|2,0,0]=4 2188 B15R1.964 COC(=O)CCC(N)Cc1ccccc1 Amb22059181 [0,2,0,0,0,0|1,0,0]=3 2189 B15R1.964 COC(=O)CCC(N)Cc1ccccc1 Amb28872538 [0,2,0,0,0,0|1,0,0]=3 2190 B15R1.964 COC(=O)CCN(C)Cc1ccccc1 Amb7755700 [0,2,0,0,0,0|2,0,0]=4 2191 B15R1.3675 CC(=O)C(N)CN(C)Cc1ccccc1 Amb33132284 [0,2,0,0,0,0|2,0,0]=4 2192 B15R1.4008 CC(=O)NCN(Cc1ccccc1)N=O Amb27827337 [0,2,0,0,0,0|2,0,0]=4 2193 B15R1.4008 CC(=O)OCC(CO)Cc1ccccc1 Amb32405236 [0,2,0,0,0,0|0,0,0]=2 2194 B15R1.4008 CCN(CCC(C)=O)Cc1ccccc1 Amb17403139 [0,2,0,0,0,0|2,0,0]=4 2195 B15R1.4 CC(=O)NCCNc1ccc(C#N)cc1 Amb9256139 [0,2,0,0,0,0|2,0,0]=4 2196 B15R1.4 CC(=O)NCCOc1ccc(C#N)cc1 Amb9870481 [0,2,0,0,0,0|2,0,0]=4 2197 B15R1.4 CCc1ccc(OCCNC(C)=O)cc1 Amb1098617 [0,2,0,0,0,0|2,0,0]=4 2198 B15R1.4 COc1ccc(CCCCC(=O)Cl)cc1 Amb5740001 [0,2,0,0,0,0|2,0,0]=4 2199 B15R1.4 COc1ccc(CCCCC(=O)O)cc1 Amb3992073 [0,2,0,0,0,0|2,0,0]=4 2200 B15R1.4 COc1ccc(OCCNC(C)=O)cc1 Amb6329696 [0,2,0,0,0,0|2,0,0]=4 2201 B15R1.4 COc1ccc(SCCCC(C)=O)cc1 Amb9283510 [0,2,0,0,0,0|2,0,0]=4 2202 B15R1.4 CSc1ccc(OCCNC(C)=O)cc1 Amb10790187 [0,2,0,0,0,0|2,0,0]=4 2203 B15R1.26 CCC(=O)CCCSc1ccc(Br)cc1 Amb32682983 [0,2,0,0,0,0|2,0,0]=4 2204 B15R1.26 CCC(=O)CCCSc1ccc(C)cc1 Amb32682980 [0,2,0,0,0,0|2,0,0]=4 2205 B15R1.26 CCC(=O)CCCSc1ccc(Cl)cc1 Amb32682963 [0,2,0,0,0,0|2,0,0]=4 2206 B15R1.26 CCC(=O)CCCSc1ccc(F)cc1 Amb32682992 [0,2,0,0,0,0|2,0,0]=4 2207 B15R1.26 COC(=O)CCCOc1ccc(Br)cc1 Amb8950462 [0,2,0,0,0,0|2,0,0]=4 2208 B15R1.26 COC(=O)CCCOc1ccc(C)cc1 Amb8950458 [0,2,0,0,0,0|2,0,0]=4 2209 B15R1.26 COC(=O)CCCOc1ccc(Cl)cc1 Amb2721091 [0,2,0,0,0,0|2,0,0]=4 2210 B15R1.26 COC(=O)CCCOc1ccc(F)cc1 Amb8952305 [0,2,0,0,0,0|2,0,0]=4 2211 B15R1.26 COC(=O)CCCOc1ccc(N)cc1 Amb19373667 [0,2,0,0,0,0|2,0,0]=4 2212 B15R1.26 COC(=O)CCCOc1ccc(N)cc1 Amb8960801 [0,2,0,0,0,0|2,0,0]=4 2213 B15R1.26 COC(=O)CCCSc1ccc(Br)cc1 Amb8961490 [0,2,0,0,0,0|2,0,0]=4 2214 B15R1.26 Cc1ccc(CCCNC(=O)CCl)cc1 Amb31176181 [0,2,0,0,0,0|1,0,0]=3 2215 B15R1.26 Cc1ccc(SCCNC(=O)CCl)cc1 Amb6573777 [0,2,0,0,0,0|2,0,0]=4 2216 B15R1.26 O=C(CBr)NCCOc1ccc(F)cc1 Amb17330503 [0,2,0,0,0,0|2,0,0]=4 2217 B15R1.26 O=C(CCl)NCCCc1ccc(Br)cc1 Amb31176189 [0,2,0,0,0,0|1,0,0]=3 2218 B15R1.26 O=C(CCl)NCCCc1ccc(Cl)cc1 Amb31176187 [0,2,0,0,0,0|1,0,0]=3 2219 B15R1.26 O=C(CCl)NCCCc1ccc(F)cc1 Amb31176184 [0,2,0,0,0,0|1,0,0]=3 2220 B15R1.26 O=C(CCl)NCCOc1ccc(Cl)cc1 Amb1092251 [0,2,0,0,0,0|2,0,0]=4 2221 B15R1.26 O=C(CCl)NCCOc1ccc(F)cc1 Amb18538748 [0,2,0,0,0,0|2,0,0]=4 2222 B15R1.26 O=C(CCl)NCCSc1ccc(Cl)cc1 Amb1657361 [0,2,0,0,0,0|2,0,0]=4 2223 B15R1.112 CC(=O)N(C)CCOc1ccc(N)cc1 Amb17131788 [0,2,0,0,0,0|2,0,0]=4 2224 B15R1.112 CC(CCCc1ccc(Br)cc1)C(=O)O Amb17275306 [0,2,0,0,0,0|2,0,0]=4 2225 B15R1.112 CC(CCCc1ccc(F)cc1)C(=O)O Amb17240565 [0,2,0,0,0,0|2,0,0]=4 2226 B15R1.112 Cc1ccc(CCCC(C)C(=O)O)cc1 Amb17238890 [0,2,0,0,0,0|2,0,0]=4 2227 B15R1.112 Cc1ccc(CCC[C@@H](C)C(=O)O)cc1 Amb33726960 [0,2,0,0,0,0|2,0,0]=4 2228 B15R1.112 Cc1ccc(CCC[C@H](C)C(=O)O)cc1 Amb33749022 [0,2,0,0,0,0|2,0,0]=4 2229 B15R1.112 NC(CCCc1ccc(Br)cc1)C(=O)O Amb33009477 [0,2,0,0,0,0|2,0,0]=4 2230 B15R1.112 NC(CCCc1ccc(F)cc1)C(=O)O Amb33358334 [0,2,0,0,0,0|2,0,0]=4 2231 B15R1.112 N[C@@H](CCCc1ccc(Cl)cc1)C(=O)O Amb34160714 [0,2,0,0,0,0|2,0,0]=4 2232 B15R1.112 N[C@H](CCCc1ccc(Cl)cc1)C(=O)O Amb34912483 [0,2,0,0,0,0|2,0,0]=4 2233 B15R1.112 O=C(O)C(=O)CCCc1ccc(Br)cc1 Amb33006013 [0,2,0,0,0,0|2,0,0]=4 2234 B15R1.112 O=C(O)C(=O)CCCc1ccc(F)cc1 Amb33320032 [0,2,0,0,0,0|2,0,0]=4 2235 B15R1.112 O=C(O)C(O)CCCc1ccc(Br)cc1 Amb33006024 [0,2,0,0,0,0|2,0,0]=4 2236 B15R1.112 O=C(O)C(O)CCCc1ccc(F)cc1 Amb33320012 [0,2,0,0,0,0|2,0,0]=4 2237 B15R1.870 CC(=O)CC(C)SCc1ccc(Cl)cc1 Amb32683038 [0,2,0,0,0,0|2,0,0]=4 2238 B15R1.870 CC(CCc1ccc(Br)cc1)CC(=O)O Amb28963535 [0,2,0,0,0,0|2,0,0]=4 2239 B15R1.870 CC(CCc1ccc(F)cc1)CC(=O)O Amb32954330 [0,2,0,0,0,0|2,0,0]=4 2240 B15R1.870 CC(CCc1ccc(I)cc1)CC(=O)O Amb28963534 [0,2,0,0,0,0|2,0,0]=4 2241 B15R1.870 NC(CCc1ccc(Br)cc1)CC(=O)O Amb33006021 [0,2,0,0,0,0|2,0,0]=4 2242 B15R1.870 NC(CCc1ccc(F)cc1)CC(=O)O Amb33038343 [0,2,0,0,0,0|2,0,0]=4 2243 B15R1.870 O=C(O)CC(O)CCc1ccc(Br)cc1 Amb17276796 [0,2,0,0,0,0|2,0,0]=4 2244 B15R1.870 O=C(O)CC(O)CCc1ccc(F)cc1 Amb17241115 [0,2,0,0,0,0|2,0,0]=4 2245 B15R1.870 O=C(O)C[C@@H](O)CCc1ccc(Br)cc1 Amb33006030 [0,2,0,0,0,0|2,0,0]=4 2246 B15R1.870 O=C(O)C[C@@H](O)CCc1ccc(F)cc1 Amb33226670 [0,2,0,0,0,0|2,0,0]=4 2247 B15R1.870 O=C(O)C[C@H](O)CCc1ccc(Br)cc1 Amb33006019 [0,2,0,0,0,0|2,0,0]=4 2248 B15R1.870 O=C(O)C[C@H](O)CCc1ccc(F)cc1 Amb33319980 [0,2,0,0,0,0|2,0,0]=4 2249 B15R1.909 CS(=O)(=O)OCCCc1ccc(Cl)cc1 Amb22727886 [0,2,0,0,0,0|1,0,0]=3 2250 B15R1.315 CC(C)(CBr)OCCCc1ccccc1 Amb33348287 [0,2,0,0,0,0|1,0,1]=4 2251 B15R1.315 CC(C)(CI)OCCCc1ccccc1 Amb33348463 [0,2,0,0,0,0|1,0,1]=4 2252 B15R1.741 CC(CCc1ccccc1)NC(=O)CCl Amb1644306 [0,2,0,0,0,0|1,0,0]=3 2253 B15R1.741 CC(CCc1ccccc1)NC(=O)CN Amb32428289 [0,2,0,0,0,0|1,0,0]=3 2254 B15R1.741 COC(=O)CC(=O)CCc1ccccc1 Amb17595507 [0,2,0,0,0,0|1,0,1]=4 2255 B15R1.741 COC(=O)CC(C)NCc1ccccc1 Amb9398411 [0,2,0,0,0,0|2,0,0]=4 2256 B15R1.741 COC(=O)CC(N)CCc1ccccc1 Amb32645727 [0,2,0,0,0,0|1,0,0]=3 2257 B15R1.741 COC(=O)C[C@@H](C)NCc1ccccc1 Amb28388658 [0,2,0,0,0,0|2,0,0]=4 2258 B15R1.741 COC(=O)C[C@@H](N)CCc1ccccc1 Amb33456352 [0,2,0,0,0,0|1,0,0]=3 2259 B15R1.741 COC(=O)C[C@@H](N)CCc1ccccc1 Amb33456353 [0,2,0,0,0,0|1,0,0]=3 2260 B15R1.741 COC(=O)C[C@H](N)CCc1ccccc1 Amb33456266 [0,2,0,0,0,0|1,0,0]=3 2261 B15R1.741 COC(=O)C[C@H](N)CCc1ccccc1 Amb33456271 [0,2,0,0,0,0|1,0,0]=3 2262 B15R1.741 COC(=O)OC(=O)NCc1ccccc1 Amb27605843 [0,2,0,0,0,0|1,0,1]=4 2263 B15R1.741 COC(=O)\C=C(/C)CCc1ccccc1 Amb33109888 [0,2,0,0,0,0|1,0,1]=4 2264 B15R1.741 COC(=O)\C=C(\C)CCc1ccccc1 Amb33472087 [0,2,0,0,0,0|1,0,1]=4 2265 B15R1.741 NCC(=O)OC(=O)OCc1ccccc1 Amb28074175 [0,2,0,0,0,0|1,0,1]=4 2266 B15R1.778 C#CCC(=O)CCNCc1ccccc1 Amb33131466 [0,2,0,0,0,0|2,0,0]=4 2267 B15R1.778 CCCC(=O)CCNCc1ccccc1 Amb33131468 [0,2,0,0,0,0|2,0,0]=4 2268 B15R1.778 CCCC(=O)OCCCc1ccccc1 Amb22732786 [0,2,0,0,0,0|0,0,0]=2 2269 B15R1.778 CCCC(=O)OCCOc1ccccc1 Amb21964300 [0,2,0,0,0,0|1,0,0]=3 2270 B15R1.778 CCCC(=O)OC\C=C\c1ccccc1 Amb6297856 [0,2,0,0,0,0|0,0,2]=4 2271 B15R1.778 CCOC(=O)CCCOc1ccccc1 Amb22730739 [0,2,0,0,0,0|2,0,0]=4 2272 B15R1.778 CCOC(=O)CCCSc1ccccc1 Amb19888704 [0,2,0,0,0,0|2,0,0]=4 2273 B15R1.778 CCOC(=O)CCNCc1ccccc1 Amb1930738 [0,2,0,0,0,0|2,0,0]=4 2274 B15R1.778 CCOC(=O)CCNCc1ccccc1 Amb33280205 [0,2,0,0,0,0|2,0,0]=4 2275 B15R1.778 CCOC(=O)CCOCc1ccccc1 Amb9026131 [0,2,0,0,0,0|2,0,0]=4 2276 B15R1.778 CCOC(=O)CNCCc1ccccc1 Amb6711761 [0,2,0,0,0,0|2,0,0]=4 2277 B15R1.778 CCOC(=O)NNCCc1ccccc1 Amb24103548 [0,2,0,0,0,0|2,0,0]=4 2278 B15R1.778 CNCC(=O)NCCCc1ccccc1 Amb24115171 [0,2,0,0,0,0|1,0,0]=3 2279 B15R1.778 COCC(=O)CCNCc1ccccc1 Amb33131395 [0,2,0,0,0,0|2,0,0]=4 2280 B15R1.778 C\C=C\C(=O)CCNCc1ccccc1 Amb33307195 [0,2,0,0,0,0|2,0,0]=4 2281 B15R1.778 N#CCC(=O)CCOCc1ccccc1 Amb22754626 [0,2,0,0,0,0|2,0,0]=4 2282 B15R1.778 N#CCC(=O)NCCCc1ccccc1 Amb1948524 [0,2,0,0,0,0|1,0,0]=3 2283 B15R1.778 N#CCC(=O)NCCOc1ccccc1 Amb6340294 [0,2,0,0,0,0|2,0,0]=4 2284 B15R1.778 N#CCC(=O)OCCCc1ccccc1 Amb17210530 [0,2,0,0,0,0|0,0,0]=2 2285 B15R1.778 N#CCC(=O)OCCOc1ccccc1 Amb17210529 [0,2,0,0,0,0|1,0,0]=3 2286 B15R1.778 NCCC(=O)NCCCc1ccccc1 Amb5785069 [0,2,0,0,0,0|1,0,0]=3 2287 B15R1.778 NCCC(=O)NCCOc1ccccc1 Amb17239848 [0,2,0,0,0,0|2,0,0]=4 2288 B15R1.778 O=C(CCCl)NCCCc1ccccc1 Amb9330447 [0,2,0,0,0,0|1,0,0]=3 2289 B15R1.778 O=C(CCCl)NCCOc1ccccc1 Amb17326988 [0,2,0,0,0,0|2,0,0]=4 2290 B15R1.778 O=C(CCCl)NCCSc1ccccc1 Amb10975200 [0,2,0,0,0,0|2,0,0]=4 2291 B15R1.1321 C=C(COCc1ccccc1)C(=O)OC Amb27478485 [0,2,0,0,0,0|2,0,0]=4 2292 B15R1.1321 CCC(=O)C(C)COCc1ccccc1 Amb25307969 [0,2,0,0,0,0|2,0,0]=4 2293 B15R1.1321 CCC(=O)[C@@H](C)COCc1ccccc1 Amb26622039 [0,2,0,0,0,0|2,0,0]=4 2294 B15R1.1321 CN(CCCc1ccccc1)C(=O)CCl Amb9451843 [0,2,0,0,0,0|1,0,0]=3 2295 B15R1.1321 CN(CCCc1ccccc1)C(=O)CN Amb9452004 [0,2,0,0,0,0|1,0,0]=3 2296 B15R1.1321 CN(CCOc1ccccc1)C(=O)CCl Amb17331635 [0,2,0,0,0,0|2,0,0]=4 2297 B15R1.1321 CN(CCOc1ccccc1)C(=O)CN Amb17239847 [0,2,0,0,0,0|2,0,0]=4 2298 B15R1.1321 COC(=O)C(Br)COCc1ccccc1 Amb26452853 [0,2,0,0,0,0|2,0,0]=4 2299 B15R1.1321 COC(=O)C(C)CCCc1ccccc1 Amb8392134 [0,2,0,0,0,0|1,0,0]=3 2300 B15R1.1321 COC(=O)C(C)CNCc1ccccc1 Amb2725270 [0,2,0,0,0,0|2,0,0]=4 2301 B15R1.1321 COC(=O)C(C)COCc1ccccc1 Amb9399794 [0,2,0,0,0,0|2,0,0]=4 2302 B15R1.1321 COC(=O)C(I)CNCc1ccccc1 Amb28047499 [0,2,0,0,0,0|2,0,0]=4 2303 B15R1.1321 COC(=O)C(N)CCCc1ccccc1 Amb34912861 [0,2,0,0,0,0|1,0,0]=3 2304 B15R1.1321 COC(=O)C(N)CCNc1ccccc1 Amb32993447 [0,2,0,0,0,0|2,0,0]=4 2305 B15R1.1321 COC(=O)C(N)CCSc1ccccc1 Amb33802740 [0,2,0,0,0,0|2,0,0]=4 2306 B15R1.1321 COC(=O)C(N)COCc1ccccc1 Amb24081016 [0,2,0,0,0,0|2,0,0]=4 2307 B15R1.1321 COC(=O)C(O)CCCc1ccccc1 Amb28963669 [0,2,0,0,0,0|1,0,0]=3 2308 B15R1.1321 COC(=O)C(O)COCc1ccccc1 Amb22641879 [0,2,0,0,0,0|2,0,0]=4 2309 B15R1.1321 COC(=O)[C@@H](C)CNCc1ccccc1 Amb27466484 [0,2,0,0,0,0|2,0,0]=4 2310 B15R1.1321 COC(=O)[C@@H](C)COCc1ccccc1 Amb26332074 [0,2,0,0,0,0|2,0,0]=4 2311 B15R1.1321 COC(=O)[C@@H](N)COCc1ccccc1 Amb10844864 [0,2,0,0,0,0|2,0,0]=4 2312 B15R1.1321 COC(=O)[C@@H](N)COCc1ccccc1 Amb22746151 [0,2,0,0,0,0|2,0,0]=4 2313 B15R1.1321 COC(=O)[C@@H](N)CSCc1ccccc1 Amb16183933 [0,2,0,0,0,0|2,0,0]=4 2314 B15R1.1321 COC(=O)[C@@H](N)CSCc1ccccc1 Amb19944285 [0,2,0,0,0,0|2,0,0]=4 2315 B15R1.1321 COC(=O)[C@@H](O)CNCc1ccccc1 Amb27604331 [0,2,0,0,0,0|2,0,0]=4 2316 B15R1.1321 COC(=O)[C@@H](O)COCc1ccccc1 Amb2697757 [0,2,0,0,0,0|2,0,0]=4 2317 B15R1.1321 COC(=O)[C@H](N)CCCc1ccccc1 Amb34912871 [0,2,0,0,0,0|1,0,0]=3 2318 B15R1.1321 COC(=O)[C@H](O)COCc1ccccc1 Amb17617212 [0,2,0,0,0,0|2,0,0]=4 2319 B15R1.3678 CC(=O)C(N)C(C)OCc1ccccc1 Amb33132357 [0,2,0,0,0,0|2,0,0]=4 2320 B15R1.3678 CC(=O)[C@H](N)[C@H](C)OCc1ccccc1 Amb33132342 [0,2,0,0,0,0|2,0,0]=4 2321 B15R1.5336 CCC(CC(C)=O)NCc1ccccc1 Amb27612832 [0,2,0,0,0,0|2,0,0]=4 2322 B15R1.12240 CC(C)(CCc1ccccc1)CC(=O)O Amb32413149 [0,2,0,0,0,0|2,0,0]=4 2323 B15R1.9012 CC(=O)C(C)(C)CNCc1ccccc1 Amb27830105 [0,2,0,0,0,0|2,0,0]=4 2324 B15R1.9012 CC(C)(CCCc1ccccc1)C(=O)O Amb33531413 [0,2,0,0,0,0|2,0,0]=4 2325 B13R2.1 CCNC1CCc2ccccc21 Amb10610131 [1,0,0,1,0,0|1,0,1]=4 2326 B13R2.1 CCNC1CCc2ccccc21 Amb9722140 [1,0,0,1,0,0|1,0,1]=4 2327 B13R2.1 CCSC1CCc2ccccc21 Amb27220071 [1,0,0,1,0,0|0,1,1]=4 2328 B13R2.1 CNCC1CCc2ccccc21 Amb17470428 [1,0,0,1,0,0|2,0,0]=4 2329 B13R2.1 CONC1CCc2ccccc21 Amb27470590 [1,0,0,1,0,0|2,0,0]=4 2330 B13R2.1 O=C=NC1CCc2ccccc21 Amb27635843 [1,0,0,1,0,0|1,0,1]=4 2331 B13R2.1 O=C=N[C@H]1CCc2ccccc21 Amb10807458 [1,0,0,1,0,0|1,0,1]=4 2332 B13R2.1 O=CCC1CCc2ccccc21 Amb26865434 [1,0,0,1,0,0|1,0,0]=3 2333 B13R2.1 O=CN[C@@H]1CCc2ccccc21 Amb27478053 [1,0,0,1,0,0|1,0,0]=3 2334 B13R2.1 O=COC1CNc2ccccc21 Amb28052802 [1,0,0,1,0,0|1,0,0]=3 2335 B13R2.1 O=C\C=C1/CCc2ccccc21 Amb28397447 [1,0,0,1,0,0|1,0,1]=4 2336 B13R2.3 C1=CC(c2ccccc2)CCC1 Amb4035356 [1,0,0,1,0,0|1,0,1]=4 2337 B13R2.3 C1=CC(c2ccccc2)CC[NH2+]1 Amb24080270 [1,0,0,1,0,0|1,0,1]=4 2338 B13R2.3 C1=COC(c2ccccc2)CC1 Amb26038784 [1,0,0,1,0,0|1,0,1]=4 2339 B13R2.3 c1ccc(C2CCCCC2)cc1 Amb6357376 [1,0,0,1,0,0|1,0,1]=4 2340 B13R2.3 c1ccc(C2CCCNC2)cc1 Amb1995213 [1,0,0,1,0,0|2,0,0]=4 2341 B13R2.3 c1ccc(C2CCCNC2)cc1 Amb2236473 [1,0,0,1,0,0|2,0,0]=4 2342 B13R2.3 c1ccc(C2CCNCC2)cc1 Amb1019521 [1,0,0,1,0,0|1,0,1]=4 2343 B13R2.3 c1ccc(C2CCNCC2)cc1 Amb2099643 [1,0,0,1,0,0|1,0,1]=4 2344 B13R2.3 c1ccc(C2CCOCC2)cc1 Amb21856446 [1,0,0,1,0,0|0,0,1]=3 2345 B13R2.3 c1ccc(C2CCOCC2)nc1 Amb10573557 [1,0,0,1,0,0|1,0,1]=4 2346 B13R2.3 c1ccc(C2CCOCN2)cc1 Amb32751745 [1,0,0,1,0,0|1,0,1]=4 2347 B13R2.3 c1ccc(C2CCOCO2)cc1 Amb6357160 [1,0,0,1,0,0|0,0,2]=4 2348 B13R2.3 c1ccc(N2CCOCC2)cc1 Amb1019547 [1,0,0,1,0,0|1,0,1]=4 2349 B13R2.3 c1ccc([C@@H]2CCCNC2)cc1 Amb19888364 [1,0,0,1,0,0|2,0,0]=4 2350 B13R2.3 c1ccc([C@@H]2CCOCO2)cc1 Amb22226715 [1,0,0,1,0,0|0,0,2]=4 2351 B13R2.3 c1ccc([C@H]2CCCNC2)cc1 Amb19888168 [1,0,0,1,0,0|2,0,0]=4 2352 B13R2.3 c1ccc([C@H]2CCCNC2)cc1 Amb22755507 [1,0,0,1,0,0|2,0,0]=4 2353 B13R2.3 c1ccc([C@H]2CCOCO2)cc1 Amb27425306 [1,0,0,1,0,0|0,0,2]=4 2354 B13R2.3 c1cncc(C2CCOCC2)c1 Amb24320765 [1,0,0,1,0,0|1,0,1]=4 2355 B13R2.15 CC1CCCC1c2ccccc2 Amb28060308 [1,0,0,1,0,0|1,0,1]=4 2356 B13R2.15 CC1NCCC1c2ccccc2 Amb18279882 [1,0,0,1,0,0|1,0,1]=4 2357 B13R2.15 CC1OCNC1c2ccccc2 Amb27614663 [1,0,0,1,0,0|1,0,1]=4 2358 B13R2.15 CN1CCC[C@@H]1c2ccccc2 Amb25817229 [1,0,0,1,0,0|2,0,0]=4 2359 B13R2.15 CN1CCC[C@H]1c2ccccc2 Amb27603452 [1,0,0,1,0,0|2,0,0]=4 2360 B13R2.15 C[C@@H]1NCCC1c2ccccc2 Amb27616689 [1,0,0,1,0,0|1,0,1]=4 2361 B13R2.15 C[C@@H]1NCC[C@H]1c2ccccc2 Amb27420012 [1,0,0,1,0,0|1,0,1]=4 2362 B13R2.15 C[C@@H]1OCN[C@H]1c2ccccc2 Amb28385033 [1,0,0,1,0,0|1,0,1]=4 2363 B13R2.15 C[C@H]1OCN[C@H]1c2ccccc2 Amb27441110 [1,0,0,1,0,0|1,0,1]=4 2364 B13R2.15 N=C1NCCC1c2ccccc2 Amb27791860 [1,0,0,1,0,0|2,0,0]=4 2365 B13R2.15 O=C1CCCC1c2ccccc2 Amb17940271 [1,0,0,1,0,0|1,0,0]=3 2366 B13R2.15 O=C1CCCC1c2ccccn2 Amb2793693 [1,0,0,1,0,0|2,0,0]=4 2367 B13R2.15 O=C1CCCC1c2ccccn2 Amb32652718 [1,0,0,1,0,0|2,0,0]=4 2368 B13R2.15 O=C1CCCC1c2cccnc2 Amb18797977 [1,0,0,1,0,0|2,0,0]=4 2369 B13R2.15 O=C1CCCN1c2ccccc2 Amb6357467 [1,0,0,1,0,0|2,0,0]=4 2370 B13R2.15 O=C1CCC[C@H]1c2ccccc2 Amb27175855 [1,0,0,1,0,0|1,0,0]=3 2371 B13R2.15 O=C1CCNC1c2ccccc2 Amb18829957 [1,0,0,1,0,0|2,0,0]=4 2372 B13R2.15 O=C1CCNC1c2ccccc2 Amb22901061 [1,0,0,1,0,0|2,0,0]=4 2373 B13R2.15 O=C1CCOC1c2ccccc2 Amb27177705 [1,0,0,1,0,0|2,0,0]=4 2374 B13R2.15 O=C1COCC1c2ccccc2 Amb23590154 [1,0,0,1,0,0|2,0,0]=4 2375 B13R2.15 O=C1NCCC1c2ccccc2 Amb17400090 [1,0,0,1,0,0|1,0,0]=3 2376 B13R2.15 O=C1NCCN1c2ccccc2 Amb2695649 [1,0,0,1,0,0|2,0,0]=4 2377 B13R2.15 O=C1NCC[C@@H]1c2ccccc2 Amb28316759 [1,0,0,1,0,0|1,0,0]=3 2378 B13R2.15 O=C1NCC[C@H]1c2ccccc2 Amb27852446 [1,0,0,1,0,0|1,0,0]=3 2379 B13R2.15 O=C1NCOC1c2ccccc2 Amb28243816 [1,0,0,1,0,0|2,0,0]=4 2380 B13R2.15 O=C1OCCC1c2ccccc2 Amb10606603 [1,0,0,1,0,0|0,0,0]=2 2381 B13R2.15 O=C1OCCC1c2ccccn2 Amb22757402 [1,0,0,1,0,0|1,0,0]=3 2382 B13R2.15 O=C1OCCC1c2cccnc2 Amb22757403 [1,0,0,1,0,0|1,0,0]=3 2383 B13R2.15 O=C1OCCC1c2ccncc2 Amb22757401 [1,0,0,1,0,0|1,0,0]=3 2384 B13R2.15 O=C1OCCN1c2ccccc2 Amb2721031 [1,0,0,1,0,0|1,0,0]=3 2385 B13R2.15 O=C1ON=CC1c2ccccc2 Amb25891987 [1,0,0,1,0,0|1,0,1]=4 2386 B13R2.15 OC1OCCC1c2ccccc2 Amb22752503 [1,0,0,1,0,0|0,0,2]=4 2387 B13R2.25 C=CCC1CC1c2ccccc2 Amb26386415 [1,0,0,1,0,0|1,0,1]=4 2388 B13R2.25 C=CC[C@@H]1C[C@H]1c2ccccc2 Amb32667547 [1,0,0,1,0,0|1,0,1]=4 2389 B13R2.25 CCNC1CC1c2ccccc2 Amb18983170 [1,0,0,1,0,0|1,0,1]=4 2390 B13R2.25 CCN[C@@H]1C[C@H]1c2ccccc2 Amb27814227 [1,0,0,1,0,0|1,0,1]=4 2391 B13R2.25 CCN[C@H]1C[C@@H]1c2ccccc2 Amb28457419 [1,0,0,1,0,0|1,0,1]=4 2392 B13R2.25 CNCC1CC1c2ccccc2 Amb17568106 [1,0,0,1,0,0|2,0,0]=4 2393 B13R2.25 CNC[C@@H]1C[C@@H]1c2ccccc2 Amb27434473 [1,0,0,1,0,0|2,0,0]=4 2394 B13R2.25 CNC[C@@H]1C[C@H]1c2ccccc2 Amb29837831 [1,0,0,1,0,0|2,0,0]=4 2395 B13R2.25 CONC1CC1c2ccccc2 Amb28126379 [1,0,0,1,0,0|2,0,0]=4 2396 B13R2.25 CSC[C@@H]1C[C@H]1c2ccccc2 Amb28183079 [1,0,0,1,0,0|2,0,0]=4 2397 B13R2.25 O=C=NC1CC1c2ccccc2 Amb17232284 [1,0,0,1,0,0|1,0,1]=4 2398 B13R2.25 O=C=N[C@@H]1C[C@@H]1c2ccccc2 Amb27210554 [1,0,0,1,0,0|1,0,1]=4 2399 B13R2.25 O=C=N[C@H]1C[C@@H]1c2ccccc2 Amb26425948 [1,0,0,1,0,0|1,0,1]=4 2400 B13R2.25 O=CCC1CC1c2ccccc2 Amb28243837 [1,0,0,1,0,0|1,0,0]=3 2401 B13R2.25 O=CC[C@@H]1C[C@@H]1c2ccccc2 Amb34915327 [1,0,0,1,0,0|1,0,0]=3 2402 B13R2.25 O=CC[C@@H]1C[C@H]1c2ccccc2 Amb32667655 [1,0,0,1,0,0|1,0,0]=3 2403 B13R2.27 O=C1CCC1Cc2ccccc2 Amb27177755 [1,0,0,1,0,0|1,0,0]=3 2404 B13R2.27 O=C1CCN1Cc2ccccc2 Amb25117461 [1,0,0,1,0,0|2,0,0]=4 2405 B13R2.27 O=C1COC1Cc2ccccc2 Amb35789727 [1,0,0,1,0,0|2,0,0]=4 2406 B13R2.27 O=C1NCC1Cc2ccccc2 Amb27855620 [1,0,0,1,0,0|1,0,0]=3 2407 B13R2.50 O=CC1CC1Cc2ccccc2 Amb24537604 [1,0,0,1,0,0|1,0,0]=3 2408 B13R2.50 O=C[C@@H]1C[C@H]1Oc2ccccc2 Amb27257945 [1,0,0,1,0,0|2,0,0]=4 2409 B13R2.50 O=C[C@@H]1C[C@H]1Sc2ccccc2 Amb28400027 [1,0,0,1,0,0|2,0,0]=4 2410 B13R2.56 CNC1CCC1c2ccccc2 Amb27858960 [1,0,0,1,0,0|2,0,0]=4 2411 B13R2.56 O=CC1CCC1c2ccccc2 Amb28290504 [1,0,0,1,0,0|1,0,0]=3 2412 B13R2.56 O=C[C@@H]1CC[C@@H]1c2ccccc2 Amb26951878 [1,0,0,1,0,0|1,0,0]=3 2413 B13R2.56 O=C[C@@H]1CC[C@H]1c2ccccc2 Amb26935631 [1,0,0,1,0,0|1,0,0]=3 2414 B13R2.56 O=C[C@H]1CC[C@H]1c2ccccc2 Amb26388586 [1,0,0,1,0,0|1,0,0]=3 2415 B13R2.64 C1=CCC(Cc2ccccc2)C1 Amb29888235 [1,0,0,1,0,0|1,0,0]=3 2416 B13R2.64 C1=CCC(Cc2cccnc2)C1 Amb29888236 [1,0,0,1,0,0|2,0,0]=4 2417 B13R2.64 C1=CCN(Cc2ccccc2)C1 Amb9820128 [1,0,0,1,0,0|2,0,0]=4 2418 B13R2.64 C1=N[C@@H](Cc2ccccc2)CN1 Amb27475965 [1,0,0,1,0,0|2,0,0]=4 2419 B13R2.64 C1=N[C@H](Cc2ccccc2)CN1 Amb27834345 [1,0,0,1,0,0|2,0,0]=4 2420 B13R2.64 c1ccc(CC2CCNC2)cc1 Amb24097496 [1,0,0,1,0,0|1,0,1]=4 2421 B13R2.64 c1ccc(CC2CCNC2)cc1 Amb3940960 [1,0,0,1,0,0|1,0,1]=4 2422 B13R2.64 c1ccc(CC2CCOC2)cc1 Amb27770987 [1,0,0,1,0,0|0,0,1]=3 2423 B13R2.64 c1ccc(CC2COCN2)cc1 Amb18563410 [1,0,0,1,0,0|1,0,1]=4 2424 B13R2.64 c1ccc(CN2CCOC2)cc1 Amb22229191 [1,0,0,1,0,0|1,0,1]=4 2425 B13R2.64 c1ccc(C[C@H]2COCN2)cc1 Amb27634861 [1,0,0,1,0,0|1,0,1]=4 2426 B13R2.64 c1ccc(NC2CCOC2)cc1 Amb25310936 [1,0,0,1,0,0|1,0,1]=4 2427 B13R2.64 c1ccc(NC2CCOC2)cc1 Amb32729444 [1,0,0,1,0,0|1,0,1]=4 2428 B13R2.67 c1ccc2c(c1)CCCCCC2 Amb6359536 [1,0,0,1,0,0|1,0,1]=4 2429 B13R2.67 c1ccc2c(c1)CCCCNC2 Amb27616673 [1,0,0,1,0,0|2,0,0]=4 2430 B13R2.67 c1ccc2c(c1)CCCNCC2 Amb28246443 [1,0,0,1,0,0|1,0,1]=4 2431 B13R2.1028 CCCCC1Cc2ccccc21 Amb17758498 [1,0,0,1,0,0|1,0,1]=4 2432 B13R2.1028 CCNCC1Cc2ccccc21 Amb18289168 [1,0,0,1,0,0|1,0,1]=4 2433 B13R2.1028 O=CNCC1Cc2ccccc21 Amb28045219 [1,0,0,1,0,0|1,0,0]=3 2434 B13R2.1613 C=CC1CCCc2ccccc21 Amb33358312 [1,0,0,1,0,0|1,0,1]=4 2435 B13R2.1613 CNC1CCCc2ccccc21 Amb6892384 [1,0,0,1,0,0|2,0,0]=4 2436 B13R2.1613 CNC1CCCc2ccccc21 Amb9703046 [1,0,0,1,0,0|2,0,0]=4 2437 B13R2.1613 CN[C@@H]1CCCc2ccccc21 Amb20241467 [1,0,0,1,0,0|2,0,0]=4 2438 B13R2.1613 COC1CCCc2ccccc21 Amb2228261 [1,0,0,1,0,0|2,0,0]=4 2439 B13R2.1613 O=CC1=CCCc2ccccc21 Amb18645053 [1,0,0,1,0,0|1,0,1]=4 2440 B13R2.1613 O=CC1CCCc2ccccc21 Amb18787961 [1,0,0,1,0,0|1,0,0]=3 2441 B13R2.1613 O=CC1CCOc2ccccc21 Amb20622857 [1,0,0,1,0,0|2,0,0]=4 2442 B13R2.1613 O=CC1COCc2ccccc21 Amb25992611 [1,0,0,1,0,0|2,0,0]=4 2443 B13R2.1613 O=CC1NCCc2ccccc21 Amb28125733 [1,0,0,1,0,0|2,0,0]=4 2444 B13R2.1613 O=CC1OCCc2ccccc21 Amb18645642 [1,0,0,1,0,0|2,0,0]=4 2445 B13R2.1613 O=CN1CCCc2ccccc21 Amb2701277 [1,0,0,1,0,0|1,0,0]=3 2446 B13R2.1613 O=C[C@H]1OCCc2ccccc21 Amb28144164 [1,0,0,1,0,0|2,0,0]=4 2447 B13R2.2382 c1ccc(CCCC2CO2)cc1 Amb32952083 [1,0,0,1,0,0|2,0,0]=4 2448 B13R2.2383 c1ccc(CCC2CCN2)cc1 Amb26353890 [1,0,0,1,0,0|1,0,1]=4 2449 B13R2.2383 c1ccc(CCC2CNC2)cc1 Amb25266065 [1,0,0,1,0,0|2,0,0]=4 2450 B13R2.5252 C=C1CCCCc2ccccc21 Amb23400875 [1,0,0,1,0,0|1,0,1]=4 2451 B13R2.5252 CC1=CCCCc2ccccc21 Amb27986008 [1,0,0,1,0,0|1,0,0]=3 2452 B13R2.5252 CC1=CCCNc2ccccc21 Amb28077152 [1,0,0,1,0,0|2,0,0]=4 2453 B13R2.5252 CC1NCCCc2ccccc21 Amb25685960 [1,0,0,1,0,0|1,0,1]=4 2454 B13R2.5252 CN1CCCCc2ccccc21 Amb6359492 [1,0,0,1,0,0|2,0,0]=4 2455 B13R2.5252 O=C1CCCCc2ccccc21 Amb1208402 [1,0,0,1,0,0|1,0,0]=3 2456 B13R2.5252 O=C1CCCNc2ccccc21 Amb2690546 [1,0,0,1,0,0|2,0,0]=4 2457 B13R2.5252 O=C1CCCOc2ccccc21 Amb33545871 [1,0,0,1,0,0|2,0,0]=4 2458 B13R2.5252 O=C1CCCSc2ccccc21 Amb33545887 [1,0,0,1,0,0|2,0,0]=4 2459 B13R2.5252 O=C1CCNCc2ccccc21 Amb22499160 [1,0,0,1,0,0|2,0,0]=4 2460 B13R2.5252 O=C1CCNCc2ccccc21 Amb32405167 [1,0,0,1,0,0|2,0,0]=4 2461 B13R2.5252 O=C1CCSCc2ccccc21 Amb27177930 [1,0,0,1,0,0|2,0,0]=4 2462 B13R2.5252 O=C1CNCCc2ccccc21 Amb27389469 [1,0,0,1,0,0|2,0,0]=4 2463 B13R2.5252 O=C1CSCCc2ccccc21 Amb20668935 [1,0,0,1,0,0|2,0,0]=4 2464 B13R2.5252 O=C1NCCCc2ccccc21 Amb33544472 [1,0,0,1,0,0|1,0,0]=3 2465 B13R2.5252 O=C1NCCCc2cnccc21 Amb27755727 [1,0,0,1,0,0|2,0,0]=4 2466 B13R2.5252 O=C1NCCNc2ccccc21 Amb19958708 [1,0,0,1,0,0|2,0,0]=4 2467 B13R2.5252 O=C1NCCOc2ccccc21 Amb2445337 [1,0,0,1,0,0|2,0,0]=4 2468 B13R2.5252 O=C1NCCSc2ccccc21 Amb6360540 [1,0,0,1,0,0|2,0,0]=4 2469 B13R2.5252 O=C1OCCNc2ccncc21 Amb27770034 [1,0,0,1,0,0|2,0,0]=4 2470 B13R2.10 BrC1CCC(c2ccccc2)C1 Amb28123862 [0,0,0,1,1,0|1,0,1]=4 2471 B13R2.10 CC1=NC(c2ccccc2)CN1 Amb28071281 [0,0,0,1,1,0|2,0,0]=4 2472 B13R2.10 CC1=NN(c2ccccc2)CC1 Amb2613383 [0,0,0,1,1,0|2,0,0]=4 2473 B13R2.10 CC1NC(c2ccccc2)CO1 Amb27790805 [0,0,0,1,1,0|1,0,1]=4 2474 B13R2.10 CN1CC[C@@H](c2ccccc2)C1 Amb26877498 [0,0,0,1,1,0|2,0,0]=4 2475 B13R2.10 CN1CC[C@H](c2ccccc2)C1 Amb27227886 [0,0,0,1,1,0|2,0,0]=4 2476 B13R2.10 C[C@@H]1CCC(c2ccccc2)N1 Amb30633699 [0,0,0,1,1,0|1,0,1]=4 2477 B13R2.10 C[C@@H]1CC[C@H](c2ccccc2)N1 Amb28135456 [0,0,0,1,1,0|1,0,1]=4 2478 B13R2.10 C[C@H]1CCC(c2ccccc2)N1 Amb33801332 [0,0,0,1,1,0|1,0,1]=4 2479 B13R2.10 C[C@H]1CC[C@H](c2ccccc2)N1 Amb27631396 [0,0,0,1,1,0|1,0,1]=4 2480 B13R2.10 FC1CCC(c2ccccc2)C1 Amb27163345 [0,0,0,1,1,0|1,0,1]=4 2481 B13R2.10 N=C1N[C@@H](c2ccccc2)CO1 Amb25326051 [0,0,0,1,1,0|2,0,0]=4 2482 B13R2.10 NC1=NC(c2ccccc2)CO1 Amb33548336 [0,0,0,1,1,0|2,0,0]=4 2483 B13R2.10 NC1=N[C@H](c2ccccc2)CO1 Amb26946059 [0,0,0,1,1,0|2,0,0]=4 2484 B13R2.10 NC1CCC(c2ccccc2)C1 Amb17400101 [0,0,0,1,1,0|1,0,1]=4 2485 B13R2.10 NC1CCC(c2ccccc2)C1 Amb28555798 [0,0,0,1,1,0|1,0,1]=4 2486 B13R2.10 NN1CCC(c2ccccc2)C1 Amb26605785 [0,0,0,1,1,0|2,0,0]=4 2487 B13R2.10 N[C@@H]1CC[C@H](c2ccccc2)C1 Amb26394038 [0,0,0,1,1,0|1,0,1]=4 2488 B13R2.10 N[C@H]1CC[C@@H](c2ccccc2)C1 Amb27660989 [0,0,0,1,1,0|1,0,1]=4 2489 B13R2.10 N[C@H]1CC[C@@H](c2ccccc2)C1 Amb32663166 [0,0,0,1,1,0|1,0,1]=4 2490 B13R2.10 N[C@H]1CC[C@H](c2ccccc2)C1 Amb27449247 [0,0,0,1,1,0|1,0,1]=4 2491 B13R2.10 O=C1C=C(c2ccccc2)CC1 Amb10669546 [0,0,0,1,1,0|0,0,2]=4 2492 B13R2.10 O=C1C=C(c2ccccc2)CO1 Amb24633865 [0,0,0,1,1,0|0,0,2]=4 2493 B13R2.10 O=C1C=C[C@H](c2ccccc2)C1 Amb27177992 [0,0,0,1,1,0|0,0,2]=4 2494 B13R2.10 O=C1CC(c2ccccc2)=NO1 Amb622006 [0,0,0,1,1,0|1,0,1]=4 2495 B13R2.10 O=C1CC(c2ccccc2)CN1 Amb1772919 [0,0,0,1,1,0|1,0,0]=3 2496 B13R2.10 O=C1CC(c2ccccc2)CO1 Amb28280068 [0,0,0,1,1,0|0,0,0]=2 2497 B13R2.10 O=C1CC(c2ccccc2)NN1 Amb9798684 [0,0,0,1,1,0|2,0,0]=4 2498 B13R2.10 O=C1CC(c2ccccn2)CN1 Amb13952281 [0,0,0,1,1,0|2,0,0]=4 2499 B13R2.10 O=C1CC(c2cccnc2)CN1 Amb13783612 [0,0,0,1,1,0|2,0,0]=4 2500 B13R2.10 O=C1CC(c2ccncc2)CN1 Amb17400108 [0,0,0,1,1,0|2,0,0]=4 2501 B13R2.10 O=C1CCC(c2ccccc2)C1 Amb17138497 [0,0,0,1,1,0|0,0,0]=2 2502 B13R2.10 O=C1CCC(c2ccccc2)N1 Amb17470413 [0,0,0,1,1,0|1,0,0]=3 2503 B13R2.10 O=C1CCC(c2ccccc2)O1 Amb4393092 [0,0,0,1,1,0|1,0,0]=3 2504 B13R2.10 O=C1CCC(c2ccccn2)C1 Amb17138526 [0,0,0,1,1,0|1,0,0]=3 2505 B13R2.10 O=C1CCC(c2cccnc2)C1 Amb17138527 [0,0,0,1,1,0|1,0,0]=3 2506 B13R2.10 O=C1CCC(c2ccncc2)C1 Amb17138528 [0,0,0,1,1,0|1,0,0]=3 2507 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb32410134 [0,0,0,1,1,0|1,0,0]=3 2508 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb33528256 [0,0,0,1,1,0|1,0,0]=3 2509 B13R2.10 O=C1CCN(c2ccccc2)N1 Amb6315525 [0,0,0,1,1,0|2,0,0]=4 2510 B13R2.10 O=C1CCN(c2ccncc2)C1 Amb23449311 [0,0,0,1,1,0|2,0,0]=4 2511 B13R2.10 O=C1CC[C@@H](c2ccccc2)C1 Amb24323281 [0,0,0,1,1,0|0,0,0]=2 2512 B13R2.10 O=C1CC[C@@H](c2ccccc2)N1 Amb27242426 [0,0,0,1,1,0|1,0,0]=3 2513 B13R2.10 O=C1CC[C@@H](c2cccnc2)N1 Amb27389343 [0,0,0,1,1,0|2,0,0]=4 2514 B13R2.10 O=C1CC[C@H](c2ccccc2)C1 Amb24484347 [0,0,0,1,1,0|0,0,0]=2 2515 B13R2.10 O=C1CC[C@H](c2ccccc2)N1 Amb27227911 [0,0,0,1,1,0|1,0,0]=3 2516 B13R2.10 O=C1CC[C@H](c2ccccc2)O1 Amb28437127 [0,0,0,1,1,0|1,0,0]=3 2517 B13R2.10 O=C1CNC(c2ccccc2)O1 Amb26032124 [0,0,0,1,1,0|2,0,0]=4 2518 B13R2.10 O=C1COC(c2ccccn2)C1 Amb35718935 [0,0,0,1,1,0|2,0,0]=4 2519 B13R2.10 O=C1COC(c2cccnc2)C1 Amb29866228 [0,0,0,1,1,0|2,0,0]=4 2520 B13R2.10 O=C1COC(c2ccncc2)C1 Amb29866229 [0,0,0,1,1,0|2,0,0]=4 2521 B13R2.10 O=C1CSC(c2ccccc2)N1 Amb2221753 [0,0,0,1,1,0|2,0,0]=4 2522 B13R2.10 O=C1CSC(c2ccccc2)O1 Amb25793869 [0,0,0,1,1,0|2,0,0]=4 2523 B13R2.10 O=C1C[C@@H](c2ccccc2)CN1 Amb25277165 [0,0,0,1,1,0|1,0,0]=3 2524 B13R2.10 O=C1C[C@@H](c2ccccc2)CO1 Amb27451585 [0,0,0,1,1,0|0,0,0]=2 2525 B13R2.10 O=C1C[C@H](c2ccccc2)CN1 Amb23401452 [0,0,0,1,1,0|1,0,0]=3 2526 B13R2.10 O=C1NC(c2ccccc2)CO1 Amb6346517 [0,0,0,1,1,0|1,0,0]=3 2527 B13R2.10 O=C1NC(c2ccccc2)CS1 Amb23439132 [0,0,0,1,1,0|1,1,0]=4 2528 B13R2.10 O=C1NC(c2ccccn2)CO1 Amb27828129 [0,0,0,1,1,0|2,0,0]=4 2529 B13R2.10 O=C1NC(c2cccnc2)CO1 Amb26970930 [0,0,0,1,1,0|2,0,0]=4 2530 B13R2.10 O=C1NC(c2ccncc2)CO1 Amb26484901 [0,0,0,1,1,0|2,0,0]=4 2531 B13R2.10 O=C1NCC(c2ccccc2)N1 Amb22056050 [0,0,0,1,1,0|2,0,0]=4 2532 B13R2.10 O=C1NCC(c2ccccc2)O1 Amb16232576 [0,0,0,1,1,0|2,0,0]=4 2533 B13R2.10 O=C1NCC(c2ccccc2)S1 Amb27614799 [0,0,0,1,1,0|2,0,0]=4 2534 B13R2.10 O=C1NC[C@@H](c2ccccc2)O1 Amb24574681 [0,0,0,1,1,0|2,0,0]=4 2535 B13R2.10 O=C1N[C@@H](c2ccccc2)CO1 Amb6295901 [0,0,0,1,1,0|1,0,0]=3 2536 B13R2.10 O=C1N[C@@H](c2ccccc2)CS1 Amb28143674 [0,0,0,1,1,0|1,1,0]=4 2537 B13R2.10 O=C1N[C@@H](c2ccccn2)CO1 Amb27783384 [0,0,0,1,1,0|2,0,0]=4 2538 B13R2.10 O=C1N[C@H](c2ccccc2)CO1 Amb6295900 [0,0,0,1,1,0|1,0,0]=3 2539 B13R2.10 O=C1N[C@H](c2ccccc2)CS1 Amb24653499 [0,0,0,1,1,0|1,1,0]=4 2540 B13R2.10 O=C1N[C@H](c2cccnc2)CO1 Amb27389439 [0,0,0,1,1,0|2,0,0]=4 2541 B13R2.10 O=C1OCC(c2ccccc2)O1 Amb27790954 [0,0,0,1,1,0|1,0,0]=3 2542 B13R2.10 O=S1CCC(c2ccccc2)C1 Amb27404989 [0,0,0,1,1,0|1,0,0]=3 2543 B13R2.10 OC1=NCC(c2ccccc2)C1 Amb19866679 [0,0,0,1,1,0|1,0,1]=4 2544 B13R2.10 OC1CC(c2ccccc2)CO1 Amb22752509 [0,0,0,1,1,0|0,0,2]=4 2545 B13R2.10 OC1CCC(c2ccccc2)C1 Amb17400115 [0,0,0,1,1,0|0,0,2]=4 2546 B13R2.10 O[C@@H]1CC[C@@H](c2ccccc2)C1 Amb27218901 [0,0,0,1,1,0|0,0,2]=4 2547 B13R2.10 O[C@@H]1CC[C@H](c2ccccc2)C1 Amb27431425 [0,0,0,1,1,0|0,0,2]=4 2548 B13R2.10 O[C@H]1CC[C@H](c2ccccc2)C1 Amb27420311 [0,0,0,1,1,0|0,0,2]=4 2549 B13R2.10 S=C1NC(c2ccccc2)CO1 Amb26880718 [0,0,0,1,1,0|1,1,0]=4 2550 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb23401475 [0,0,0,1,1,0|1,0,1]=4 2551 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb27237117 [0,0,0,1,1,0|1,0,1]=4 2552 B13R2.31 O=C1CC(Cc2ccccc2)C1 Amb23401474 [0,0,0,1,1,0|0,0,0]=2 2553 B13R2.31 O=C1CC(Cc2ccccc2)N1 Amb27468739 [0,0,0,1,1,0|1,0,0]=3 2554 B13R2.31 O=C1CC(Oc2ccccc2)C1 Amb23439309 [0,0,0,1,1,0|1,0,0]=3 2555 B13R2.31 O=C1CC(Sc2ccccc2)C1 Amb32670640 [0,0,0,1,1,0|1,0,0]=3 2556 B13R2.31 O=C1CC(Sc2ccccc2)N1 Amb27264782 [0,0,0,1,1,0|2,0,0]=4 2557 B13R2.31 O=C1CC([Se]c2ccccc2)N1 Amb2612117 [0,0,0,1,1,0|2,0,0]=4 2558 B13R2.31 O=C1CN(Cc2ccccc2)C1 Amb10602421 [0,0,0,1,1,0|1,0,0]=3 2559 B13R2.31 O=C1C[C@@H](Cc2ccccc2)N1 Amb28243189 [0,0,0,1,1,0|1,0,0]=3 2560 B13R2.31 O=C1C[C@@H](Sc2ccccc2)N1 Amb27647757 [0,0,0,1,1,0|2,0,0]=4 2561 B13R2.31 OC1CC(Cc2ccccc2)C1 Amb23401472 [0,0,0,1,1,0|0,0,2]=4 2562 B13R2.72 CC(=O)C1CCc2ccccc21 Amb24400099 [0,0,0,1,1,0|0,0,0]=2 2563 B13R2.72 CC(=O)C1COc2ccccc21 Amb23586289 [0,0,0,1,1,0|1,0,0]=3 2564 B13R2.72 CC(=O)N1CCc2ccccc21 Amb6357858 [0,0,0,1,1,0|1,0,0]=3 2565 B13R2.72 CC(=O)N1CCc2cccnc21 Amb25873902 [0,0,0,1,1,0|2,0,0]=4 2566 B13R2.72 CC(=O)N1CCc2ccncc21 Amb23412123 [0,0,0,1,1,0|2,0,0]=4 2567 B13R2.72 CC(=O)N1CCc2cnccc21 Amb25847503 [0,0,0,1,1,0|2,0,0]=4 2568 B13R2.72 CC(=O)N1CNc2ccccc21 Amb28366373 [0,0,0,1,1,0|2,0,0]=4 2569 B13R2.72 CC(=O)N1COc2ccccc21 Amb28244203 [0,0,0,1,1,0|2,0,0]=4 2570 B13R2.72 CC(=O)N1CSc2ccccc21 Amb27416836 [0,0,0,1,1,0|2,0,0]=4 2571 B13R2.72 CC(=O)N1OCc2ccccc21 Amb27756375 [0,0,0,1,1,0|2,0,0]=4 2572 B13R2.72 CC(=O)[C@@H]1CCc2ccccc21 Amb25834379 [0,0,0,1,1,0|0,0,0]=2 2573 B13R2.72 CC(N)C1CCc2ccccc21 Amb27810846 [0,0,0,1,1,0|1,0,1]=4 2574 B13R2.72 CS(=O)C1CCc2ccccc21 Amb26912150 [0,0,0,1,1,0|1,0,0]=3 2575 B13R2.72 C[C@@H](N)C1CCc2ccccc21 Amb25259826 [0,0,0,1,1,0|1,0,1]=4 2576 B13R2.72 C[C@@H](O)C1CCc2ccccc21 Amb25077224 [0,0,0,1,1,0|0,0,2]=4 2577 B13R2.72 C[C@H](N)C1CCc2ccccc21 Amb28072910 [0,0,0,1,1,0|1,0,1]=4 2578 B13R2.72 C[C@H](O)C1CCc2ccccc21 Amb25378827 [0,0,0,1,1,0|0,0,2]=4 2579 B13R2.72 N=C(N)C1CCc2ccccc21 Amb24484327 [0,0,0,1,1,0|2,0,0]=4 2580 B13R2.72 NC(=O)C1CCc2ccccc21 Amb4035852 [0,0,0,1,1,0|1,0,0]=3 2581 B13R2.72 NC(=O)C1CCc2cnccc21 Amb5719884 [0,0,0,1,1,0|2,0,0]=4 2582 B13R2.72 NC(=O)C1CNc2ccccc21 Amb19320765 [0,0,0,1,1,0|2,0,0]=4 2583 B13R2.72 NC(=O)C1COc2ccccc21 Amb27404619 [0,0,0,1,1,0|2,0,0]=4 2584 B13R2.72 NC(=O)N1CCc2ccccc21 Amb1124478 [0,0,0,1,1,0|2,0,0]=4 2585 B13R2.72 NC(=O)[C@@H]1CCc2ccccc21 Amb27460722 [0,0,0,1,1,0|1,0,0]=3 2586 B13R2.72 NC(=S)C1CCc2ccccc21 Amb27831962 [0,0,0,1,1,0|1,1,0]=4 2587 B13R2.72 O=C(Cl)C1COc2ccccc21 Amb24436426 [0,0,0,1,1,0|2,0,0]=4 2588 B13R2.72 O=C(Cl)C1NCc2ccccc21 Amb27623703 [0,0,0,1,1,0|2,0,0]=4 2589 B13R2.72 O=C(Cl)N1CCc2ccccc21 Amb20670451 [0,0,0,1,1,0|2,0,0]=4 2590 B13R2.72 O=C(O)C1CCc2ccccc21 Amb18538487 [0,0,0,1,1,0|1,0,0]=3 2591 B13R2.72 O=C(O)C1CCc2cccnc21 Amb22372226 [0,0,0,1,1,0|2,0,0]=4 2592 B13R2.72 O=C(O)C1CCc2cccnc21 Amb32652229 [0,0,0,1,1,0|2,0,0]=4 2593 B13R2.72 O=C(O)C1CCc2ccncc21 Amb28138053 [0,0,0,1,1,0|2,0,0]=4 2594 B13R2.72 O=C(O)C1CNc2ccccc21 Amb22497686 [0,0,0,1,1,0|2,0,0]=4 2595 B13R2.72 O=C(O)C1CNc2ccccc21 Amb2698471 [0,0,0,1,1,0|2,0,0]=4 2596 B13R2.72 O=C(O)C1COc2ccccc21 Amb19372915 [0,0,0,1,1,0|2,0,0]=4 2597 B13R2.72 O=C(O)C1CSc2ccccc21 Amb19335022 [0,0,0,1,1,0|2,0,0]=4 2598 B13R2.72 O=C(O)C1NCc2ccccc21 Amb22491461 [0,0,0,1,1,0|2,0,0]=4 2599 B13R2.72 O=C(O)C1NCc2ccccc21 Amb2699615 [0,0,0,1,1,0|2,0,0]=4 2600 B13R2.72 O=C(O)C1OCc2ccccc21 Amb18829056 [0,0,0,1,1,0|2,0,0]=4 2601 B13R2.72 O=C(O)[C@@H]1CCc2ccccc21 Amb24729539 [0,0,0,1,1,0|1,0,0]=3 2602 B13R2.72 O=C(O)[C@@H]1NCc2ccccc21 Amb22748827 [0,0,0,1,1,0|2,0,0]=4 2603 B13R2.72 O=C(O)[C@@H]1NCc2ccccc21 Amb30869293 [0,0,0,1,1,0|2,0,0]=4 2604 B13R2.72 O=C(O)[C@H]1CCc2ccccc21 Amb24470066 [0,0,0,1,1,0|1,0,0]=3 2605 B13R2.72 O=C(O)[C@H]1NCc2ccccc21 Amb25200954 [0,0,0,1,1,0|2,0,0]=4 2606 B13R2.72 O=C(O)[C@H]1NCc2ccccc21 Amb33872272 [0,0,0,1,1,0|2,0,0]=4 2607 B13R2.163 N=C1CCCc2ccccc2N1 Amb8507493 [0,0,0,1,1,0|2,0,0]=4 2608 B13R2.163 NC1CCCc2ccccc2C1 Amb24355951 [0,0,0,1,1,0|1,0,1]=4 2609 B13R2.163 O=C1CCCc2ccccc2C1 Amb6360022 [0,0,0,1,1,0|0,0,0]=2 2610 B13R2.163 O=C1CCCc2ccccc2N1 Amb1077569 [0,0,0,1,1,0|1,0,0]=3 2611 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [0,0,0,1,1,0|1,0,0]=3 2612 B13R2.163 O=C1CCCc2cccnc2N1 Amb21962431 [0,0,0,1,1,0|2,0,0]=4 2613 B13R2.163 O=C1CCCc2ccncc2N1 Amb28074006 [0,0,0,1,1,0|2,0,0]=4 2614 B13R2.163 O=C1CCCc2ncccc2N1 Amb28319382 [0,0,0,1,1,0|2,0,0]=4 2615 B13R2.163 O=C1CCNc2ccccc2C1 Amb18829955 [0,0,0,1,1,0|1,0,0]=3 2616 B13R2.163 O=C1CCNc2ccccc2N1 Amb1666975 [0,0,0,1,1,0|2,0,0]=4 2617 B13R2.163 O=C1CCOc2ccccc2C1 Amb24352115 [0,0,0,1,1,0|1,0,0]=3 2618 B13R2.163 O=C1CCOc2ccccc2N1 Amb10608982 [0,0,0,1,1,0|2,0,0]=4 2619 B13R2.163 O=C1CCSc2ccccc2C1 Amb25878594 [0,0,0,1,1,0|1,0,0]=3 2620 B13R2.163 O=C1CCSc2ccccc2N1 Amb1154582 [0,0,0,1,1,0|2,0,0]=4 2621 B13R2.163 O=C1CNCc2ccccc2N1 Amb17606145 [0,0,0,1,1,0|2,0,0]=4 2622 B13R2.163 O=C1CNCc2ccccc2N1 Amb28872408 [0,0,0,1,1,0|2,0,0]=4 2623 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [0,0,0,1,1,0|2,0,0]=4 2624 B13R2.163 O=C1Cc2ccccc2CCN1 Amb16203437 [0,0,0,1,1,0|1,0,0]=3 2625 B13R2.163 O=C1NCCc2ccccc2N1 Amb25869873 [0,0,0,1,1,0|2,0,0]=4 2626 B13R2.163 OC1CCCc2ccccc2C1 Amb3987828 [0,0,0,1,1,0|0,0,2]=4 2627 B13R2.423 CC(=O)C1CC1c2ccccc2 Amb534893 [0,0,0,1,1,0|0,0,0]=2 2628 B13R2.423 CC(=O)C1CC1c2cnccn2 Amb35601041 [0,0,0,1,1,0|2,0,0]=4 2629 B13R2.423 CC(=O)C1CC1c2cncnc2 Amb27960546 [0,0,0,1,1,0|2,0,0]=4 2630 B13R2.423 CC(=O)C1N=C1c2ccccc2 Amb25863961 [0,0,0,1,1,0|1,0,1]=4 2631 B13R2.423 CC(=O)C1OC1c2ccccn2 Amb27426800 [0,0,0,1,1,0|2,0,0]=4 2632 B13R2.423 CC(=O)C1OC1c2cccnc2 Amb26055012 [0,0,0,1,1,0|2,0,0]=4 2633 B13R2.423 CC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb27780823 [0,0,0,1,1,0|0,0,0]=2 2634 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,0,0,1,1,0|0,0,0]=2 2635 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccn2 Amb33457459 [0,0,0,1,1,0|1,0,0]=3 2636 B13R2.423 CC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb26481631 [0,0,0,1,1,0|1,0,0]=3 2637 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [0,0,0,1,1,0|1,0,0]=3 2638 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccn2 Amb26055245 [0,0,0,1,1,0|2,0,0]=4 2639 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2cccnc2 Amb27758910 [0,0,0,1,1,0|2,0,0]=4 2640 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccncc2 Amb25375191 [0,0,0,1,1,0|2,0,0]=4 2641 B13R2.423 CC(=O)[C@H]1CC1c2ccccc2 Amb27770300 [0,0,0,1,1,0|0,0,0]=2 2642 B13R2.423 CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb28054879 [0,0,0,1,1,0|0,0,0]=2 2643 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,0,0,1,1,0|0,0,0]=2 2644 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [0,0,0,1,1,0|1,0,0]=3 2645 B13R2.423 CC(=O)[C@H]1O[C@H]1c2ccccc2 Amb27966798 [0,0,0,1,1,0|1,0,0]=3 2646 B13R2.423 CC(Cl)C1CC1c2ccccc2 Amb27426778 [0,0,0,1,1,0|1,0,1]=4 2647 B13R2.423 CC(N)C1CC1c2ccccc2 Amb10610180 [0,0,0,1,1,0|1,0,1]=4 2648 B13R2.423 CC(N)C1CC1c2ccccc2 Amb7807914 [0,0,0,1,1,0|1,0,1]=4 2649 B13R2.423 CC(N)[C@@H]1C[C@H]1c2ccccc2 Amb26926536 [0,0,0,1,1,0|1,0,1]=4 2650 B13R2.423 CC(N)[C@@H]1C[C@H]1c2ccccc2 Amb32652180 [0,0,0,1,1,0|1,0,1]=4 2651 B13R2.423 CC(O)C1CC1c2ccccc2 Amb17605479 [0,0,0,1,1,0|0,0,2]=4 2652 B13R2.423 CC(O)[C@H]1C[C@@H]1c2ccccc2 Amb27664262 [0,0,0,1,1,0|0,0,2]=4 2653 B13R2.423 C[C@@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb27857504 [0,0,0,1,1,0|0,0,2]=4 2654 B13R2.423 NC(=O)C1CC1c2cccnc2 Amb25701875 [0,0,0,1,1,0|2,0,0]=4 2655 B13R2.423 NC(=O)C1CC1c2ccncc2 Amb27598012 [0,0,0,1,1,0|2,0,0]=4 2656 B13R2.423 NC(=O)C1OC1c2ccccc2 Amb26844548 [0,0,0,1,1,0|2,0,0]=4 2657 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb25965684 [0,0,0,1,1,0|1,0,0]=3 2658 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb26624595 [0,0,0,1,1,0|1,0,0]=3 2659 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2cccnc2 Amb27473517 [0,0,0,1,1,0|2,0,0]=4 2660 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccncc2 Amb29837838 [0,0,0,1,1,0|2,0,0]=4 2661 B13R2.423 NC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb27878627 [0,0,0,1,1,0|2,0,0]=4 2662 B13R2.423 NC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24519129 [0,0,0,1,1,0|2,0,0]=4 2663 B13R2.423 NC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27984902 [0,0,0,1,1,0|2,0,0]=4 2664 B13R2.423 NC(=S)C1CC1c2ccccc2 Amb27616774 [0,0,0,1,1,0|1,1,0]=4 2665 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,0,0,1,1,0|1,0,0]=3 2666 B13R2.423 O=C(Cl)[C@@H]1C[C@H]1c2ccccc2 Amb3939047 [0,0,0,1,1,0|1,0,0]=3 2667 B13R2.423 O=C(Cl)[C@@H]1O[C@H]1c2ccccc2 Amb25205379 [0,0,0,1,1,0|2,0,0]=4 2668 B13R2.423 O=C(O)C1CC1c2ccccc2 Amb534800 [0,0,0,1,1,0|1,0,0]=3 2669 B13R2.423 O=C(O)C1CC1c2ccccn2 Amb28991402 [0,0,0,1,1,0|2,0,0]=4 2670 B13R2.423 O=C(O)C1CC1c2ccccn2 Amb9677166 [0,0,0,1,1,0|2,0,0]=4 2671 B13R2.423 O=C(O)C1CC1c2cccnc2 Amb9677138 [0,0,0,1,1,0|2,0,0]=4 2672 B13R2.423 O=C(O)C1CC1c2ccncc2 Amb19514911 [0,0,0,1,1,0|2,0,0]=4 2673 B13R2.423 O=C(O)C1CC1c2ccncc2 Amb9677129 [0,0,0,1,1,0|2,0,0]=4 2674 B13R2.423 O=C(O)C1OC1c2ccccc2 Amb3775834 [0,0,0,1,1,0|2,0,0]=4 2675 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,0,0,1,1,0|1,0,0]=3 2676 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2cccnc2 Amb27234646 [0,0,0,1,1,0|2,0,0]=4 2677 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccc2 Amb33524226 [0,0,0,1,1,0|1,0,0]=3 2678 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccn2 Amb25983800 [0,0,0,1,1,0|2,0,0]=4 2679 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccn2 Amb31260868 [0,0,0,1,1,0|2,0,0]=4 2680 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cccnc2 Amb26636966 [0,0,0,1,1,0|2,0,0]=4 2681 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncc2 Amb25299768 [0,0,0,1,1,0|2,0,0]=4 2682 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncc2 Amb28594202 [0,0,0,1,1,0|2,0,0]=4 2683 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,0,0,1,1,0|1,0,0]=3 2684 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccccn2 Amb27488853 [0,0,0,1,1,0|2,0,0]=4 2685 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2cccnc2 Amb26928613 [0,0,0,1,1,0|2,0,0]=4 2686 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccncc2 Amb27974957 [0,0,0,1,1,0|2,0,0]=4 2687 B13R2.423 O=C(O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,0,0,1,1,0|1,0,0]=3 2688 B13R2.423 O=C([O-])C1OC1c2ccccc2 Amb4008297 [0,0,0,1,1,0|2,0,0]=4 2689 B13R2.423 O=C([O-])C1OC1c2ccccc2 Amb431197 [0,0,0,1,1,0|2,0,0]=4 2690 B13R2.423 O=S([O-])[C@@H]1C[C@H]1c2ccccc2 Amb32755429 [0,0,0,1,1,0|2,0,0]=4 2691 B13R2.423 O=[N+]([O-])C1CC1c2ccccc2 Amb27651637 [0,0,0,1,1,0|2,0,0]=4 2692 B13R2.423 O=[N+]([O-])[C@@H]1CC1c2ccccc2 Amb27635928 [0,0,0,1,1,0|2,0,0]=4 2693 B13R2.423 O=[N+]([O-])[C@H]1C[C@@H]1c2ccccc2 Amb26989678 [0,0,0,1,1,0|2,0,0]=4 2694 B13R2.3122 CC1(C)CCCc2ccccc21 Amb25328610 [0,0,0,1,1,0|1,0,1]=4 2695 B13R2.3122 CC1(N)CCCc2ccccc21 Amb13952456 [0,0,0,1,1,0|1,0,1]=4 2696 B13R2.3122 CC1(N)CCCc2ccccc21 Amb9676140 [0,0,0,1,1,0|1,0,1]=4 2697 B13R2.3122 CC1(O)CCCc2ccccc21 Amb6332075 [0,0,0,1,1,0|0,0,2]=4 2698 B13R2.3122 C[N+]1(C)CCCc2ccccc21 Amb5717952 [0,0,0,1,1,0|2,0,0]=4 2699 B13R2.5881 CC(=O)NC1Cc2ccccc21 Amb17778879 [0,0,0,1,1,0|1,0,0]=3 2700 B13R2.5881 CC(=O)OC1Cc2ccccc21 Amb17778687 [0,0,0,1,1,0|0,0,0]=2 2701 B13R2.5881 CC(=O)\C=C1/Cc2ccccc21 Amb21948332 [0,0,0,1,1,0|0,0,2]=4 2702 B13R2.5881 O=C(O)CC1Cc2ccccc21 Amb25279494 [0,0,0,1,1,0|1,0,0]=3 2703 B13R2.13 O=C1CCCC(c2cccs2)C1 Amb18564148 [0,0,0,1,1,0|2,0,0]=4 2704 B13R2.13 O=C1CCCC(c2ccoc2)C1 Amb27960840 [0,0,0,1,1,0|2,0,0]=4 2705 B13R2.13 O=C1CCCC(c2ccsc2)C1 Amb27602409 [0,0,0,1,1,0|2,0,0]=4 2706 B13R2.13 O=C1N[C@@H](c2ccco2)CCO1 Amb27600854 [0,0,0,1,1,0|2,0,0]=4 2707 B13R2.13 O=C1N[C@@H](c2ccsc2)CCO1 Amb27234912 [0,0,0,1,1,0|2,0,0]=4 2708 B13R2.13 O=C1N[C@H](c2cccs2)CCO1 Amb28059189 [0,0,0,1,1,0|2,0,0]=4 2709 B13R2.13 O=C1N[C@H](c2ccsc2)CCO1 Amb27404126 [0,0,0,1,1,0|2,0,0]=4 2710 B13R2.142 O=C1CC(Cc2cccs2)CN1 Amb27231604 [0,0,0,1,1,0|2,0,0]=4 2711 B13R2.142 O=C1CC(Cn2cccc2)CN1 Amb27815348 [0,0,0,1,1,0|2,0,0]=4 2712 B13R2.142 O=C1NC(Cc2ccco2)CO1 Amb28040921 [0,0,0,1,1,0|2,0,0]=4 2713 B15R2.6 CC(=O)CCC1CCc2ccccc21 Amb33144625 [0,0,0,1,0,1|1,0,0]=3 2714 B15R2.6 CC(=O)CCC1CCc2cccnc21 Amb27663142 [0,0,0,1,0,1|2,0,0]=4 2715 B15R2.6 CC(=O)CCC1CSc2ccccc21 Amb28141490 [0,0,0,1,0,1|1,0,0]=3 2716 B15R2.6 CC(=O)CCN1CCc2ccccc21 Amb17401320 [0,0,0,1,0,1|1,0,0]=3 2717 B15R2.6 CC(=O)\C=C\C1CCc2ccccc21 Amb33144627 [0,0,0,1,0,1|1,0,0]=3 2718 B15R2.6 CS(=O)CCC1NCc2ccccc21 Amb27473824 [0,0,0,1,0,1|2,0,0]=4 2719 B15R2.6 NC(=O)CCN1CCc2ccccc21 Amb17143084 [0,0,0,1,0,1|2,0,0]=4 2720 B15R2.6 NC(=O)CSC1CCc2ccccc21 Amb11626384 [0,0,0,1,0,1|1,1,0]=4 2721 B15R2.6 O=C(Cl)CCN1CCc2ccccc21 Amb17143488 [0,0,0,1,0,1|2,0,0]=4 2722 B15R2.6 O=C(O)CCC1CCc2ccccc21 Amb18650564 [0,0,0,1,0,1|2,0,0]=4 2723 B15R2.6 O=C(O)CCC1CNc2ccccc21 Amb18560673 [0,0,0,1,0,1|2,0,0]=4 2724 B15R2.6 O=C(O)CCC1COc2ccccc21 Amb25901098 [0,0,0,1,0,1|2,0,0]=4 2725 B15R2.6 O=C(O)CCC1CSc2ccccc21 Amb25137538 [0,0,0,1,0,1|2,0,0]=4 2726 B15R2.6 O=C(O)CCN1CCc2ccccc21 Amb2235429 [0,0,0,1,0,1|2,0,0]=4 2727 B15R2.6 O=C(O)CC[C@@H]1CCc2ccccc21 Amb27865599 [0,0,0,1,0,1|2,0,0]=4 2728 B15R2.6 O=C(O)COC1CCc2ccccc21 Amb26846315 [0,0,0,1,0,1|1,0,0]=3 2729 B15R2.6 O=C(O)\C=C\C1CCc2ccccc21 Amb33145767 [0,0,0,1,0,1|2,0,0]=4 2730 B15R2.31 BrC1=CCCN(Cc2ccccc2)C1 Amb13885739 [0,0,0,1,0,1|2,0,0]=4 2731 B15R2.31 C=C1CCNC(Cc2ccccc2)C1 Amb18649678 [0,0,0,1,0,1|2,0,0]=4 2732 B15R2.31 CC1CC(Nc2ccccc2)CCO1 Amb27202210 [0,0,0,1,0,1|1,0,1]=4 2733 B15R2.31 CC1COCC(Cc2ccccc2)N1 Amb18564882 [0,0,0,1,0,1|1,0,1]=4 2734 B15R2.31 CC1NC(Cc2ccccc2)CCO1 Amb33193767 [0,0,0,1,0,1|1,0,1]=4 2735 B15R2.31 O=C1C=CCN(Cc2ccccc2)C1 Amb27611795 [0,0,0,1,0,1|1,0,1]=4 2736 B15R2.31 O=C1C=CNC(Cc2ccccc2)C1 Amb27866268 [0,0,0,1,0,1|1,0,1]=4 2737 B15R2.31 O=C1CC(Cc2ccccc2)CCN1 Amb25835625 [0,0,0,1,0,1|1,0,0]=3 2738 B15R2.31 O=C1CC(Cc2ccccc2)CCO1 Amb27963030 [0,0,0,1,0,1|0,0,0]=2 2739 B15R2.31 O=C1CCCC(Nc2ccccc2)C1 Amb27791842 [0,0,0,1,0,1|1,0,0]=3 2740 B15R2.31 O=C1CCCC(Sc2ccccc2)C1 Amb25123623 [0,0,0,1,0,1|1,0,0]=3 2741 B15R2.31 O=C1CCCN(Cc2ccccc2)C1 Amb2691209 [0,0,0,1,0,1|1,0,0]=3 2742 B15R2.31 O=C1CCCN(Cc2ccccc2)C1 Amb2695152 [0,0,0,1,0,1|1,0,0]=3 2743 B15R2.31 O=C1CCCN(Cc2ccccc2)C1 Amb6365418 [0,0,0,1,0,1|1,0,0]=3 2744 B15R2.31 O=C1CCCN(Cc2ccccn2)C1 Amb27752261 [0,0,0,1,0,1|2,0,0]=4 2745 B15R2.31 O=C1CCCN(Cc2ccncc2)C1 Amb28124148 [0,0,0,1,0,1|2,0,0]=4 2746 B15R2.31 O=C1CCNC(Cc2ccccc2)C1 Amb28457239 [0,0,0,1,0,1|1,0,0]=3 2747 B15R2.31 O=C1CCOC(Cc2ccccc2)C1 Amb27746791 [0,0,0,1,0,1|1,0,0]=3 2748 B15R2.31 O=C1CN(Cc2ccccc2)CCN1 Amb8630718 [0,0,0,1,0,1|1,0,0]=3 2749 B15R2.31 O=C1CN(Cc2ccccc2)CCO1 Amb22490281 [0,0,0,1,0,1|0,0,0]=2 2750 B15R2.31 O=C1CN(Cc2cccnc2)CCN1 Amb31193716 [0,0,0,1,0,1|2,0,0]=4 2751 B15R2.31 O=C1CNCC(Cc2ccccc2)N1 Amb27748147 [0,0,0,1,0,1|2,0,0]=4 2752 B15R2.31 O=C1CNC[C@@H](Cc2ccccc2)N1 Amb26019569 [0,0,0,1,0,1|2,0,0]=4 2753 B15R2.31 O=C1CNC[C@@H](Cc2ccccc2)N1 Amb32434776 [0,0,0,1,0,1|2,0,0]=4 2754 B15R2.31 O=C1CNC[C@H](Cc2ccccc2)N1 Amb25791537 [0,0,0,1,0,1|2,0,0]=4 2755 B15R2.31 O=C1CNC[C@H](Cc2ccccc2)N1 Amb32434778 [0,0,0,1,0,1|2,0,0]=4 2756 B15R2.31 O=C1CNC[C@H](Cc2ccccc2)O1 Amb27387011 [0,0,0,1,0,1|2,0,0]=4 2757 B15R2.31 O=C1COCC(Cc2ccccc2)N1 Amb21864802 [0,0,0,1,0,1|1,0,0]=3 2758 B15R2.31 O=C1COC[C@@H](Cc2ccccc2)N1 Amb25082881 [0,0,0,1,0,1|1,0,0]=3 2759 B15R2.31 O=C1COC[C@H](Cc2ccccc2)N1 Amb25725966 [0,0,0,1,0,1|1,0,0]=3 2760 B15R2.31 O=C1NC(Cc2ccccc2)CCO1 Amb8392176 [0,0,0,1,0,1|1,0,0]=3 2761 B15R2.31 O=C1NNCC(Cc2ccccc2)N1 Amb28203971 [0,0,0,1,0,1|2,0,0]=4 2762 B15R2.31 OC1CC(Cc2ccccc2)CCO1 Amb28350051 [0,0,0,1,0,1|0,0,2]=4 2763 B15R2.31 OC1CN(Cc2ccccc2)CCO1 Amb22499166 [0,0,0,1,0,1|0,0,2]=4 2764 B15R2.63 CC(=O)C1CNCC1c2ccccn2 Amb32670098 [0,0,0,1,0,1|2,0,0]=4 2765 B15R2.63 CC(=O)N1CCCC1c2ccccc2 Amb25916883 [0,0,0,1,0,1|1,0,0]=3 2766 B15R2.63 CC(=O)N1CCCC1c2ccccn2 Amb20136482 [0,0,0,1,0,1|2,0,0]=4 2767 B15R2.63 CC(=O)N1CCCC1c2cccnc2 Amb23444561 [0,0,0,1,0,1|2,0,0]=4 2768 B15R2.63 CC(=O)N1CCC[C@@H]1c2cccnc2 Amb32674891 [0,0,0,1,0,1|2,0,0]=4 2769 B15R2.63 CC(=O)N1CCC[C@H]1c2cccnc2 Amb26050368 [0,0,0,1,0,1|2,0,0]=4 2770 B15R2.63 CC(=O)N1CCSC1c2ccccc2 Amb27190042 [0,0,0,1,0,1|1,0,0]=3 2771 B15R2.63 NC(=O)C1=CCCC1c2ccccc2 Amb27471932 [0,0,0,1,0,1|2,0,0]=4 2772 B15R2.63 NC(=O)C1CCCN1c2ccccc2 Amb27390055 [0,0,0,1,0,1|2,0,0]=4 2773 B15R2.63 NC(=O)C1CNCC1c2ccccc2 Amb28322430 [0,0,0,1,0,1|2,0,0]=4 2774 B15R2.63 NC(=O)[C@@H]1CNC[C@H]1c2ccccc2 Amb26404554 [0,0,0,1,0,1|2,0,0]=4 2775 B15R2.63 O=C(Cl)N1CCCC1c2ccccc2 Amb24336164 [0,0,0,1,0,1|2,0,0]=4 2776 B15R2.63 O=C(O)C1=C(c2ccccc2)CCC1 Amb25743569 [0,0,0,1,0,1|2,0,0]=4 2777 B15R2.63 O=C(O)C1CCCC1c2ccccc2 Amb33547200 [0,0,0,1,0,1|2,0,0]=4 2778 B15R2.63 O=C(O)C1CCCN1c2ccccc2 Amb10576138 [0,0,0,1,0,1|2,0,0]=4 2779 B15R2.63 O=C(O)C1CCNC1c2ccccc2 Amb18636233 [0,0,0,1,0,1|2,0,0]=4 2780 B15R2.63 O=C(O)C1CCNC1c2ccccc2 Amb26304357 [0,0,0,1,0,1|2,0,0]=4 2781 B15R2.63 O=C(O)C1CCOC1c2ccccc2 Amb10609878 [0,0,0,1,0,1|2,0,0]=4 2782 B15R2.63 O=C(O)C1CNCC1c2ccccc2 Amb18818548 [0,0,0,1,0,1|2,0,0]=4 2783 B15R2.63 O=C(O)C1CNCC1c2ccccc2 Amb29083270 [0,0,0,1,0,1|2,0,0]=4 2784 B15R2.63 O=C(O)C1COCC1c2ccccc2 Amb28325761 [0,0,0,1,0,1|2,0,0]=4 2785 B15R2.63 O=C(O)C1CSCC1c2ccccc2 Amb27145757 [0,0,0,1,0,1|2,0,0]=4 2786 B15R2.63 O=C(O)C1NCCC1c2ccccc2 Amb10818868 [0,0,0,1,0,1|2,0,0]=4 2787 B15R2.63 O=C(O)C1NCCC1c2ccccc2 Amb33164135 [0,0,0,1,0,1|2,0,0]=4 2788 B15R2.63 O=C(O)C1OCCC1c2ccccc2 Amb28074924 [0,0,0,1,0,1|1,0,0]=3 2789 B15R2.63 O=C(O)[C@@H]1CCCN1c2ccccc2 Amb28195323 [0,0,0,1,0,1|2,0,0]=4 2790 B15R2.63 O=C(O)[C@@H]1CCN[C@@H]1c2ccccc2 Amb22750627 [0,0,0,1,0,1|2,0,0]=4 2791 B15R2.63 O=C(O)[C@@H]1CCN[C@@H]1c2ccccc2 Amb31177973 [0,0,0,1,0,1|2,0,0]=4 2792 B15R2.63 O=C(O)[C@@H]1CCN[C@H]1c2ccccc2 Amb18818528 [0,0,0,1,0,1|2,0,0]=4 2793 B15R2.63 O=C(O)[C@@H]1CCO[C@H]1c2ccccc2 Amb28239926 [0,0,0,1,0,1|2,0,0]=4 2794 B15R2.63 O=C(O)[C@@H]1CNC[C@@H]1c2ccccc2 Amb25201259 [0,0,0,1,0,1|2,0,0]=4 2795 B15R2.63 O=C(O)[C@@H]1CNC[C@@H]1c2ccccc2 Amb34916589 [0,0,0,1,0,1|2,0,0]=4 2796 B15R2.63 O=C(O)[C@@H]1CNC[C@H]1c2ccccc2 Amb20241709 [0,0,0,1,0,1|2,0,0]=4 2797 B15R2.63 O=C(O)[C@@H]1CNC[C@H]1c2ccccc2 Amb22288903 [0,0,0,1,0,1|2,0,0]=4 2798 B15R2.63 O=C(O)[C@@H]1CSC[C@H]1c2ccccc2 Amb24655987 [0,0,0,1,0,1|2,0,0]=4 2799 B15R2.63 O=C(O)[C@@H]1NCC[C@@H]1c2ccccc2 Amb22831280 [0,0,0,1,0,1|2,0,0]=4 2800 B15R2.63 O=C(O)[C@@H]1NCC[C@H]1c2ccccc2 Amb19889777 [0,0,0,1,0,1|2,0,0]=4 2801 B15R2.63 O=C(O)[C@@H]1NCC[C@H]1c2ccccc2 Amb24181876 [0,0,0,1,0,1|2,0,0]=4 2802 B15R2.63 O=C(O)[C@@H]1OCC[C@@H]1c2ccccc2 Amb25168842 [0,0,0,1,0,1|1,0,0]=3 2803 B15R2.63 O=C(O)[C@@H]1OCC[C@H]1c2ccccc2 Amb32655932 [0,0,0,1,0,1|1,0,0]=3 2804 B15R2.63 O=C(O)[C@H]1CCN[C@@H]1c2ccccc2 Amb28345682 [0,0,0,1,0,1|2,0,0]=4 2805 B15R2.63 O=C(O)[C@H]1CCN[C@H]1c2ccccc2 Amb25022881 [0,0,0,1,0,1|2,0,0]=4 2806 B15R2.63 O=C(O)[C@H]1CCN[C@H]1c2ccccc2 Amb28429244 [0,0,0,1,0,1|2,0,0]=4 2807 B15R2.63 O=C(O)[C@H]1CNC[C@@H]1c2ccccc2 Amb20241710 [0,0,0,1,0,1|2,0,0]=4 2808 B15R2.63 O=C(O)[C@H]1CNC[C@@H]1c2ccccc2 Amb25658996 [0,0,0,1,0,1|2,0,0]=4 2809 B15R2.63 O=C(O)[C@H]1COC[C@@H]1c2ccccc2 Amb25254638 [0,0,0,1,0,1|2,0,0]=4 2810 B15R2.63 O=C(O)[C@H]1CSC[C@H]1c2ccccc2 Amb27969129 [0,0,0,1,0,1|2,0,0]=4 2811 B15R2.63 O=C(O)[C@H]1NCCC1c2ccccc2 Amb10602347 [0,0,0,1,0,1|2,0,0]=4 2812 B15R2.63 O=C(O)[C@H]1NCC[C@@H]1c2ccccc2 Amb8515085 [0,0,0,1,0,1|2,0,0]=4 2813 B15R2.63 O=C(O)[C@H]1NCC[C@H]1c2ccccc2 Amb6357151 [0,0,0,1,0,1|2,0,0]=4 2814 B15R2.63 O=C(O)[C@H]1OCC[C@H]1c2ccccc2 Amb28137142 [0,0,0,1,0,1|1,0,0]=3 2815 B15R2.283 BrC1=NOC(COc2ccccc2)C1 Amb23449514 [0,0,0,1,0,1|2,0,0]=4 2816 B15R2.283 C=C1COC(CCc2ccccc2)C1 Amb25183212 [0,0,0,1,0,1|1,0,0]=3 2817 B15R2.283 CC1CC(NCc2ccccc2)CO1 Amb35686686 [0,0,0,1,0,1|1,0,1]=4 2818 B15R2.283 N=C1CN(CCc2ccccc2)NO1 Amb27795767 [0,0,0,1,0,1|2,0,0]=4 2819 B15R2.283 NC1=NC(CSc2ccccc2)CO1 Amb27784910 [0,0,0,1,0,1|2,0,0]=4 2820 B15R2.283 NC1=N[C@@H](CCc2ccccc2)CO1 Amb27969242 [0,0,0,1,0,1|2,0,0]=4 2821 B15R2.283 NC1=N[C@H](CCc2ccccc2)CO1 Amb27879567 [0,0,0,1,0,1|2,0,0]=4 2822 B15R2.283 NC1=N[C@H](COc2ccccc2)CO1 Amb27464440 [0,0,0,1,0,1|2,0,0]=4 2823 B15R2.283 NC1COC(CCc2ccccc2)C1 Amb35584887 [0,0,0,1,0,1|1,0,1]=4 2824 B15R2.283 O=C1C=C(NCc2ccccc2)CO1 Amb23562822 [0,0,0,1,0,1|0,0,2]=4 2825 B15R2.283 O=C1C=C[C@H](OCc2ccccc2)C1 Amb25167796 [0,0,0,1,0,1|1,0,1]=4 2826 B15R2.283 O=C1CC(C#Cc2ccccc2)CN1 Amb28136628 [0,0,0,1,0,1|1,0,1]=4 2827 B15R2.283 O=C1CC(CCc2ccccc2)CN1 Amb26954493 [0,0,0,1,0,1|1,0,0]=3 2828 B15R2.283 O=C1CC(CCc2ccccc2)NN1 Amb29862137 [0,0,0,1,0,1|1,0,0]=3 2829 B15R2.283 O=C1CC(CNc2ccccn2)CN1 Amb28429975 [0,0,0,1,0,1|2,0,0]=4 2830 B15R2.283 O=C1CC(CNc2ccncc2)CN1 Amb28429974 [0,0,0,1,0,1|2,0,0]=4 2831 B15R2.283 O=C1CC(COc2ccccn2)CN1 Amb31193664 [0,0,0,1,0,1|2,0,0]=4 2832 B15R2.283 O=C1CC(COc2cccnc2)CN1 Amb27786079 [0,0,0,1,0,1|2,0,0]=4 2833 B15R2.283 O=C1CC(NCc2ccccc2)CN1 Amb27824136 [0,0,0,1,0,1|1,0,0]=3 2834 B15R2.283 O=C1CC(NCc2ccccn2)CN1 Amb28461476 [0,0,0,1,0,1|2,0,0]=4 2835 B15R2.283 O=C1CC(NCc2cccnc2)CN1 Amb27824294 [0,0,0,1,0,1|2,0,0]=4 2836 B15R2.283 O=C1CC(SCc2ccccc2)CN1 Amb28408803 [0,0,0,1,0,1|1,0,0]=3 2837 B15R2.283 O=C1CC(\C=C\c2ccccc2)CN1 Amb33083000 [0,0,0,1,0,1|1,0,1]=4 2838 B15R2.283 O=C1CCC(CCc2ccccc2)C1 Amb28124539 [0,0,0,1,0,1|1,0,0]=3 2839 B15R2.283 O=C1CCC(CCc2ccccc2)N1 Amb27596663 [0,0,0,1,0,1|2,0,0]=4 2840 B15R2.283 O=C1CCC(OCc2ccccc2)C1 Amb27465409 [0,0,0,1,0,1|1,0,0]=3 2841 B15R2.283 O=C1CCN(CCc2ccccc2)C1 Amb8947966 [0,0,0,1,0,1|1,0,0]=3 2842 B15R2.283 O=C1CC[C@@H](COc2ccccc2)N1 Amb27960874 [0,0,0,1,0,1|2,0,0]=4 2843 B15R2.283 O=C1COC(CCc2ccccc2)C1 Amb35722230 [0,0,0,1,0,1|0,0,0]=2 2844 B15R2.283 O=C1NC(CCc2ccccc2)CO1 Amb25217512 [0,0,0,1,0,1|1,0,0]=3 2845 B15R2.283 O=C1NC(\C=C\c2ccccc2)CO1 Amb33081796 [0,0,0,1,0,1|1,0,1]=4 2846 B15R2.283 O=C1NCC(CCc2ccccc2)O1 Amb27662552 [0,0,0,1,0,1|2,0,0]=4 2847 B15R2.283 O=C1NCC(CNc2ccccc2)O1 Amb25082861 [0,0,0,1,0,1|2,0,0]=4 2848 B15R2.283 O=C1NCC(COc2ccccc2)O1 Amb25861694 [0,0,0,1,0,1|2,0,0]=4 2849 B15R2.283 O=C1NCC(CSc2ccccc2)O1 Amb25756159 [0,0,0,1,0,1|2,0,0]=4 2850 B15R2.283 O=C1N[C@@H](C#Cc2ccccc2)CO1 Amb27849997 [0,0,0,1,0,1|1,0,1]=4 2851 B15R2.283 O=C1OCC(CNc2ccccc2)O1 Amb28137905 [0,0,0,1,0,1|1,0,0]=3 2852 B15R2.283 O=S1OCC(COc2ccccc2)O1 Amb3483030 [0,0,0,1,0,1|2,0,0]=4 2853 B15R2.283 OC1COC(CCc2ccccc2)C1 Amb35584952 [0,0,0,1,0,1|0,0,2]=4 2854 B15R2.283 S=C1NC(CCc2ccccc2)CO1 Amb28241411 [0,0,0,1,0,1|1,1,0]=4 2855 B15R2.388 CC1(C)OCCC1Nc2ccccc2 Amb27421295 [0,0,0,1,0,1|1,0,1]=4 2856 B15R2.388 O=S1(=O)OCCC1Cc2ccccc2 Amb24184094 [0,0,0,1,0,1|2,0,0]=4 2857 B15R2.388 O=S1(=O)OCCN1Cc2ccccc2 Amb26569615 [0,0,0,1,0,1|2,0,0]=4 2858 B15R2.465 CC1(C)OCCNC1c2ccccc2 Amb25037654 [0,0,0,1,0,1|1,0,1]=4 2859 B15R2.543 O=C1C=C(c2ccccc2)CCCC1 Amb27853297 [0,0,0,1,0,1|1,0,1]=4 2860 B15R2.543 O=C1CC(c2ccccc2)NCCN1 Amb9201094 [0,0,0,1,0,1|1,0,0]=3 2861 B15R2.543 O=C1CC(c2ccccn2)NCCN1 Amb18564859 [0,0,0,1,0,1|2,0,0]=4 2862 B15R2.543 O=C1CC(c2cccnc2)NCCN1 Amb18564860 [0,0,0,1,0,1|2,0,0]=4 2863 B15R2.543 O=C1CC(c2ccncc2)NCCN1 Amb18564861 [0,0,0,1,0,1|2,0,0]=4 2864 B15R2.543 O=C1CCCCC(c2ccccc2)C1 Amb22059558 [0,0,0,1,0,1|1,0,0]=3 2865 B15R2.543 O=C1CCCCC(c2ccccc2)N1 Amb25050480 [0,0,0,1,0,1|2,0,0]=4 2866 B15R2.543 O=C1CCCCC(c2cccnc2)C1 Amb28430436 [0,0,0,1,0,1|2,0,0]=4 2867 B15R2.543 O=C1CN(c2ccccc2)CCCN1 Amb25289905 [0,0,0,1,0,1|1,0,0]=3 2868 B15R2.543 O=C1NOCCC(c2ccccc2)N1 Amb28040922 [0,0,0,1,0,1|1,0,0]=3 2869 B15R2.543 S=C1CN(c2ccccc2)CCCN1 Amb27754068 [0,0,0,1,0,1|1,1,0]=4 2870 B15R2.617 C=C1CC(COCc2ccccc2)C1 Amb27407558 [0,0,0,1,0,1|2,0,0]=4 2871 B15R2.617 O=C1CC(COCc2ccccc2)C1 Amb10873134 [0,0,0,1,0,1|1,0,0]=3 2872 B15R2.617 O=C1CC(COCc2ccccc2)O1 Amb27962753 [0,0,0,1,0,1|0,0,0]=2 2873 B15R2.1220 O=C(O)[C@@H]1C[C@H]1CCc2ccccc2 Amb32951845 [0,0,0,1,0,1|2,0,0]=4 2874 B15R2.1222 NC(=O)NC1CC1Oc2ccccc2 Amb27204506 [0,0,0,1,0,1|2,0,0]=4 2875 B15R2.1222 O=C(O)C[C@@H]1C[C@H]1Cc2ccccc2 Amb32751776 [0,0,0,1,0,1|2,0,0]=4 2876 B15R2.1223 O=C(O)CN1CCC1c2ccccc2 Amb28065659 [0,0,0,1,0,1|2,0,0]=4 2877 B15R2.1226 O=C(Cl)CCC1CC1c2ccccc2 Amb32669164 [0,0,0,1,0,1|2,0,0]=4 2878 B15R2.1226 O=C(O)CCC1CC1c2ccccc2 Amb32669131 [0,0,0,1,0,1|2,0,0]=4 2879 B15R2.1226 O=C(O)\C=C\[C@H]1C[C@@H]1c2ccccc2 Amb27865533 [0,0,0,1,0,1|2,0,0]=4 2880 B15R2.1241 CC(=O)C1CCN1Cc2ccccc2 Amb26907827 [0,0,0,1,0,1|1,0,0]=3 2881 B15R2.1241 NC(=O)C1CCN1Cc2ccccc2 Amb22227870 [0,0,0,1,0,1|2,0,0]=4 2882 B15R2.1241 NC(=O)[C@H]1CCN1Cc2ccccc2 Amb28066635 [0,0,0,1,0,1|2,0,0]=4 2883 B15R2.1241 O=C(O)C1CCC1Nc2ccccc2 Amb27952025 [0,0,0,1,0,1|2,0,0]=4 2884 B15R2.1241 O=C(O)C1CCC1Sc2ccccc2 Amb27389651 [0,0,0,1,0,1|2,0,0]=4 2885 B15R2.1241 O=C(O)C1CCN1Cc2ccccc2 Amb9774968 [0,0,0,1,0,1|2,0,0]=4 2886 B15R2.1241 O=C(O)[C@@H]1CCN1Cc2ccccc2 Amb28058866 [0,0,0,1,0,1|2,0,0]=4 2887 B15R2.1241 O=C(O)[C@@H]1CC[C@@H]1Cc2ccccc2 Amb26054796 [0,0,0,1,0,1|2,0,0]=4 2888 B15R2.4226 C(CCNCc1ccccc1)=C2CC2 Amb27387053 [0,0,0,1,0,1|2,0,0]=4 2889 B15R2.68122 C=C(C)CC1NCCc2ccccc21 Amb27387505 [0,0,0,1,0,1|2,0,0]=4 2890 B15R2.68122 CC(=O)CC1CCCc2ccccc21 Amb27442280 [0,0,0,1,0,1|1,0,0]=3 2891 B15R2.68122 CC(=O)CC1CCOc2ccccc21 Amb22284632 [0,0,0,1,0,1|1,0,0]=3 2892 B15R2.68122 CC(=O)NC1CCCc2ncccc21 Amb27230568 [0,0,0,1,0,1|2,0,0]=4 2893 B15R2.68122 CC(=O)NC1CCNc2ccccc21 Amb28053069 [0,0,0,1,0,1|1,0,0]=3 2894 B15R2.68122 CC(=O)NC1CCSc2ccccc21 Amb8243770 [0,0,0,1,0,1|1,0,0]=3 2895 B15R2.68122 CC(=O)NC1CNCc2ccccc21 Amb19110548 [0,0,0,1,0,1|1,0,0]=3 2896 B15R2.68122 CC(=O)NC1OCCc2ccccc21 Amb27230604 [0,0,0,1,0,1|1,0,0]=3 2897 B15R2.68122 CC(=O)N[C@@H]1CCCc2cccnc21 Amb25335522 [0,0,0,1,0,1|2,0,0]=4 2898 B15R2.68122 CC(=O)N[C@H]1CCCc2cccnc21 Amb28074147 [0,0,0,1,0,1|2,0,0]=4 2899 B15R2.68122 CC(=O)OC1CCCc2ccccc21 Amb22170321 [0,0,0,1,0,1|0,0,0]=2 2900 B15R2.68122 CC(=O)OC1CCCc2cnccc21 Amb27200708 [0,0,0,1,0,1|1,0,0]=3 2901 B15R2.68122 CC(=O)OC1CNCc2ccccc21 Amb25866948 [0,0,0,1,0,1|0,0,0]=2 2902 B15R2.68122 CC(=O)\C=C1\CCSc2ccccc21 Amb27182869 [0,0,0,1,0,1|1,0,1]=4 2903 B15R2.68122 CC(=O)\C=C1\COCc2ccccc21 Amb27760886 [0,0,0,1,0,1|1,0,1]=4 2904 B15R2.68122 CS(=O)\N=C1\CCCc2ccccc21 Amb29858763 [0,0,0,1,0,1|2,0,0]=4 2905 B15R2.68122 NC(=O)CC1CCCc2ccccc21 Amb17234746 [0,0,0,1,0,1|2,0,0]=4 2906 B15R2.68122 NC(=O)CC1CCNc2ccccc21 Amb25802830 [0,0,0,1,0,1|2,0,0]=4 2907 B15R2.68122 NC(=O)CC1CCOc2ccccc21 Amb17235083 [0,0,0,1,0,1|2,0,0]=4 2908 B15R2.68122 NC(=O)CN1CCCc2ccccc21 Amb8341348 [0,0,0,1,0,1|2,0,0]=4 2909 B15R2.68122 NC(=O)NC1CCCc2ccccc21 Amb9267863 [0,0,0,1,0,1|2,0,0]=4 2910 B15R2.68122 NC(=O)N[C@@H]1CCCc2ccccc21 Amb32414133 [0,0,0,1,0,1|2,0,0]=4 2911 B15R2.68122 NC(=O)N[C@@H]1CCOc2ccccc21 Amb27224395 [0,0,0,1,0,1|2,0,0]=4 2912 B15R2.68122 O=C(Cl)CN1CCCc2ccccc21 Amb2695674 [0,0,0,1,0,1|2,0,0]=4 2913 B15R2.68122 O=C(Cl)NC1CCCc2ccccc21 Amb35637074 [0,0,0,1,0,1|2,0,0]=4 2914 B15R2.68122 O=C(Cl)NC1CCOc2ccccc21 Amb35614167 [0,0,0,1,0,1|2,0,0]=4 2915 B15R2.68122 O=C(O)CC1CCCc2ccccc21 Amb33528477 [0,0,0,1,0,1|2,0,0]=4 2916 B15R2.68122 O=C(O)CC1CCNc2ccccc21 Amb18560225 [0,0,0,1,0,1|2,0,0]=4 2917 B15R2.68122 O=C(O)CC1CCNc2ccccc21 Amb31217600 [0,0,0,1,0,1|2,0,0]=4 2918 B15R2.68122 O=C(O)CC1CCOc2ccccc21 Amb6749236 [0,0,0,1,0,1|2,0,0]=4 2919 B15R2.68122 O=C(O)CC1COCc2ccccc21 Amb24747419 [0,0,0,1,0,1|2,0,0]=4 2920 B15R2.68122 O=C(O)CC1NCCc2ccccc21 Amb1106535 [0,0,0,1,0,1|2,0,0]=4 2921 B15R2.68122 O=C(O)CC1NCCc2ccccc21 Amb2606726 [0,0,0,1,0,1|2,0,0]=4 2922 B15R2.68122 O=C(O)CC1OCCc2ccccc21 Amb18118374 [0,0,0,1,0,1|2,0,0]=4 2923 B15R2.68122 O=C(O)CC1[NH2+]CCc2ccccc21 Amb3466030 [0,0,0,1,0,1|2,0,0]=4 2924 B15R2.68122 O=C(O)CN1CCCc2ccccc21 Amb2695673 [0,0,0,1,0,1|2,0,0]=4 2925 B15R2.68122 O=C(O)C[C@@H]1OCCc2ccccc21 Amb22745967 [0,0,0,1,0,1|2,0,0]=4 2926 B15R2.68122 O=C(O)C[C@H]1CCCc2ccccc21 Amb27798753 [0,0,0,1,0,1|2,0,0]=4 2927 B15R2.68122 O=C(O)C[C@H]1NCCc2ccccc21 Amb27773975 [0,0,0,1,0,1|2,0,0]=4 2928 B15R2.68122 O=C(O)C[C@H]1OCCc2ccccc21 Amb20241802 [0,0,0,1,0,1|2,0,0]=4 2929 B15R2.68122 O=C(O)\C=C1/CCCc2ccccc21 Amb18538529 [0,0,0,1,0,1|2,0,0]=4 2930 B15R2.69183 CC(=O)C1CCCCc2ccccc21 Amb27479126 [0,0,0,1,0,1|1,0,0]=3 2931 B15R2.69183 CC(=O)N1CCCCc2ccccc21 Amb27265944 [0,0,0,1,0,1|1,0,0]=3 2932 B15R2.69183 CC(=O)N1CCCNc2ccccc21 Amb18819197 [0,0,0,1,0,1|1,0,0]=3 2933 B15R2.69183 CC(=O)N1CCCNc2cccnc21 Amb18818377 [0,0,0,1,0,1|2,0,0]=4 2934 B15R2.69183 CC(=O)N1CCCNc2ccncc21 Amb18818378 [0,0,0,1,0,1|2,0,0]=4 2935 B15R2.69183 CC(=O)N1CCCNc2cnccc21 Amb18818376 [0,0,0,1,0,1|2,0,0]=4 2936 B15R2.69183 CC(=O)N1CCCNc2ncccc21 Amb18818374 [0,0,0,1,0,1|2,0,0]=4 2937 B15R2.69183 CC(=O)N1CCNCc2cccnc21 Amb32696389 [0,0,0,1,0,1|2,0,0]=4 2938 B15R2.69183 NC(=O)C1OCCCc2ccccc21 Amb27386858 [0,0,0,1,0,1|1,0,0]=3 2939 B15R2.69183 NC(=O)N1CCCCc2ccccc21 Amb28135311 [0,0,0,1,0,1|2,0,0]=4 2940 B15R2.69183 NC(=O)N1CCCOc2ccccc21 Amb28061505 [0,0,0,1,0,1|2,0,0]=4 2941 B15R2.69183 O=C(Cl)N1CCCCc2ccccc21 Amb26935925 [0,0,0,1,0,1|2,0,0]=4 2942 B15R2.69183 O=C(O)C1=CCCCc2ccccc21 Amb2667890 [0,0,0,1,0,1|2,0,0]=4 2943 B15R2.69183 O=C(O)C1CCCCc2ccccc21 Amb19040894 [0,0,0,1,0,1|2,0,0]=4 2944 B15R2.69183 O=C(O)C1CCCNc2ccccc21 Amb18818490 [0,0,0,1,0,1|2,0,0]=4 2945 B15R2.69183 O=C(O)C1CCCOc2ccccc21 Amb17578578 [0,0,0,1,0,1|2,0,0]=4 2946 B15R2.69183 O=C(O)C1CCCSc2ccccc21 Amb18777012 [0,0,0,1,0,1|2,0,0]=4 2947 B15R2.69183 O=C(O)C1NCCCc2ccccc21 Amb27183452 [0,0,0,1,0,1|2,0,0]=4 2948 B15R2.69183 O=C(O)C1OCCCc2ccccc21 Amb8009504 [0,0,0,1,0,1|1,0,0]=3 2949 B15R2.30 Cc1cc(C2CCCC(=O)C2)ccn1 Amb27960965 [0,1,0,1,0,0|2,0,0]=4 2950 B15R2.30 Cc1cccc(C2CC(=O)CCN2)c1 Amb17234676 [0,1,0,1,0,0|2,0,0]=4 2951 B15R2.30 Cc1cccc(C2CCCC(=O)C2)c1 Amb18564534 [0,1,0,1,0,0|1,0,0]=3 2952 B15R2.30 Cc1cccc(C2CCCC(=O)C2)n1 Amb27641178 [0,1,0,1,0,0|2,0,0]=4 2953 B15R2.30 Cc1cccc(C2CCCC(=O)N2)c1 Amb32862505 [0,1,0,1,0,0|2,0,0]=4 2954 B15R2.30 Cc1cccc(C2CCNC(=O)N2)c1 Amb25776173 [0,1,0,1,0,0|2,0,0]=4 2955 B15R2.30 Cc1cncc(C2CCCC(=O)C2)c1 Amb27851012 [0,1,0,1,0,0|2,0,0]=4 2956 B15R2.30 Nc1cc(C2CCCC(=O)C2)ccn1 Amb27621466 [0,1,0,1,0,0|2,0,0]=4 2957 B15R2.30 Nc1cccc(C2CCCC(=O)C2)c1 Amb27388109 [0,1,0,1,0,0|1,0,0]=3 2958 B15R2.30 Nc1cccc(C2CCCC(=O)C2)n1 Amb28068902 [0,1,0,1,0,0|2,0,0]=4 2959 B15R2.30 Nc1cccc(C2CCCC(=O)N2)c1 Amb32675089 [0,1,0,1,0,0|2,0,0]=4 2960 B15R2.30 Nc1cccc(C2CCNC(=O)C2)c1 Amb26066036 [0,1,0,1,0,0|1,0,0]=3 2961 B15R2.30 Nc1cccc(N2CCNC(=O)C2)c1 Amb8825394 [0,1,0,1,0,0|2,0,0]=4 2962 B15R2.30 Nc1ccnc(C2CCCC(=O)C2)c1 Amb27406042 [0,1,0,1,0,0|2,0,0]=4 2963 B15R2.30 Nc1ccnc(C2CCNC(=O)C2)c1 Amb27759025 [0,1,0,1,0,0|2,0,0]=4 2964 B15R2.30 O=C1CC(c2cccc(Cl)c2)CCN1 Amb27965592 [0,1,0,1,0,0|1,0,0]=3 2965 B15R2.30 O=C1CC(c2cccc(Cl)c2)CCO1 Amb27632074 [0,1,0,1,0,0|0,0,0]=2 2966 B15R2.30 O=C1CCCC(c2cc(Br)ccn2)C1 Amb27388070 [0,1,0,1,0,0|2,0,0]=4 2967 B15R2.30 O=C1CCCC(c2cccc(Br)c2)C1 Amb24698987 [0,1,0,1,0,0|1,0,0]=3 2968 B15R2.30 O=C1CCCC(c2cccc(Cl)c2)C1 Amb18568611 [0,1,0,1,0,0|1,0,0]=3 2969 B15R2.30 O=C1CCCC(c2cccc(Cl)c2)N1 Amb32862527 [0,1,0,1,0,0|2,0,0]=4 2970 B15R2.30 O=C1CCCC(c2cccc(Cl)c2)O1 Amb27203916 [0,1,0,1,0,0|2,0,0]=4 2971 B15R2.30 O=C1CCCC(c2cccc(Cl)n2)C1 Amb28042463 [0,1,0,1,0,0|2,0,0]=4 2972 B15R2.30 O=C1CCCC(c2cccc(F)c2)C1 Amb18565094 [0,1,0,1,0,0|1,0,0]=3 2973 B15R2.30 O=C1CCCC(c2cccc(F)c2)N1 Amb32862552 [0,1,0,1,0,0|2,0,0]=4 2974 B15R2.30 O=C1CCCC(c2cccc(O)c2)C1 Amb27600227 [0,1,0,1,0,0|1,0,0]=3 2975 B15R2.30 O=C1CCCC(c2cccc(O)n2)C1 Amb27641221 [0,1,0,1,0,0|2,0,0]=4 2976 B15R2.30 O=C1CCCC(c2ccnc(Br)c2)C1 Amb27410682 [0,1,0,1,0,0|2,0,0]=4 2977 B15R2.30 O=C1CCCN(c2cccc(Cl)c2)C1 Amb27163290 [0,1,0,1,0,0|2,0,0]=4 2978 B15R2.30 O=C1CCC[C@@H](c2cccc(Cl)c2)O1 Amb27230014 [0,1,0,1,0,0|2,0,0]=4 2979 B15R2.30 O=C1CCC[C@H](c2cccc(Cl)c2)O1 Amb27487928 [0,1,0,1,0,0|2,0,0]=4 2980 B15R2.30 O=C1CCNC(c2cccc(Br)c2)C1 Amb17263738 [0,1,0,1,0,0|2,0,0]=4 2981 B15R2.30 O=C1CCNC(c2cccc(Cl)c2)C1 Amb17240443 [0,1,0,1,0,0|2,0,0]=4 2982 B15R2.30 O=C1CCNC(c2cccc(F)c2)C1 Amb18816278 [0,1,0,1,0,0|2,0,0]=4 2983 B15R2.30 O=C1C[C@H](c2cccc(Cl)c2)CCO1 Amb27393669 [0,1,0,1,0,0|0,0,0]=2 2984 B15R2.30 O=C1NC(c2cccc(Br)n2)CCO1 Amb28281856 [0,1,0,1,0,0|2,0,0]=4 2985 B15R2.30 O=C1NC(c2cccc(O)c2)CCO1 Amb28319620 [0,1,0,1,0,0|1,0,0]=3 2986 B15R2.30 O=C1NCCC(c2cccc(Br)c2)N1 Amb25699908 [0,1,0,1,0,0|2,0,0]=4 2987 B15R2.30 O=C1NCCC(c2cccc(Cl)c2)N1 Amb28248710 [0,1,0,1,0,0|2,0,0]=4 2988 B15R2.30 O=C1NCCC(c2cccc(F)c2)N1 Amb24555116 [0,1,0,1,0,0|2,0,0]=4 2989 B15R2.30 O=C1N[C@@H](c2ccnc(Br)c2)CCO1 Amb27206665 [0,1,0,1,0,0|2,0,0]=4 2990 B15R2.30 O=C1N[C@H](c2cccc(Br)n2)CCO1 Amb28348563 [0,1,0,1,0,0|2,0,0]=4 2991 B15R2.30 O=C1N[C@H](c2cccc(Cl)c2)CCO1 Amb28044815 [0,1,0,1,0,0|1,0,0]=3 2992 B15R2.30 O=C1N[C@H](c2ccnc(Br)c2)CCO1 Amb27273462 [0,1,0,1,0,0|2,0,0]=4 2993 B15R2.30 OC1CC(c2cccc(F)c2)CCO1 Amb27164452 [0,1,0,1,0,0|0,0,2]=4 2994 B15R2.377 CC(=O)NC1CCc2cc(Cl)ccc21 Amb11529735 [0,1,0,1,0,0|1,0,0]=3 2995 B15R2.377 CC(C)OC1CCc2cc(Br)ccc21 Amb13951782 [0,1,0,1,0,0|1,0,1]=4 2996 B15R2.377 Cc1ccc2c(c1)CCC2CC(=O)O Amb17401399 [0,1,0,1,0,0|2,0,0]=4 2997 B15R2.377 O=C(O)CC1CCc2cc(Br)ccc21 Amb18667671 [0,1,0,1,0,0|2,0,0]=4 2998 B15R2.377 O=C(O)CC1CCc2cc(Cl)ccc21 Amb17404039 [0,1,0,1,0,0|2,0,0]=4 2999 B15R2.377 O=C(O)CC1CCc2cc(F)ccc21 Amb17401845 [0,1,0,1,0,0|2,0,0]=4 3000 B15R2.377 O=C(O)CC1CCc2cc(O)ccc21 Amb26637649 [0,1,0,1,0,0|2,0,0]=4 3001 B15R2.377 O=C(O)C[C@@H]1CCc2cc(O)ccc21 Amb27650619 [0,1,0,1,0,0|2,0,0]=4 3002 B15R2.384 CC(=O)N1CCCc2cc(Br)ccc21 Amb2099591 [0,1,0,1,0,0|1,0,0]=3 3003 B15R2.384 CC(=O)N1CCCc2cc(Cl)ccc21 Amb18866071 [0,1,0,1,0,0|1,0,0]=3 3004 B15R2.384 CC(=O)N1CCCc2cc(N)ccc21 Amb13952090 [0,1,0,1,0,0|1,0,0]=3 3005 B15R2.384 CC(=O)N1CCCc2cc(N)ccc21 Amb6682894 [0,1,0,1,0,0|1,0,0]=3 3006 B15R2.384 CC(=O)N1CCCc2cc(O)ccc21 Amb18650811 [0,1,0,1,0,0|1,0,0]=3 3007 B15R2.384 CC(=O)N1CCCc2cc(S)ccc21 Amb28121539 [0,1,0,1,0,0|1,0,0]=3 3008 B15R2.384 CC(=O)N1CCNc2cc(F)ccc21 Amb18815184 [0,1,0,1,0,0|2,0,0]=4 3009 B15R2.384 CC(=O)N1CCNc2cc(O)ccc21 Amb18817392 [0,1,0,1,0,0|2,0,0]=4 3010 B15R2.384 CC(=O)N1CCOc2cc(Br)ccc21 Amb22739668 [0,1,0,1,0,0|2,0,0]=4 3011 B15R2.384 CC(=O)N1CCOc2cc(N)ccc21 Amb18565086 [0,1,0,1,0,0|2,0,0]=4 3012 B15R2.384 NC(=O)N1CCCc2cc(N)ccc21 Amb6683177 [0,1,0,1,0,0|2,0,0]=4 3013 B15R2.384 Nc1ccc2c(c1)CCCC2C(=O)O Amb28343102 [0,1,0,1,0,0|2,0,0]=4 3014 B15R2.384 Nc1ccc2c(c1)CCCC2C(=O)O Amb33804566 [0,1,0,1,0,0|2,0,0]=4 3015 B15R2.384 O=C(O)C1CCCc2cc(O)ccc21 Amb18651067 [0,1,0,1,0,0|2,0,0]=4 3016 B15R2.1115 Cc1cccc(CC2CCC(=O)C2)c1 Amb27867267 [0,1,0,1,0,0|1,0,0]=3 3017 B15R2.1115 Cc1cccc(CC2CCC(=O)O2)c1 Amb27850937 [0,1,0,1,0,0|2,0,0]=4 3018 B15R2.1115 Cc1cccc(CC2CNC(=O)O2)c1 Amb27798346 [0,1,0,1,0,0|2,0,0]=4 3019 B15R2.1115 Cc1cccc(CN2CCC(=O)C2)c1 Amb19060552 [0,1,0,1,0,0|2,0,0]=4 3020 B15R2.1115 NC1=NC(Cc2cccc(Cl)c2)CO1 Amb27856140 [0,1,0,1,0,0|2,0,0]=4 3021 B15R2.1115 NC1=NC(Cc2cccc(F)c2)CO1 Amb27174275 [0,1,0,1,0,0|2,0,0]=4 3022 B15R2.1115 Nc1cccc(CC2CCC(=O)N2)c1 Amb18819187 [0,1,0,1,0,0|2,0,0]=4 3023 B15R2.1115 Nc1cccc(NC2CNC(=O)C2)c1 Amb27824242 [0,1,0,1,0,0|2,0,0]=4 3024 B15R2.1115 O=C1CC(Cc2cccc(Cl)c2)CN1 Amb28131641 [0,1,0,1,0,0|1,0,0]=3 3025 B15R2.1115 O=C1CC(Cc2cccc(F)c2)CN1 Amb28400177 [0,1,0,1,0,0|1,0,0]=3 3026 B15R2.1115 O=C1CCC(Cc2cccc(Cl)c2)N1 Amb27457427 [0,1,0,1,0,0|2,0,0]=4 3027 B15R2.1115 O=C1CCC(Cc2cccc(I)c2)N1 Amb27476906 [0,1,0,1,0,0|2,0,0]=4 3028 B15R2.1115 O=C1CCC(Cc2cccc(O)c2)O1 Amb20668453 [0,1,0,1,0,0|2,0,0]=4 3029 B15R2.1115 O=C1CCC(Cc2cncc(Br)c2)C1 Amb27204407 [0,1,0,1,0,0|2,0,0]=4 3030 B15R2.1115 O=C1CCC(Nc2cccc(Cl)c2)C1 Amb28121847 [0,1,0,1,0,0|2,0,0]=4 3031 B15R2.1115 O=C1CCC(Oc2cccc(F)c2)C1 Amb28289054 [0,1,0,1,0,0|2,0,0]=4 3032 B15R2.1115 O=C1CCC(Sc2cccc(F)c2)C1 Amb28045100 [0,1,0,1,0,0|2,0,0]=4 3033 B15R2.1115 O=C1CCN(Cc2cccc(Br)c2)C1 Amb27756755 [0,1,0,1,0,0|2,0,0]=4 3034 B15R2.1115 O=C1CCN(Cc2cccc(Cl)c2)C1 Amb27272883 [0,1,0,1,0,0|2,0,0]=4 3035 B15R2.1115 O=C1CC[C@@H](Cc2cccc(O)c2)O1 Amb24506328 [0,1,0,1,0,0|2,0,0]=4 3036 B15R2.1115 O=C1CC[C@H](Cc2cccc(O)c2)O1 Amb25073401 [0,1,0,1,0,0|2,0,0]=4 3037 B15R2.1115 O=C1NCC(Cc2cccc(Br)c2)O1 Amb27200725 [0,1,0,1,0,0|2,0,0]=4 3038 B15R2.1115 O=C1NCC(Cc2cccc(F)c2)O1 Amb24506386 [0,1,0,1,0,0|2,0,0]=4 3039 B15R2.7127 O=C(O)C1CCC1c2cccc(Br)c2 Amb34892407 [0,1,0,1,0,0|2,0,0]=4 3040 B15R2.7134 Cc1cccc([C@H]2C[C@@H]2CC(=O)O)c1 Amb28436860 [0,1,0,1,0,0|2,0,0]=4 3041 B15R2.7134 O=C(O)CC1CC1c2cccc(F)c2 Amb27659428 [0,1,0,1,0,0|2,0,0]=4 3042 B15R2.7134 O=C(O)C[C@H]1C[C@@H]1c2cccc(F)c2 Amb28385601 [0,1,0,1,0,0|2,0,0]=4 3043 B15R2.13624 Cc1cccc2c1C(CC(=O)O)CC2 Amb17401400 [0,1,0,1,0,0|2,0,0]=4 3044 B15R2.13624 O=C(O)CC1CCc2cccc(Cl)c21 Amb17404040 [0,1,0,1,0,0|2,0,0]=4 3045 B15R2.13624 O=C(O)CC1CCc2cccc(F)c21 Amb17401846 [0,1,0,1,0,0|2,0,0]=4 3046 B15R2.13624 O=C(O)CC1CCc2cccc(O)c21 Amb27231610 [0,1,0,1,0,0|2,0,0]=4 3047 B15R2.61345 CC(=O)N1CCCc2cccc(C)c21 Amb22000047 [0,1,0,1,0,0|1,0,0]=3 3048 B15R2.61345 CC(=O)N1CCCc2cccc(N)c21 Amb5750773 [0,1,0,1,0,0|1,0,0]=3 3049 B15R2.61345 CC(=O)N1CCCc2cccc(O)c21 Amb22750994 [0,1,0,1,0,0|1,0,0]=3 3050 B15R2.61345 NC(=O)C1CCCc2cccc(Cl)c21 Amb28058317 [0,1,0,1,0,0|2,0,0]=4 3051 B15R2.61345 Nc1cccc2c1C(C(=O)O)CCC2 Amb28119888 [0,1,0,1,0,0|2,0,0]=4 3052 B15R2.305 Cc1ccccc1CC2CCC(=O)N2 Amb27979116 [0,1,0,1,0,0|2,0,0]=4 3053 B15R2.305 Cc1ccccc1CC2CCC(=O)O2 Amb27235204 [0,1,0,1,0,0|2,0,0]=4 3054 B15R2.305 Cc1ccccc1CC2CNC(=O)C2 Amb27493006 [0,1,0,1,0,0|1,0,0]=3 3055 B15R2.305 Cc1ccccc1CC2CNC(=O)O2 Amb25035880 [0,1,0,1,0,0|2,0,0]=4 3056 B15R2.305 Cc1ccccc1CN2CCC(=O)C2 Amb19060551 [0,1,0,1,0,0|2,0,0]=4 3057 B15R2.305 Cc1ccccc1NC2CCC(=O)C2 Amb27614219 [0,1,0,1,0,0|2,0,0]=4 3058 B15R2.305 NC1=N[C@@H](Cc2ccccc2Cl)CO1 Amb27464390 [0,1,0,1,0,0|2,0,0]=4 3059 B15R2.305 O=C1CCC(Cc2ccccc2Br)N1 Amb27858199 [0,1,0,1,0,0|2,0,0]=4 3060 B15R2.305 O=C1CCC(Cc2ncccc2Br)C1 Amb28059961 [0,1,0,1,0,0|2,0,0]=4 3061 B15R2.305 O=C1CCC(Oc2ccccc2F)C1 Amb27656595 [0,1,0,1,0,0|2,0,0]=4 3062 B15R2.305 O=C1CCN(Cc2ccccc2F)C1 Amb8947957 [0,1,0,1,0,0|2,0,0]=4 3063 B15R2.305 O=C1NCC(Cc2ccccc2Cl)O1 Amb26938771 [0,1,0,1,0,0|2,0,0]=4 3064 B15R2.305 O=C1NCC(Cc2ccccc2F)O1 Amb28291470 [0,1,0,1,0,0|2,0,0]=4 3065 B15R2.305 O=C1NCC(Cc2ccccc2O)O1 Amb18651410 [0,1,0,1,0,0|2,0,0]=4 3066 B15R2.332 CC1NC(c2ccccc2F)CCO1 Amb33194471 [0,1,0,1,0,0|1,0,1]=4 3067 B15R2.332 Cc1ccccc1C2CC(=O)CCN2 Amb17234674 [0,1,0,1,0,0|2,0,0]=4 3068 B15R2.332 Cc1ccccc1C2CC(=O)CCO2 Amb28320981 [0,1,0,1,0,0|2,0,0]=4 3069 B15R2.332 Cc1ccccc1C2CCCC(=O)C2 Amb18564533 [0,1,0,1,0,0|1,0,0]=3 3070 B15R2.332 Cc1ccccc1C2CCNC(=O)N2 Amb26515025 [0,1,0,1,0,0|2,0,0]=4 3071 B15R2.332 Cc1ccccc1[C@@H]2CCOC(=O)N2 Amb27811989 [0,1,0,1,0,0|1,0,0]=3 3072 B15R2.332 Cc1cccnc1C2CCCC(=O)C2 Amb26330586 [0,1,0,1,0,0|2,0,0]=4 3073 B15R2.332 Cc1ccncc1C2CCCC(=O)C2 Amb27417750 [0,1,0,1,0,0|2,0,0]=4 3074 B15R2.332 Nc1ccccc1C2CCCC(=O)C2 Amb24731942 [0,1,0,1,0,0|1,0,0]=3 3075 B15R2.332 Nc1ccccc1C2CCNC(=O)C2 Amb25995479 [0,1,0,1,0,0|1,0,0]=3 3076 B15R2.332 Nc1ccccc1C2CCNC(=O)O2 Amb27965870 [0,1,0,1,0,0|2,0,0]=4 3077 B15R2.332 Nc1ccccc1N2CCNC(=O)C2 Amb1113930 [0,1,0,1,0,0|2,0,0]=4 3078 B15R2.332 Nc1cccnc1C2CCCC(=O)C2 Amb28197026 [0,1,0,1,0,0|2,0,0]=4 3079 B15R2.332 O=C1CC(c2ccccc2Cl)CCN1 Amb27199934 [0,1,0,1,0,0|1,0,0]=3 3080 B15R2.332 O=C1CCCC(c2ccccc2Br)C1 Amb26850825 [0,1,0,1,0,0|1,0,0]=3 3081 B15R2.332 O=C1CCCC(c2ccccc2Cl)C1 Amb18568610 [0,1,0,1,0,0|1,0,0]=3 3082 B15R2.332 O=C1CCCC(c2ccccc2Cl)O1 Amb27830010 [0,1,0,1,0,0|2,0,0]=4 3083 B15R2.332 O=C1CCCC(c2ccccc2F)C1 Amb21959247 [0,1,0,1,0,0|1,0,0]=3 3084 B15R2.332 O=C1CCCC(c2ccccc2F)O1 Amb27417401 [0,1,0,1,0,0|2,0,0]=4 3085 B15R2.332 O=C1CCCC(c2ccccc2I)O1 Amb28132810 [0,1,0,1,0,0|2,0,0]=4 3086 B15R2.332 O=C1CCCC(c2cccnc2Br)C1 Amb27494775 [0,1,0,1,0,0|2,0,0]=4 3087 B15R2.332 O=C1CCCC(c2ccncc2Br)C1 Amb27780611 [0,1,0,1,0,0|2,0,0]=4 3088 B15R2.332 O=C1CCCC(c2ccncc2Cl)C1 Amb27494824 [0,1,0,1,0,0|2,0,0]=4 3089 B15R2.332 O=C1CCCC(c2ccncc2F)C1 Amb27585992 [0,1,0,1,0,0|2,0,0]=4 3090 B15R2.332 O=C1CCCC(c2ncccc2O)C1 Amb25315298 [0,1,0,1,0,0|2,0,0]=4 3091 B15R2.332 O=C1CCC[C@@H](c2ccccc2Br)O1 Amb28119123 [0,1,0,1,0,0|2,0,0]=4 3092 B15R2.332 O=C1CCNC(c2ccccc2Cl)C1 Amb17240441 [0,1,0,1,0,0|2,0,0]=4 3093 B15R2.332 O=C1CCNC(c2ccccc2F)C1 Amb17235572 [0,1,0,1,0,0|2,0,0]=4 3094 B15R2.332 O=C1CN(c2ccccc2Br)CCN1 Amb27849277 [0,1,0,1,0,0|2,0,0]=4 3095 B15R2.332 O=C1NC(c2ccccc2Cl)CCO1 Amb27604417 [0,1,0,1,0,0|1,0,0]=3 3096 B15R2.332 O=C1NC(c2cccnc2Br)CCO1 Amb27456453 [0,1,0,1,0,0|2,0,0]=4 3097 B15R2.332 O=C1NC(c2cccnc2Cl)CCO1 Amb27207394 [0,1,0,1,0,0|2,0,0]=4 3098 B15R2.332 O=C1NCCC(c2ccccc2Br)N1 Amb28063131 [0,1,0,1,0,0|2,0,0]=4 3099 B15R2.332 O=C1NCCC(c2ccccc2Cl)N1 Amb26647323 [0,1,0,1,0,0|2,0,0]=4 3100 B15R2.332 O=C1NCCC(c2ccccc2F)N1 Amb27478694 [0,1,0,1,0,0|2,0,0]=4 3101 B15R2.332 O=C1N[C@@H](c2ccccc2Br)CCO1 Amb28136637 [0,1,0,1,0,0|1,0,0]=3 3102 B15R2.332 O=C1N[C@@H](c2ccccc2O)CCO1 Amb27483722 [0,1,0,1,0,0|1,0,0]=3 3103 B15R2.332 O=C1N[C@H](c2ccccc2Br)CCO1 Amb27222666 [0,1,0,1,0,0|1,0,0]=3 3104 B15R2.332 O=C1N[C@H](c2ccccc2O)CCO1 Amb27585890 [0,1,0,1,0,0|1,0,0]=3 3105 B15R2.332 O=C1N[C@H](c2cccnc2Cl)CCO1 Amb27174415 [0,1,0,1,0,0|2,0,0]=4 3106 B15R2.332 OC1CC(c2ccccc2F)CCO1 Amb27255233 [0,1,0,1,0,0|0,0,2]=4 3107 B15R2.1237 CC(=O)N1CCNc2ccccc2C1 Amb8395947 [0,1,0,1,0,0|2,0,0]=4 3108 B15R2.1237 CC(=O)N1CCOc2ccccc2C1 Amb20512765 [0,1,0,1,0,0|2,0,0]=4 3109 B15R2.1237 NC(=O)C1CCCc2ccccc2N1 Amb22546373 [0,1,0,1,0,0|2,0,0]=4 3110 B15R2.1237 NC(=O)N1CCCc2ccccc2C1 Amb27419271 [0,1,0,1,0,0|2,0,0]=4 3111 B15R2.1237 O=C(O)C1=Cc2ccccc2CCC1 Amb25808770 [0,1,0,1,0,0|2,0,0]=4 3112 B15R2.1237 O=C(O)C1CCCc2ccccc2C1 Amb25690195 [0,1,0,1,0,0|2,0,0]=4 3113 B15R2.1237 O=C(O)C1CCCc2ccccc2N1 Amb18818503 [0,1,0,1,0,0|2,0,0]=4 3114 B15R2.1660 CC(=O)CCC1Cc2ccccc2C1 Amb33342532 [0,1,0,1,0,0|1,0,0]=3 3115 B15R2.1660 CC(=O)OCC1Cc2ccccc2N1 Amb27397613 [0,1,0,1,0,0|0,0,0]=2 3116 B15R2.1660 CC(=O)OCc1nc2ccccc2s1 Amb2852356 [0,1,0,1,0,0|1,0,1]=4 3117 B15R2.1660 CC(=O)\C=C\C1Cc2ccccc2C1 Amb33342534 [0,1,0,1,0,0|1,0,1]=4 3118 B15R2.1660 CS(=O)CCC1Cc2ccccc2N1 Amb27855272 [0,1,0,1,0,0|2,0,0]=4 3119 B15R2.1660 O=C(Cl)NCC1Cc2ccccc2O1 Amb35625733 [0,1,0,1,0,0|2,0,0]=4 3120 B15R2.1660 O=C(O)CCC1Cc2ccccc2C1 Amb26493324 [0,1,0,1,0,0|2,0,0]=4 3121 B15R2.1660 O=C(O)CCC1Cc2ccccc2O1 Amb24684259 [0,1,0,1,0,0|2,0,0]=4 3122 B15R2.1660 O=C(O)CCC1Cc2ccccc2S1 Amb26015870 [0,1,0,1,0,0|2,0,0]=4 3123 B15R2.1660 O=C(O)CC[C@@H]1Cc2ccccc2O1 Amb27878801 [0,1,0,1,0,0|2,0,0]=4 3124 B15R2.1668 CC(=O)CC1COc2ccccc2C1 Amb33424079 [0,1,0,1,0,0|2,0,0]=4 3125 B15R2.1668 CC(=O)CC1COc2ccccc2O1 Amb33322029 [0,1,0,1,0,0|2,0,0]=4 3126 B15R2.1668 CC(=O)NC1CCc2ncccc2C1 Amb27463388 [0,1,0,1,0,0|2,0,0]=4 3127 B15R2.1668 CC(=O)NC1CNc2ccccc2C1 Amb6245409 [0,1,0,1,0,0|2,0,0]=4 3128 B15R2.1668 CC(=O)NC1COc2ccccc2C1 Amb25878251 [0,1,0,1,0,0|2,0,0]=4 3129 B15R2.1668 CC(=O)N[C@@H]1COc2ccccc2C1 Amb28128686 [0,1,0,1,0,0|2,0,0]=4 3130 B15R2.1668 CC(=O)N[C@H]1CCc2ccccc2C1 Amb27949587 [0,1,0,1,0,0|1,0,0]=3 3131 B15R2.1668 NC(=O)CC1CCc2ccccc2N1 Amb27746916 [0,1,0,1,0,0|2,0,0]=4 3132 B15R2.1668 NC(=O)OC1CCc2ccccc2C1 Amb27747124 [0,1,0,1,0,0|1,0,0]=3 3133 B15R2.1668 O=C(Cl)NC1CCc2ccccc2C1 Amb35625502 [0,1,0,1,0,0|2,0,0]=4 3134 B15R2.1668 O=C(O)CC1CCc2ccccc2C1 Amb17940131 [0,1,0,1,0,0|2,0,0]=4 3135 B15R2.1668 O=C(O)CC1CCc2ccccc2N1 Amb2695229 [0,1,0,1,0,0|2,0,0]=4 3136 B15R2.1668 O=C(O)CC1CCc2ccccc2N1 Amb33299327 [0,1,0,1,0,0|2,0,0]=4 3137 B15R2.1668 O=C(O)CC1CCc2ccccc2O1 Amb27456464 [0,1,0,1,0,0|2,0,0]=4 3138 B15R2.1668 O=C(O)C[C@@H]1CCc2ccccc2O1 Amb27946989 [0,1,0,1,0,0|2,0,0]=4 3139 B15R2.1668 O=C(O)C[C@H]1CCc2ccccc2O1 Amb27660910 [0,1,0,1,0,0|2,0,0]=4 3140 B15R2.8792 Cc1ccccc1C2CCC2C(=O)O Amb27216534 [0,1,0,1,0,0|2,0,0]=4 3141 B15R2.8792 O=C(O)C1CCC1c2ccccc2Cl Amb25801262 [0,1,0,1,0,0|2,0,0]=4 3142 B15R2.8795 NC(=O)NC1CC1c2ccccc2Cl Amb25108309 [0,1,0,1,0,0|2,0,0]=4 3143 B15R2.13587 CC(=O)NC1CCc2c(N)cccc21 Amb33039841 [0,1,0,1,0,0|1,0,0]=3 3144 B15R2.13587 CC(=O)N[C@@H]1CCc2c(N)cccc21 Amb32697385 [0,1,0,1,0,0|1,0,0]=3 3145 B15R2.13587 CC(=O)OC1CCc2c(Cl)ccnc21 Amb21858841 [0,1,0,1,0,0|1,0,0]=3 3146 B15R2.13587 CC(=O)\C=C1\CCc2c(Br)cccc21 Amb27776293 [0,1,0,1,0,0|1,0,1]=4 3147 B15R2.13587 Cc1cccc2c1CCC2CC(=O)O Amb17234920 [0,1,0,1,0,0|2,0,0]=4 3148 B15R2.13587 Cc1cccc2c1CCC2CC(N)=O Amb17234742 [0,1,0,1,0,0|2,0,0]=4 3149 B15R2.13587 NC(=O)CC1CCc2c(Cl)cccc21 Amb17240477 [0,1,0,1,0,0|2,0,0]=4 3150 B15R2.13587 NC(=O)CC1CCc2c(F)cccc21 Amb17235598 [0,1,0,1,0,0|2,0,0]=4 3151 B15R2.13587 O=C(O)CC1CCc2c(Cl)cccc21 Amb17240753 [0,1,0,1,0,0|2,0,0]=4 3152 B15R2.13587 O=C(O)CC1CCc2c(F)cccc21 Amb17235893 [0,1,0,1,0,0|2,0,0]=4 3153 B15R2.13611 CC(=O)N1CCCc2c(N)cccc21 Amb18061632 [0,1,0,1,0,0|1,0,0]=3 3154 B15R2.13611 CC(=O)N1CCNc2c(F)cccc21 Amb18815185 [0,1,0,1,0,0|2,0,0]=4 3155 B15R2.13611 CC(=O)N1CCOc2c(N)cccc21 Amb18565087 [0,1,0,1,0,0|2,0,0]=4 3156 B15R2.13611 NC(=O)N1CCCc2c(N)cccc21 Amb25870181 [0,1,0,1,0,0|2,0,0]=4 3157 B15R2.13611 Nc1cccc2c1CCCC2C(=O)O Amb27232965 [0,1,0,1,0,0|2,0,0]=4 3158 B15R2.13611 O=C(O)C1CCCc2c(O)cccc21 Amb22494125 [0,1,0,1,0,0|2,0,0]=4 3159 B15R2.59 CC(=N)N1CCC(c2ccccc2)C1 Amb28200474 [0,1,0,1,0,0|2,0,0]=4 3160 B15R2.59 CC(=O)N1CCC(c2ccccc2)=N1 Amb6397024 [0,1,0,1,0,0|1,0,1]=4 3161 B15R2.59 CC(=O)N1CCC(c2ccccc2)C1 Amb5797423 [0,1,0,1,0,0|1,0,0]=3 3162 B15R2.59 CC(=O)N1CNC(c2ccccc2)C1 Amb22757115 [0,1,0,1,0,0|2,0,0]=4 3163 B15R2.59 NC(=O)C1CCC(c2ccccc2)N1 Amb27862378 [0,1,0,1,0,0|2,0,0]=4 3164 B15R2.59 NC(=O)C1CCC(c2ccccc2)N1 Amb33329382 [0,1,0,1,0,0|2,0,0]=4 3165 B15R2.59 NC(=O)N1CCC(c2ccccc2)C1 Amb19078282 [0,1,0,1,0,0|2,0,0]=4 3166 B15R2.59 NC(=O)[C@@H]1CC[C@@H](c2ccccc2)C1 Amb27845488 [0,1,0,1,0,0|2,0,0]=4 3167 B15R2.59 NC(=O)[C@H]1CC[C@@H](c2ccccc2)C1 Amb27619185 [0,1,0,1,0,0|2,0,0]=4 3168 B15R2.59 O=C(Cl)N1CCC(c2ccccc2)C1 Amb27747311 [0,1,0,1,0,0|2,0,0]=4 3169 B15R2.59 O=C(O)C1CCC(c2ccccc2)C1 Amb33547155 [0,1,0,1,0,0|2,0,0]=4 3170 B15R2.59 O=C(O)C1CCC(c2ccccc2)N1 Amb32666126 [0,1,0,1,0,0|2,0,0]=4 3171 B15R2.59 O=C(O)C1CCC(c2ccccc2)N1 Amb6739840 [0,1,0,1,0,0|2,0,0]=4 3172 B15R2.59 O=C(O)C1CCC(c2ccccc2)O1 Amb24729953 [0,1,0,1,0,0|2,0,0]=4 3173 B15R2.59 O=C(O)[C@@H]1CCC(c2ccccc2)N1 Amb28436804 [0,1,0,1,0,0|2,0,0]=4 3174 B15R2.59 O=C(O)[C@@H]1CC[C@@H](c2ccccc2)C1 Amb28384470 [0,1,0,1,0,0|2,0,0]=4 3175 B15R2.59 O=C(O)[C@@H]1CC[C@@H](c2ccccc2)N1 Amb25264385 [0,1,0,1,0,0|2,0,0]=4 3176 B15R2.59 O=C(O)[C@@H]1CC[C@@H](c2ccccc2)N1 Amb32664813 [0,1,0,1,0,0|2,0,0]=4 3177 B15R2.59 O=C(O)[C@@H]1CC[C@H](c2ccccc2)O1 Amb24742589 [0,1,0,1,0,0|2,0,0]=4 3178 B15R2.59 O=C(O)[C@H]1CC[C@@H](c2ccccc2)N1 Amb27420118 [0,1,0,1,0,0|2,0,0]=4 3179 B15R2.59 O=C(O)[C@H]1CC[C@@H](c2ccccc2)O1 Amb28052209 [0,1,0,1,0,0|2,0,0]=4 3180 B15R2.59 O=C(O)[C@H]1CC[C@H](c2ccccc2)N1 Amb26838899 [0,1,0,1,0,0|2,0,0]=4 3181 B15R2.59 O=C(O)[C@H]1CC[C@H](c2ccccc2)N1 Amb26930070 [0,1,0,1,0,0|2,0,0]=4 3182 B15R2.59 O=C(O)[C@H]1CC[C@H](c2ccccc2)O1 Amb28052208 [0,1,0,1,0,0|2,0,0]=4 3183 B15R2.297 CC(c1ccccc1)C2CC(=O)CO2 Amb35693012 [0,1,0,1,0,0|2,0,0]=4 3184 B15R2.297 CC(c1ccccc1)C2CC(=O)NN2 Amb35701214 [0,1,0,1,0,0|2,0,0]=4 3185 B15R2.297 CC(c1ccccc1)C2CNC(=O)C2 Amb25067874 [0,1,0,1,0,0|1,0,0]=3 3186 B15R2.297 CC(c1ccccc1)C2CNC(=O)O2 Amb25037772 [0,1,0,1,0,0|2,0,0]=4 3187 B15R2.297 CC(c1ccccc1)C2COC(=O)N2 Amb26311941 [0,1,0,1,0,0|1,0,0]=3 3188 B15R2.297 CC(c1ccccc1)C2COC(N)=N2 Amb27747068 [0,1,0,1,0,0|2,0,0]=4 3189 B15R2.297 CC(c1ccccc1)N2CCC(=O)C2 Amb8947951 [0,1,0,1,0,0|2,0,0]=4 3190 B15R2.297 CC1CC(C(O)c2ccccc2)CO1 Amb27595702 [0,1,0,1,0,0|1,0,1]=4 3191 B15R2.297 C[C@@H](c1ccccc1)N2CCC(=O)C2 Amb8386518 [0,1,0,1,0,0|2,0,0]=4 3192 B15R2.297 NC(C1=NOC(=O)C1)c2ccccc2 Amb27495694 [0,1,0,1,0,0|1,0,1]=4 3193 B15R2.297 N[C@@H](c1ccccc1)[C@@H]2COC(=O)N2 Amb27419865 [0,1,0,1,0,0|1,0,0]=3 3194 B15R2.297 N[C@@H](c1ccccc1)[C@H]2CCC(=O)O2 Amb27635861 [0,1,0,1,0,0|2,0,0]=4 3195 B15R2.297 N[C@H](c1ccccc1)[C@@H]2COC(=O)N2 Amb27419863 [0,1,0,1,0,0|1,0,0]=3 3196 B15R2.297 O=C1CC(C(=O)c2ccccc2)CN1 Amb27439611 [0,1,0,1,0,0|1,0,1]=4 3197 B15R2.297 O=C1CC(C(=O)c2ccccc2)CO1 Amb2730333 [0,1,0,1,0,0|0,0,1]=3 3198 B15R2.297 O=C1CCC(C(O)c2ccccc2)O1 Amb26050077 [0,1,0,1,0,0|2,0,0]=4 3199 B15R2.297 O=C1CC[C@@H]([C@@H](O)c2ccccc2)N1 Amb27797355 [0,1,0,1,0,0|2,0,0]=4 3200 B15R2.297 O=C1CC[C@@H]([C@@H](O)c2ccccc2)O1 Amb28053803 [0,1,0,1,0,0|2,0,0]=4 3201 B15R2.297 O=C1CC[C@H]([C@@H](O)c2ccccc2)O1 Amb27849013 [0,1,0,1,0,0|2,0,0]=4 3202 B15R2.297 O=C1NC(C(=O)c2ccccc2)CO1 Amb27831242 [0,1,0,1,0,0|1,0,1]=4 3203 B15R2.297 O=C1NC(C(Cl)c2ccccc2)CO1 Amb28068885 [0,1,0,1,0,0|1,0,0]=3 3204 B15R2.297 O=C1N[C@H](C(O)c2ccccc2)CO1 Amb28408797 [0,1,0,1,0,0|1,0,0]=3 3205 B15R2.297 O=C1N[C@H]([C@@H](Cl)c2ccccc2)CO1 Amb27636941 [0,1,0,1,0,0|1,0,0]=3 3206 B15R2.297 O=C1N[C@H]([C@H](Cl)c2ccccc2)CO1 Amb28053687 [0,1,0,1,0,0|1,0,0]=3 3207 B15R2.548 CC1CNC(c2ccccc2)CCO1 Amb28194402 [0,1,0,1,0,0|1,0,1]=4 3208 B15R2.548 N=C1CCC(c2ccccc2)CCN1 Amb27228838 [0,1,0,1,0,0|2,0,0]=4 3209 B15R2.548 O=C1CCC(c2ccccc2)CCN1 Amb9316852 [0,1,0,1,0,0|1,0,0]=3 3210 B15R2.548 O=C1CCC(c2ccccc2)CCO1 Amb22337540 [0,1,0,1,0,0|0,0,0]=2 3211 B15R2.548 O=C1CCCC(c2ccccc2)CC1 Amb26602313 [0,1,0,1,0,0|1,0,0]=3 3212 B15R2.548 O=C1CCCC(c2ccccc2)CN1 Amb22642248 [0,1,0,1,0,0|1,0,0]=3 3213 B15R2.548 O=C1CCNC(c2ccccc2)CN1 Amb27847304 [0,1,0,1,0,0|2,0,0]=4 3214 B15R2.586 CC1(C)NC(c2ccccc2)CCO1 Amb33193160 [0,1,0,1,0,0|1,0,1]=4 3215 B15R2.586 CC1(C)OCCC(c2ccccc2)O1 Amb27482540 [0,1,0,1,0,0|0,0,2]=4 3216 B15R2.612 CC(OC1CC(=O)C1)c2ccccc2 Amb27480402 [0,1,0,1,0,0|2,0,0]=4 3217 B15R2.1113 CC1(c2ccccc2)CC(=O)CCN1 Amb18063211 [0,1,0,1,0,0|2,0,0]=4 3218 B15R2.1224 CC(=N)NC1CC(c2ccccc2)C1 Amb35707407 [0,1,0,1,0,0|2,0,0]=4 3219 B15R2.1224 CC(=O)C=C1CC(c2ccccc2)C1 Amb35671745 [0,1,0,1,0,0|1,0,1]=4 3220 B15R2.1224 CC(=O)NC1CC(c2ccccc2)C1 Amb27863994 [0,1,0,1,0,0|1,0,0]=3 3221 B15R2.1224 NC(=O)NC1CC(c2ccccc2)C1 Amb35735926 [0,1,0,1,0,0|2,0,0]=4 3222 B15R2.1224 O=C(Cl)NC1CC(c2ccccc2)C1 Amb35633345 [0,1,0,1,0,0|2,0,0]=4 3223 B15R2.1224 O=C(O)CC1CC(c2ccccc2)C1 Amb25211758 [0,1,0,1,0,0|2,0,0]=4 3224 B15R2.14628 CC(=O)N1CCC(=O)c2ccccc21 Amb16971728 [0,1,0,1,0,0|1,0,1]=4 3225 B15R2.14628 CC(=O)N1CCC(C)c2ccccc21 Amb22499781 [0,1,0,1,0,0|1,0,0]=3 3226 B15R2.14628 CC(=O)N1CCC(N)c2ccccc21 Amb22059524 [0,1,0,1,0,0|1,0,0]=3 3227 B15R2.14628 CC(=O)N1CCC(O)c2ccccc21 Amb17014286 [0,1,0,1,0,0|1,0,0]=3 3228 B15R2.14628 C[C@H]1CC[C@H](C(=O)O)c2ccccc21 Amb27493426 [0,1,0,1,0,0|2,0,0]=4 3229 B15R2.14628 NC1CCC(C(=O)O)c2ccccc21 Amb31252147 [0,1,0,1,0,0|2,0,0]=4 3230 B15R2.14628 NC1CCC(C(=O)O)c2ccccc21 Amb32796258 [0,1,0,1,0,0|2,0,0]=4 3231 B15R2.16289 CC(c1ccccc1)C2CC2C(=O)O Amb33081592 [0,1,0,1,0,0|2,0,0]=4 3232 B15R2.16289 CC(c1ccccc1)[C@@H]2C[C@H]2C(=O)O Amb33081603 [0,1,0,1,0,0|2,0,0]=4 3233 B15R2.16289 O=C(O)[C@H]1C[C@@H]1C(O)c2ccccc2 Amb28436899 [0,1,0,1,0,0|2,0,0]=4 3234 B15R2.19816 CC1(c2ccccc2)CC1CC(=O)O Amb27429028 [0,1,0,1,0,0|2,0,0]=4 3235 B15R2.53147 CC(=O)OC1=CC(C)c2ccccc21 Amb17778892 [0,1,0,1,0,0|0,0,2]=4 3236 B15R2.53147 CC(=O)OC1C=C(C)c2ccccc21 Amb17778913 [0,1,0,1,0,0|0,0,2]=4 3237 B15R2.53147 CC(=O)OC1OC(=O)c2ccccc21 Amb17850786 [0,1,0,1,0,0|1,0,1]=4 3238 B15R2.53147 CC1CC(CC(N)=O)c2ccccc21 Amb17234747 [0,1,0,1,0,0|2,0,0]=4 3239 B15R2.53147 O=C(O)CC1CC(F)c2ccccc21 Amb28139670 [0,1,0,1,0,0|2,0,0]=4 3240 B15R2.29 CC1CNC(Cc2ccccc2)CO1 Amb18563409 [0,1,0,1,0,0|1,0,1]=4 3241 B15R2.29 O=C1C=CC(Cc2ccccc2)CC1 Amb25793582 [0,1,0,1,0,0|1,0,1]=4 3242 B15R2.29 O=C1CCC(Cc2ccccc2)CC1 Amb13777318 [0,1,0,1,0,0|1,0,0]=3 3243 B15R2.29 O=C1CCC(Cc2ccccc2)CN1 Amb27388034 [0,1,0,1,0,0|1,0,0]=3 3244 B15R2.29 O=C1CCC(Cc2ccccn2)CC1 Amb27833056 [0,1,0,1,0,0|2,0,0]=4 3245 B15R2.29 O=C1CCC(Oc2ccccc2)CC1 Amb25825595 [0,1,0,1,0,0|2,0,0]=4 3246 B15R2.29 O=C1CCC(Sc2ccccc2)CC1 Amb26855446 [0,1,0,1,0,0|2,0,0]=4 3247 B15R2.29 O=C1CCN(Cc2ccccc2)CC1 Amb2684677 [0,1,0,1,0,0|2,0,0]=4 3248 B15R2.29 O=C1CNC(Cc2ccccc2)CN1 Amb18819212 [0,1,0,1,0,0|1,0,0]=3 3249 B15R2.29 O=C1COC(Cc2ccccc2)CN1 Amb26405206 [0,1,0,1,0,0|1,0,0]=3 3250 B15R2.29 O=C1NCC(Cc2ccccc2)CO1 Amb28346309 [0,1,0,1,0,0|0,0,0]=2 3251 B15R2.29 O=C1OCC(Nc2ccccc2)CO1 Amb28121065 [0,1,0,1,0,0|1,0,0]=3 3252 B15R2.33 CC1CCC(=O)CC1c2ccccc2 Amb32865311 [0,1,0,1,0,0|1,0,0]=3 3253 B15R2.33 CC1CCC(=O)CC1c2cccnc2 Amb32865325 [0,1,0,1,0,0|2,0,0]=4 3254 B15R2.33 CC1CCC(=O)CC1c2ccncc2 Amb32865383 [0,1,0,1,0,0|2,0,0]=4 3255 B15R2.33 CC1CNC(=O)NC1c2ccccc2 Amb28409059 [0,1,0,1,0,0|2,0,0]=4 3256 B15R2.33 CC1OCC(N)C(c2ccccc2)O1 Amb28190723 [0,1,0,1,0,0|0,0,2]=4 3257 B15R2.33 CC1OC[C@@H](N)[C@H](c2ccccc2)O1 Amb27420073 [0,1,0,1,0,0|0,0,2]=4 3258 B15R2.33 CN1CCC(=O)CC1c2ccccc2 Amb8394312 [0,1,0,1,0,0|2,0,0]=4 3259 B15R2.33 C[C@@H]1CNC(=O)N[C@@H]1c2ccccc2 Amb27450137 [0,1,0,1,0,0|2,0,0]=4 3260 B15R2.33 C[C@@H]1COC(=O)N[C@@H]1c2ccccc2 Amb28246373 [0,1,0,1,0,0|1,0,0]=3 3261 B15R2.33 NC1CCC(=O)NC1c2ccccc2 Amb17401423 [0,1,0,1,0,0|2,0,0]=4 3262 B15R2.33 NC1CNC(=O)CC1c2ccccc2 Amb27794734 [0,1,0,1,0,0|1,0,0]=3 3263 B15R2.33 N[C@@H]1CCC(=O)N[C@H]1c2ccccc2 Amb24100134 [0,1,0,1,0,0|2,0,0]=4 3264 B15R2.33 N[C@@H]1CNC(=O)C[C@@H]1c2ccccc2 Amb27783041 [0,1,0,1,0,0|1,0,0]=3 3265 B15R2.33 N[C@H]1COC(=O)C[C@@H]1c2ccccc2 Amb27790730 [0,1,0,1,0,0|0,0,0]=2 3266 B15R2.33 O=C1C=CC(O)C(c2ccccc2)C1 Amb28281783 [0,1,0,1,0,0|1,0,1]=4 3267 B15R2.33 O=C1C=C[C@H](O)[C@@H](c2ccccc2)C1 Amb28068729 [0,1,0,1,0,0|1,0,1]=4 3268 B15R2.33 O=C1CCC(O)C(c2ccccc2)N1 Amb27607838 [0,1,0,1,0,0|2,0,0]=4 3269 B15R2.33 O=C1CC[C@@H](O)[C@@H](c2ccccc2)N1 Amb28345637 [0,1,0,1,0,0|2,0,0]=4 3270 B15R2.33 O=C1CC[C@H](O)[C@@H](c2ccccc2)N1 Amb27216028 [0,1,0,1,0,0|2,0,0]=4 3271 B15R2.33 O=C1NC(c2ccccc2)C(=O)CO1 Amb27174293 [0,1,0,1,0,0|1,0,1]=4 3272 B15R2.33 O=C1OCC(Cl)[C@H](c2ccccc2)O1 Amb27169459 [0,1,0,1,0,0|1,0,0]=3 3273 B15R2.988 CC(=O)N1CC(C)Cc2ccccc21 Amb16979215 [0,1,0,1,0,0|1,0,0]=3 3274 B15R2.988 CC(=O)N1CC(C)Oc2ccccc21 Amb18368568 [0,1,0,1,0,0|2,0,0]=4 3275 B15R2.988 CC(=O)N1CC(N)Cc2ccccc21 Amb27602780 [0,1,0,1,0,0|1,0,0]=3 3276 B15R2.988 CC1Cc2ccccc2N(C(N)=O)C1 Amb28207607 [0,1,0,1,0,0|2,0,0]=4 3277 B15R2.993 CC(=O)NC1c2ccccc2CC1Br Amb27395115 [0,1,0,1,0,0|1,0,0]=3 3278 B15R2.993 CC(=O)NC1c2ccccc2CC1C Amb3779023 [0,1,0,1,0,0|1,0,0]=3 3279 B15R2.993 CC(=O)NC1c2ccccc2CC1Cl Amb27808487 [0,1,0,1,0,0|1,0,0]=3 3280 B15R2.993 CC(=O)NC1c2ccccc2CC1F Amb27646537 [0,1,0,1,0,0|1,0,0]=3 3281 B15R2.993 CC(=O)NC1c2ccccc2CC1N Amb27852048 [0,1,0,1,0,0|1,0,0]=3 3282 B15R2.993 CC(=O)NC1c2ccccc2CC1O Amb19041152 [0,1,0,1,0,0|1,0,0]=3 3283 B15R2.993 CC(=O)N[C@@H]1c2ccccc2C[C@@H]1O Amb27822767 [0,1,0,1,0,0|1,0,0]=3 3284 B15R2.993 CC(=O)N[C@@H]1c2ccccc2C[C@H]1O Amb28202598 [0,1,0,1,0,0|1,0,0]=3 3285 B15R2.993 CC(=O)N[C@H]1c2ccccc2C[C@@H]1O Amb26629113 [0,1,0,1,0,0|1,0,0]=3 3286 B15R2.993 CC(=O)N[C@H]1c2ccccc2C[C@H]1F Amb27631335 [0,1,0,1,0,0|1,0,0]=3 3287 B15R2.993 CC(=O)N[C@H]1c2ccccc2C[C@H]1O Amb24599752 [0,1,0,1,0,0|1,0,0]=3 3288 B15R2.993 CC(=O)O[C@@H]1c2ccccc2C[C@@H]1Cl Amb27849003 [0,1,0,1,0,0|0,0,0]=2 3289 B15R2.993 CC(=O)O[C@H]1c2ccccc2C[C@@H]1Cl Amb27224845 [0,1,0,1,0,0|0,0,0]=2 3290 B15R2.993 CC(=O)O[C@H]1c2ccccc2C[C@@H]1O Amb27197455 [0,1,0,1,0,0|0,0,0]=2 3291 B15R2.993 NC(=O)NC1c2ccccc2CC1O Amb19050476 [0,1,0,1,0,0|2,0,0]=4 3292 B15R2.993 NC(=O)N[C@@H]1c2ccccc2C[C@@H]1O Amb27822935 [0,1,0,1,0,0|2,0,0]=4 3293 B15R2.993 NC(=O)N[C@H]1c2ccccc2C[C@H]1O Amb26452771 [0,1,0,1,0,0|2,0,0]=4 3294 B15R2.993 O=C(O)CC1c2ccccc2CC1O Amb18651105 [0,1,0,1,0,0|2,0,0]=4 3295 B15R2.993 O=C(O)C[C@H]1c2ccccc2C[C@H]1O Amb28246031 [0,1,0,1,0,0|2,0,0]=4 3296 B15R2.1244 O=C(O)C1CC(Cc2ccccc2)C1 Amb23537993 [0,1,0,1,0,0|2,0,0]=4 3297 B15R2.4086 CC1(Cc2ccccc2)CC(=O)CO1 Amb35693030 [0,1,0,1,0,0|2,0,0]=4 3298 B15R2.4086 CC1(Cc2ccccc2)CC(=O)NN1 Amb30010409 [0,1,0,1,0,0|2,0,0]=4 3299 B15R2.4086 CC1(Cc2ccccc2)CCC(=O)N1 Amb28183443 [0,1,0,1,0,0|2,0,0]=4 3300 B15R2.4086 CC1(Cc2ccccc2)CNC(=O)C1 Amb26416821 [0,1,0,1,0,0|1,0,0]=3 3301 B15R2.4086 CC1(Cc2ccccc2)CNC(=S)C1 Amb27868403 [0,1,0,1,0,0|1,1,0]=4 3302 B15R2.4086 CC1(Cc2cccnc2)CCC(=O)C1 Amb27626461 [0,1,0,1,0,0|2,0,0]=4 3303 B15R2.4086 CC1=CCC(N)(Cc2ccccc2)C1 Amb25765731 [0,1,0,1,0,0|2,0,0]=4 3304 B15R2.4086 CC1CC(O)(Cc2ccccc2)CO1 Amb29850365 [0,1,0,1,0,0|1,0,1]=4 3305 B15R2.4086 C[C@@]1(Cc2ccccc2)COC(=O)N1 Amb27841747 [0,1,0,1,0,0|1,0,0]=3 3306 B15R2.7532 CC1(C)NC(Cc2ccccc2)CO1 Amb18563401 [0,1,0,1,0,0|1,0,1]=4 3307 B15R2.7532 CC1(C)N[C@@H](Cc2ccccc2)CO1 Amb28368452 [0,1,0,1,0,0|1,0,1]=4 3308 B15R2.28 Cc1ccc(C2CC(=O)CCN2)cc1 Amb17234678 [0,1,0,1,0,0|2,0,0]=4 3309 B15R2.28 Cc1ccc(C2CCCC(=O)C2)cc1 Amb18564535 [0,1,0,1,0,0|1,0,0]=3 3310 B15R2.28 Cc1ccc(C2CCCC(=O)C2)nc1 Amb28410150 [0,1,0,1,0,0|2,0,0]=4 3311 B15R2.28 Cc1ccc(C2CCCC(=O)N2)cc1 Amb25806015 [0,1,0,1,0,0|2,0,0]=4 3312 B15R2.28 Cc1ccc(C2CCCC(=O)O2)cc1 Amb28244717 [0,1,0,1,0,0|2,0,0]=4 3313 B15R2.28 Cc1ccc(C2CCNC(=O)N2)cc1 Amb28061610 [0,1,0,1,0,0|2,0,0]=4 3314 B15R2.28 Cc1ccc(C2CCOC(=O)C2)cc1 Amb28190717 [0,1,0,1,0,0|0,0,0]=2 3315 B15R2.28 Cc1ccc([C@H]2CCCC(=O)C2)cc1 Amb28423494 [0,1,0,1,0,0|1,0,0]=3 3316 B15R2.28 Cc1ccc([C@H]2CCOC(=O)C2)cc1 Amb27957115 [0,1,0,1,0,0|0,0,0]=2 3317 B15R2.28 Nc1ccc(C2CCCC(=O)C2)cc1 Amb26645087 [0,1,0,1,0,0|1,0,0]=3 3318 B15R2.28 Nc1ccc(C2CCCC(=O)C2)cn1 Amb28324443 [0,1,0,1,0,0|2,0,0]=4 3319 B15R2.28 Nc1ccc(C2CCCC(=O)N2)cc1 Amb32862499 [0,1,0,1,0,0|2,0,0]=4 3320 B15R2.28 Nc1ccc(C2CCNC(=O)C2)cc1 Amb25129463 [0,1,0,1,0,0|1,0,0]=3 3321 B15R2.28 Nc1ccc(N2CCNC(=O)C2)cc1 Amb1117648 [0,1,0,1,0,0|2,0,0]=4 3322 B15R2.28 Nc1ccc(N2CCOC(=O)C2)cc1 Amb27203373 [0,1,0,1,0,0|1,0,0]=3 3323 B15R2.28 O=C1CC(c2ccc(Cl)cc2)CCN1 Amb27950608 [0,1,0,1,0,0|1,0,0]=3 3324 B15R2.28 O=C1CC(c2ccc(Cl)cc2)CCO1 Amb25095898 [0,1,0,1,0,0|0,0,0]=2 3325 B15R2.28 O=C1CC(c2ccc(F)cc2)CCO1 Amb27259165 [0,1,0,1,0,0|0,0,0]=2 3326 B15R2.28 O=C1CCCC(c2ccc(Br)cc2)C1 Amb26594155 [0,1,0,1,0,0|1,0,0]=3 3327 B15R2.28 O=C1CCCC(c2ccc(Br)cc2)N1 Amb32992317 [0,1,0,1,0,0|2,0,0]=4 3328 B15R2.28 O=C1CCCC(c2ccc(Br)cc2)O1 Amb27808892 [0,1,0,1,0,0|2,0,0]=4 3329 B15R2.28 O=C1CCCC(c2ccc(Cl)cc2)C1 Amb33537835 [0,1,0,1,0,0|1,0,0]=3 3330 B15R2.28 O=C1CCCC(c2ccc(Cl)cc2)N1 Amb25668299 [0,1,0,1,0,0|2,0,0]=4 3331 B15R2.28 O=C1CCCC(c2ccc(Cl)cn2)C1 Amb28118525 [0,1,0,1,0,0|2,0,0]=4 3332 B15R2.28 O=C1CCCC(c2ccc(F)cc2)C1 Amb18565095 [0,1,0,1,0,0|1,0,0]=3 3333 B15R2.28 O=C1CCCC(c2ccc(F)cc2)N1 Amb28408925 [0,1,0,1,0,0|2,0,0]=4 3334 B15R2.28 O=C1CCCC(c2ccc(F)nc2)C1 Amb27388114 [0,1,0,1,0,0|2,0,0]=4 3335 B15R2.28 O=C1CCC[C@@H](c2ccc(F)cc2)O1 Amb28195863 [0,1,0,1,0,0|2,0,0]=4 3336 B15R2.28 O=C1CCNC(c2ccc(Br)cc2)C1 Amb17263740 [0,1,0,1,0,0|2,0,0]=4 3337 B15R2.28 O=C1CCNC(c2ccc(Cl)cc2)C1 Amb17240445 [0,1,0,1,0,0|2,0,0]=4 3338 B15R2.28 O=C1CCNC(c2ccc(F)cc2)C1 Amb17235574 [0,1,0,1,0,0|2,0,0]=4 3339 B15R2.28 O=C1CCNC(c2ccc(O)cc2)C1 Amb18818529 [0,1,0,1,0,0|2,0,0]=4 3340 B15R2.28 O=C1CCN[C@@H](c2ccc(F)cc2)C1 Amb27273279 [0,1,0,1,0,0|2,0,0]=4 3341 B15R2.28 O=C1CCOC(c2ccc(F)cc2)C1 Amb27794202 [0,1,0,1,0,0|2,0,0]=4 3342 B15R2.28 O=C1C[C@@H](c2ccc(Cl)cc2)CCO1 Amb27392823 [0,1,0,1,0,0|0,0,0]=2 3343 B15R2.28 O=C1C[C@@H](c2ccc(F)cc2)CCN1 Amb27234706 [0,1,0,1,0,0|1,0,0]=3 3344 B15R2.28 O=C1NC(c2ccc(Br)cc2)CCO1 Amb28065105 [0,1,0,1,0,0|1,0,0]=3 3345 B15R2.28 O=C1NC(c2ccc(F)cc2)CCO1 Amb27665442 [0,1,0,1,0,0|1,0,0]=3 3346 B15R2.28 O=C1NCCC(c2ccc(Br)cc2)N1 Amb27149059 [0,1,0,1,0,0|2,0,0]=4 3347 B15R2.28 O=C1NCCC(c2ccc(Cl)cc2)N1 Amb28191235 [0,1,0,1,0,0|2,0,0]=4 3348 B15R2.28 O=C1NCCC(c2ccc(F)cc2)N1 Amb25879871 [0,1,0,1,0,0|2,0,0]=4 3349 B15R2.28 O=C1N[C@H](c2ccc(Br)nc2)CCO1 Amb27198424 [0,1,0,1,0,0|2,0,0]=4 3350 B15R2.98 Cc1ccc(CC2CCC(=O)O2)cc1 Amb27170785 [0,1,0,1,0,0|2,0,0]=4 3351 B15R2.98 Cc1ccc(CC2COC(N)=N2)cc1 Amb27413652 [0,1,0,1,0,0|2,0,0]=4 3352 B15R2.98 Cc1ccc(CN2CCC(=O)C2)cc1 Amb8947965 [0,1,0,1,0,0|2,0,0]=4 3353 B15R2.98 Cc1ccc(NC2CCC(=O)C2)cc1 Amb27471997 [0,1,0,1,0,0|2,0,0]=4 3354 B15R2.98 Cc1ccc(OC2CCC(=O)C2)cc1 Amb27425444 [0,1,0,1,0,0|2,0,0]=4 3355 B15R2.98 NC1=NC(Cc2ccc(F)cc2)CO1 Amb27169139 [0,1,0,1,0,0|2,0,0]=4 3356 B15R2.98 NC1=N[C@@H](Cc2ccc(F)cc2)CO1 Amb28204006 [0,1,0,1,0,0|2,0,0]=4 3357 B15R2.98 Nc1ccc(CC2=CC(=O)OC2)cc1 Amb27240034 [0,1,0,1,0,0|0,0,2]=4 3358 B15R2.98 Nc1ccc(CC2CCC(=O)N2)cc1 Amb18819188 [0,1,0,1,0,0|2,0,0]=4 3359 B15R2.98 Nc1ccc(CC2CNC(=O)O2)cc1 Amb18559562 [0,1,0,1,0,0|2,0,0]=4 3360 B15R2.98 Nc1ccc(CC2CNC(=O)O2)cc1 Amb32662972 [0,1,0,1,0,0|2,0,0]=4 3361 B15R2.98 Nc1ccc(CC2COC(=O)N2)cc1 Amb2613740 [0,1,0,1,0,0|1,0,0]=3 3362 B15R2.98 Nc1ccc(C[C@@H]2COC(=O)N2)cc1 Amb19130394 [0,1,0,1,0,0|1,0,0]=3 3363 B15R2.98 Nc1ccc(C[C@H]2COC(=O)N2)cc1 Amb8392894 [0,1,0,1,0,0|1,0,0]=3 3364 B15R2.98 O=C1CC(Cc2ccc(F)cc2)CN1 Amb27948094 [0,1,0,1,0,0|1,0,0]=3 3365 B15R2.98 O=C1CCC(Cc2ccc(Br)cc2)N1 Amb27632179 [0,1,0,1,0,0|2,0,0]=4 3366 B15R2.98 O=C1CCC(Cc2ccc(Br)cn2)C1 Amb27950480 [0,1,0,1,0,0|2,0,0]=4 3367 B15R2.98 O=C1CCC(Cc2ccc(O)cc2)O1 Amb20668221 [0,1,0,1,0,0|2,0,0]=4 3368 B15R2.98 O=C1CCC(Oc2ccc(Br)cc2)C1 Amb27773903 [0,1,0,1,0,0|2,0,0]=4 3369 B15R2.98 O=C1CCC(Oc2ccc(F)cc2)C1 Amb27474463 [0,1,0,1,0,0|2,0,0]=4 3370 B15R2.98 O=C1CCN(Cc2ccc(Cl)cc2)C1 Amb8948002 [0,1,0,1,0,0|2,0,0]=4 3371 B15R2.98 O=C1CC[C@@H](Cc2ccc(F)cc2)N1 Amb27867363 [0,1,0,1,0,0|2,0,0]=4 3372 B15R2.98 O=C1NC(Cc2ccc(Cl)cc2)CO1 Amb27166135 [0,1,0,1,0,0|1,0,0]=3 3373 B15R2.98 O=C1NC(Cc2ccc(O)cc2)CO1 Amb28399035 [0,1,0,1,0,0|1,0,0]=3 3374 B15R2.98 O=C1NCC(Cc2ccc(Cl)cc2)O1 Amb27487314 [0,1,0,1,0,0|2,0,0]=4 3375 B15R2.98 O=C1NCC(Cc2ccc(F)cc2)O1 Amb27590243 [0,1,0,1,0,0|2,0,0]=4 3376 B15R2.98 O=C1N[C@@H](Cc2ccc(O)cc2)CO1 Amb27760747 [0,1,0,1,0,0|1,0,0]=3 3377 B15R2.558 Nc1ccc2c(c1)NC(=O)CCCC2 Amb27798127 [0,1,0,1,0,0|2,0,0]=4 3378 B15R2.6971 CC(=O)N1CCC1c2ccc(Br)cc2 Amb28065984 [0,1,0,1,0,0|1,0,0]=3 3379 B15R2.6971 O=C(O)C1CCC1c2ccc(Br)cc2 Amb29883113 [0,1,0,1,0,0|2,0,0]=4 3380 B15R2.6971 O=C(O)C1CCC1c2ccc(F)cc2 Amb26859540 [0,1,0,1,0,0|2,0,0]=4 3381 B15R2.6974 CC(=O)NC1CC1c2ccc(Cl)cc2 Amb24361199 [0,1,0,1,0,0|1,0,0]=3 3382 B15R2.6974 O=C(O)CC1CC1c2ccc(Br)cc2 Amb17264231 [0,1,0,1,0,0|2,0,0]=4 3383 B15R2.6974 O=C(O)CC1CC1c2ccc(Cl)cc2 Amb17240727 [0,1,0,1,0,0|2,0,0]=4 3384 B15R2.6974 O=C(O)CC1CC1c2ccc(O)cc2 Amb27985857 [0,1,0,1,0,0|2,0,0]=4 3385 B15R2.6974 O=C(O)C[C@@H]1C[C@H]1c2ccc(O)cc2 Amb32666572 [0,1,0,1,0,0|2,0,0]=4 3386 B15R2.7268 CC(=O)N1CCCc2ccc(C)nc21 Amb28287864 [0,1,0,1,0,0|2,0,0]=4 3387 B15R2.7268 CC(=O)N1CCCc2ccc(I)cc21 Amb27162434 [0,1,0,1,0,0|1,0,0]=3 3388 B15R2.7268 CC(=O)N1CCCc2ccc(N)cc21 Amb10603340 [0,1,0,1,0,0|1,0,0]=3 3389 B15R2.7268 CC(=O)N1CCCc2ccc(N)cc21 Amb32409661 [0,1,0,1,0,0|1,0,0]=3 3390 B15R2.7268 CC(=O)N1CCNc2ccc(O)cc21 Amb18817393 [0,1,0,1,0,0|2,0,0]=4 3391 B15R2.7268 CC(=O)N1CCOc2ccc(Br)cc21 Amb25857479 [0,1,0,1,0,0|2,0,0]=4 3392 B15R2.7268 CC(=O)N1CCOc2ccc(C)cc21 Amb17016807 [0,1,0,1,0,0|2,0,0]=4 3393 B15R2.7268 CC(=O)N1CCOc2ccc(N)cc21 Amb18565085 [0,1,0,1,0,0|2,0,0]=4 3394 B15R2.7268 CC(=O)N1CCSc2ccc(N)cc21 Amb10609319 [0,1,0,1,0,0|2,0,0]=4 3395 B15R2.7268 CS(=O)N1CCCc2ccc(N)cc21 Amb28145142 [0,1,0,1,0,0|2,0,0]=4 3396 B15R2.7268 Cc1ccc2c(c1)C(C(=O)O)CCC2 Amb17108429 [0,1,0,1,0,0|2,0,0]=4 3397 B15R2.7268 NC(=O)N1CCCc2ccc(N)cc21 Amb18278133 [0,1,0,1,0,0|2,0,0]=4 3398 B15R2.7268 Nc1ccc2c(c1)C(C(=O)O)CCC2 Amb27858724 [0,1,0,1,0,0|2,0,0]=4 3399 B15R2.7268 Nc1ccc2c(c1)C(C(=O)O)CCC2 Amb35752369 [0,1,0,1,0,0|2,0,0]=4 3400 B15R2.7268 O=C(O)C1CCCc2ccc(Br)cc21 Amb17108439 [0,1,0,1,0,0|2,0,0]=4 3401 B15R2.7268 O=C(O)C1CCCc2ccc(F)cc21 Amb17108435 [0,1,0,1,0,0|2,0,0]=4 3402 B15R2.9410 CC(=O)CN1CCc2ccc(F)cc21 Amb27183684 [0,1,0,1,0,0|2,0,0]=4 3403 B15R2.9410 CC(=O)NC1CCc2ccc(F)cc21 Amb25698356 [0,1,0,1,0,0|1,0,0]=3 3404 B15R2.9410 Cc1ccc2c(c1)C(CC(=O)O)CC2 Amb17234919 [0,1,0,1,0,0|2,0,0]=4 3405 B15R2.9410 Cc1ccc2c(c1)C(CC(N)=O)CC2 Amb17234741 [0,1,0,1,0,0|2,0,0]=4 3406 B15R2.9410 NC(=O)CC1CCc2ccc(Cl)cc21 Amb17240476 [0,1,0,1,0,0|2,0,0]=4 3407 B15R2.9410 NC(=O)CC1CCc2ccc(F)cc21 Amb17235597 [0,1,0,1,0,0|2,0,0]=4 3408 B15R2.9410 O=C(O)CC1CCc2ccc(Cl)cc21 Amb17240752 [0,1,0,1,0,0|2,0,0]=4 3409 B15R2.9410 O=C(O)CC1CCc2ccc(F)cc21 Amb17235892 [0,1,0,1,0,0|2,0,0]=4 3410 B15R2.19017 Cc1ccc(CC2CC2C(=O)O)cc1 Amb23453719 [0,1,0,1,0,0|2,0,0]=4 3411 B15R2.19017 O=C(O)C1CC1Cc2ccc(Br)cc2 Amb23453729 [0,1,0,1,0,0|2,0,0]=4 3412 B15R2.19017 O=C(O)C1CC1Cc2ccc(F)cc2 Amb23453727 [0,1,0,1,0,0|2,0,0]=4 3413 B15R2.4 C#CC(=O)NC1CCc2ccccc21 Amb30017881 [0,1,0,1,0,0|1,0,1]=4 3414 B15R2.4 C=CC(=O)NC1CCc2ccccc21 Amb9516904 [0,1,0,1,0,0|1,0,1]=4 3415 B15R2.4 CCC(=O)NC1CCc2ccccc21 Amb8340525 [0,1,0,1,0,0|1,0,0]=3 3416 B15R2.4 CCC(=O)NN1CCc2ccccc21 Amb647231 [0,1,0,1,0,0|2,0,0]=4 3417 B15R2.4 CNC(=O)CC1CCc2ccccc21 Amb17234743 [0,1,0,1,0,0|1,0,0]=3 3418 B15R2.4 CNC(=O)NC1CCc2ccccc21 Amb24181769 [0,1,0,1,0,0|1,0,0]=3 3419 B15R2.4 COC(=O)CC1CNc2ccccc21 Amb17592979 [0,1,0,1,0,0|2,0,0]=4 3420 B15R2.4 COC(=O)CC1CNc2ccccc21 Amb32674605 [0,1,0,1,0,0|2,0,0]=4 3421 B15R2.4 COC(=O)CC1COc2ccccc21 Amb27791137 [0,1,0,1,0,0|2,0,0]=4 3422 B15R2.4 COC(=O)CC1NCc2ccccc21 Amb22497860 [0,1,0,1,0,0|2,0,0]=4 3423 B15R2.4 COC(=O)C[C@H]1NCc2ccccc21 Amb27878658 [0,1,0,1,0,0|2,0,0]=4 3424 B15R2.4 COC(=O)NC1CCc2ccccc21 Amb27588053 [0,1,0,1,0,0|1,0,0]=3 3425 B15R2.4 COC(=O)\C=C1\CCc2ccccc21 Amb28289805 [0,1,0,1,0,0|1,0,1]=4 3426 B15R2.4 NCC(=O)NC1COc2ccccc21 Amb28184297 [0,1,0,1,0,0|2,0,0]=4 3427 B15R2.4 NNC(=O)CC1CCc2ccccc21 Amb27407362 [0,1,0,1,0,0|2,0,0]=4 3428 B15R2.4 NNC(=O)OC1CCc2ccccc21 Amb27830916 [0,1,0,1,0,0|1,0,0]=3 3429 B15R2.4 O=C(CBr)NC1CCc2ccccc21 Amb17329466 [0,1,0,1,0,0|1,0,0]=3 3430 B15R2.4 O=C(CBr)N[C@@H]1CCc2ccccc21 Amb27883611 [0,1,0,1,0,0|1,0,0]=3 3431 B15R2.4 O=C(CBr)N[C@H]1CCc2ccccc21 Amb27650509 [0,1,0,1,0,0|1,0,0]=3 3432 B15R2.4 O=C(CCl)NC1CCc2ccccc21 Amb9516901 [0,1,0,1,0,0|1,0,0]=3 3433 B15R2.4 O=C(CCl)NC1COc2ccccc21 Amb27956914 [0,1,0,1,0,0|2,0,0]=4 3434 B15R2.4 O=C(CCl)N[C@H]1CCc2ccccc21 Amb27958274 [0,1,0,1,0,0|1,0,0]=3 3435 B15R2.4 O=C(CCl)OC1COc2ccccc21 Amb27387949 [0,1,0,1,0,0|1,0,0]=3 3436 B15R2.15 C=CC1=N[C@@H](Cc2ccccc2)CO1 Amb22747341 [0,1,0,1,0,0|1,0,1]=4 3437 B15R2.15 COC1=NC(Cc2ccccc2)CO1 Amb22549387 [0,1,0,1,0,0|1,0,0]=3 3438 B15R2.15 O\N=C1\CCC(Cc2ccccc2)C1 Amb28072694 [0,1,0,1,0,0|1,0,1]=4 3439 B15R2.17 CCC1NC(c2ccccc2)CCO1 Amb33193178 [0,1,0,1,0,0|1,0,1]=4 3440 B15R2.17 CCC1OCCC(c2ccccc2)O1 Amb27796791 [0,1,0,1,0,0|0,0,2]=4 3441 B15R2.17 O=CC1CCCC(c2ccccc2)C1 Amb25906615 [0,1,0,1,0,0|1,0,1]=4 3442 B15R2.32 CC1C(=O)CCNC1c2ccccc2 Amb1778613 [0,1,0,1,0,0|2,0,0]=4 3443 B15R2.32 CN1C(=O)CNCC1c2ccccc2 Amb27387910 [0,1,0,1,0,0|2,0,0]=4 3444 B15R2.32 C[C@@H]1C(=O)CCN[C@H]1c2ccccc2 Amb27199721 [0,1,0,1,0,0|2,0,0]=4 3445 B15R2.32 NC1C(=O)NCCC1c2ccccc2 Amb27755554 [0,1,0,1,0,0|1,0,0]=3 3446 B15R2.32 O=C1CCC[C@@H](c2ccccc2)[C@@H]1O Amb28435788 [0,1,0,1,0,0|1,0,0]=3 3447 B15R2.32 O=C1CCO[C@@H](c2ccccc2)[C@@H]1O Amb27420319 [0,1,0,1,0,0|2,0,0]=4 3448 B15R2.32 O=C1OCC=C(c2ccccc2)C1O Amb28455649 [0,1,0,1,0,0|0,0,2]=4 3449 B15R2.32 O=C1OCCN(c2ccccc2)C1=O Amb10064379 [0,1,0,1,0,0|1,0,1]=4 3450 B15R2.342 O=C1CCC1COCc2ccccc2 Amb25316137 [0,1,0,1,0,0|2,0,0]=4 3451 B15R2.545 O=C1C(F)=CCCCc2ccccc21 Amb33330497 [0,1,0,1,0,0|2,0,0]=4 3452 B15R2.597 CC1C(=O)NC1SCc2ccccc2 Amb27783354 [0,1,0,1,0,0|2,0,0]=4 3453 B15R2.597 N[C@H]1C(=O)N[C@H]1CCc2ccccc2 Amb27441068 [0,1,0,1,0,0|1,0,0]=3 3454 B15R2.597 O=C1CC(OCc2ccccc2)C1Cl Amb28247084 [0,1,0,1,0,0|2,0,0]=4 3455 B15R2.597 O=C1NC(COc2ccccc2)C1O Amb27449240 [0,1,0,1,0,0|2,0,0]=4 3456 B15R2.1561 COC(=O)C1CN1Cc2ccccc2 Amb22504624 [0,1,0,1,0,0|2,0,0]=4 3457 B15R2.1600 COC(=O)C1CCC1c2ccccc2 Amb23453479 [0,1,0,1,0,0|1,0,0]=3 3458 B15R2.1600 COC(=O)[C@@H]1NC[C@H]1c2ccccc2 Amb33737661 [0,1,0,1,0,0|2,0,0]=4 3459 B15R2.1600 NCC(=O)N1CCC1c2ccccc2 Amb27451524 [0,1,0,1,0,0|1,0,0]=3 3460 B15R2.1621 C#CC(=O)NC1CC1c2ccccc2 Amb35694350 [0,1,0,1,0,0|1,0,1]=4 3461 B15R2.1621 C=CC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb28285550 [0,1,0,1,0,0|1,0,1]=4 3462 B15R2.1621 CCC(=N)NC1CC1c2ccccc2 Amb28350684 [0,1,0,1,0,0|2,0,0]=4 3463 B15R2.1621 CCC(=O)NC1CC1c2ccccc2 Amb25141389 [0,1,0,1,0,0|1,0,0]=3 3464 B15R2.1621 CNC(=N)NC1CC1c2ccccc2 Amb19072436 [0,1,0,1,0,0|2,0,0]=4 3465 B15R2.1621 CNC(=O)NC1CC1c2ccccc2 Amb27589565 [0,1,0,1,0,0|1,0,0]=3 3466 B15R2.1621 COC(=O)NC1CC1c2ccccc2 Amb27982550 [0,1,0,1,0,0|1,0,0]=3 3467 B15R2.1621 CO\C(C)=N/C1CC1c2ccccc2 Amb22356821 [0,1,0,1,0,0|1,0,1]=4 3468 B15R2.1621 NNC(=O)NC1CC1c2ccccc2 Amb19078521 [0,1,0,1,0,0|2,0,0]=4 3469 B15R2.1621 O=C(CS)NC1CC1c2ccccc2 Amb27594562 [0,1,0,1,0,0|1,0,0]=3 3470 B15R2.4083 CC1C(=O)CCC1Sc2ccccc2 Amb27181526 [0,1,0,1,0,0|2,0,0]=4 3471 B15R2.4083 CC1C(=O)CCN1Cc2ccccc2 Amb17609111 [0,1,0,1,0,0|2,0,0]=4 3472 B15R2.4083 CC1C(=O)NCC1Cc2ccccc2 Amb28056220 [0,1,0,1,0,0|1,0,0]=3 3473 B15R2.4083 CC1C(=O)NNC1Cc2ccccc2 Amb35686089 [0,1,0,1,0,0|2,0,0]=4 3474 B15R2.4083 CC1C(=O)OCC1Nc2ccccc2 Amb27813303 [0,1,0,1,0,0|1,0,0]=3 3475 B15R2.4083 CN1C(=O)CN[C@@H]1Cc2ccccc2 Amb28458338 [0,1,0,1,0,0|2,0,0]=4 3476 B15R2.4083 CN1C(=O)NCC1Cc2ccccc2 Amb18061674 [0,1,0,1,0,0|1,0,0]=3 3477 B15R2.4083 CN1C(=O)OCC1Cc2ccccc2 Amb18559293 [0,1,0,1,0,0|0,0,0]=2 3478 B15R2.4083 CN1C(=O)ON=C1Cc2ccccc2 Amb28070482 [0,1,0,1,0,0|1,0,1]=4 3479 B15R2.4083 O=C1OC[C@@H](Cc2ccccc2)[C@H]1O Amb27184414 [0,1,0,1,0,0|0,0,0]=2 3480 B15R2.4083 O=C1OC\C(=N/c2ccccc2)C1Cl Amb25678608 [0,1,0,1,0,0|1,0,1]=4 3481 B15R2.4106 C[C@]1(C=O)CCC[C@H]1c2ccccc2 Amb27257944 [0,1,0,1,0,0|1,0,1]=4 3482 B15R2.27836 c1ccc(CCCOC2CNC2)cc1 Amb19073483 [0,1,0,1,0,0|1,0,1]=4 3483 B15R2.27836 c1ccc(CCCOC2CNC2)cc1 Amb20623912 [0,1,0,1,0,0|1,0,1]=4 3484 B15R2.79185 C#CC(=O)NCC1Cc2ccccc21 Amb35735590 [0,1,0,1,0,0|1,0,1]=4 3485 B15R2.79185 CNC(=O)NCC1Cc2ccccc21 Amb28191259 [0,1,0,1,0,0|1,0,0]=3 3486 B15R2.79765 C#CC(=O)C1CCCc2ccccc21 Amb27747141 [0,1,0,1,0,0|1,0,1]=4 3487 B15R2.79765 C#CC(=O)N1CCCc2ccccc21 Amb35713464 [0,1,0,1,0,0|1,0,1]=4 3488 B15R2.79765 C=C(CBr)C1CCCc2ccccc21 Amb33478733 [0,1,0,1,0,0|2,0,0]=4 3489 B15R2.79765 C=C(CCl)C1CCCc2ccccc21 Amb33256141 [0,1,0,1,0,0|2,0,0]=4 3490 B15R2.79765 C=C(CN)C1CCCc2ccccc21 Amb33379618 [0,1,0,1,0,0|2,0,0]=4 3491 B15R2.79765 C=CC(=O)C1CCCc2ccccc21 Amb27655141 [0,1,0,1,0,0|1,0,1]=4 3492 B15R2.79765 C=CC(=O)N1CCCc2ccccc21 Amb9480424 [0,1,0,1,0,0|1,0,1]=4 3493 B15R2.79765 CC(C=O)C1CCCc2ccccc21 Amb33379625 [0,1,0,1,0,0|1,0,1]=4 3494 B15R2.79765 CCC(=O)C1COCc2ccccc21 Amb28119530 [0,1,0,1,0,0|2,0,0]=4 3495 B15R2.79765 CCC(=O)N1CCCc2ccccc21 Amb2754748 [0,1,0,1,0,0|1,0,0]=3 3496 B15R2.79765 CCC(=O)N1CCOc2ccccc21 Amb18400325 [0,1,0,1,0,0|2,0,0]=4 3497 B15R2.79765 CN(C=O)C1CCCc2ccccc21 Amb27466638 [0,1,0,1,0,0|2,0,0]=4 3498 B15R2.79765 CNC(=O)C1CCCc2ccccc21 Amb8332110 [0,1,0,1,0,0|1,0,0]=3 3499 B15R2.79765 CNC(=O)C1CCNc2ccccc21 Amb23586317 [0,1,0,1,0,0|2,0,0]=4 3500 B15R2.79765 CNC(=O)C1CNCc2ccccc21 Amb18356848 [0,1,0,1,0,0|2,0,0]=4 3501 B15R2.79765 CNC(=O)C1NCCc2ccccc21 Amb18946032 [0,1,0,1,0,0|2,0,0]=4 3502 B15R2.79765 CNC(=O)C1OCCc2ccccc21 Amb4420659 [0,1,0,1,0,0|2,0,0]=4 3503 B15R2.79765 CNC(=O)N1CCNc2ccccc21 Amb27591461 [0,1,0,1,0,0|2,0,0]=4 3504 B15R2.79765 CNC(=O)N1CCSc2ccccc21 Amb24392178 [0,1,0,1,0,0|2,0,0]=4 3505 B15R2.79765 CNC(=S)N1CCCc2ccccc21 Amb6516090 [0,1,0,1,0,0|1,1,0]=4 3506 B15R2.79765 COC(=N)C1CCCc2ccccc21 Amb27647437 [0,1,0,1,0,0|2,0,0]=4 3507 B15R2.79765 COC(=O)C1CCCc2ccccc21 Amb8331050 [0,1,0,1,0,0|1,0,0]=3 3508 B15R2.79765 COC(=O)C1CCCc2cccnc21 Amb26914216 [0,1,0,1,0,0|2,0,0]=4 3509 B15R2.79765 COC(=O)C1CCCc2cnccc21 Amb27270838 [0,1,0,1,0,0|2,0,0]=4 3510 B15R2.79765 COC(=O)C1CCCc2ncccc21 Amb28041481 [0,1,0,1,0,0|2,0,0]=4 3511 B15R2.79765 COC(=O)C1CCNc2ccccc21 Amb10603355 [0,1,0,1,0,0|2,0,0]=4 3512 B15R2.79765 COC(=O)C1CCNc2ccccc21 Amb33329033 [0,1,0,1,0,0|2,0,0]=4 3513 B15R2.79765 COC(=O)C1CNCc2ccccc21 Amb10067661 [0,1,0,1,0,0|2,0,0]=4 3514 B15R2.79765 COC(=O)C1CNCc2ccccc21 Amb15691942 [0,1,0,1,0,0|2,0,0]=4 3515 B15R2.79765 COC(=O)C1NCCc2ccccc21 Amb18956496 [0,1,0,1,0,0|2,0,0]=4 3516 B15R2.79765 COC(=O)C1NCCc2ccccc21 Amb19375544 [0,1,0,1,0,0|2,0,0]=4 3517 B15R2.79765 COC(=O)C1OCCc2ccccc21 Amb1102553 [0,1,0,1,0,0|2,0,0]=4 3518 B15R2.79765 COC(=O)C1SCCc2ccccc21 Amb27172818 [0,1,0,1,0,0|2,0,0]=4 3519 B15R2.79765 COC(=O)[C@H]1CCCc2ccccc21 Amb28192440 [0,1,0,1,0,0|1,0,0]=3 3520 B15R2.79765 COC(=O)[C@H]1NCCc2ccccc21 Amb33803190 [0,1,0,1,0,0|2,0,0]=4 3521 B15R2.79765 C\C(C=O)=C1\CCCc2ccccc21 Amb26488984 [0,1,0,1,0,0|1,0,0]=3 3522 B15R2.79765 NCC(=O)C1CCCc2ccccc21 Amb33380020 [0,1,0,1,0,0|1,0,0]=3 3523 B15R2.79765 NCC(=O)N1CCCc2ccccc21 Amb10610219 [0,1,0,1,0,0|1,0,0]=3 3524 B15R2.79765 NCC(=O)N1CCCc2ccccc21 Amb5783075 [0,1,0,1,0,0|1,0,0]=3 3525 B15R2.79765 NCC(=O)N1CCOc2ccccc21 Amb18944723 [0,1,0,1,0,0|2,0,0]=4 3526 B15R2.79765 NCC(=O)N1CCOc2ccccc21 Amb32680392 [0,1,0,1,0,0|2,0,0]=4 3527 B15R2.79765 NCC(=O)N1CCSc2ccccc21 Amb18944524 [0,1,0,1,0,0|2,0,0]=4 3528 B15R2.79765 NNC(=O)C1CCCc2ccccc21 Amb8999064 [0,1,0,1,0,0|2,0,0]=4 3529 B15R2.79765 O=C(CBr)C1CCCc2ccccc21 Amb27438359 [0,1,0,1,0,0|1,0,0]=3 3530 B15R2.79765 O=C(CBr)C1CCOc2ccccc21 Amb24559718 [0,1,0,1,0,0|2,0,0]=4 3531 B15R2.79765 O=C(CBr)N1CCCc2ccccc21 Amb17325849 [0,1,0,1,0,0|1,0,0]=3 3532 B15R2.79765 O=C(CBr)N1CCSc2ccccc21 Amb27455889 [0,1,0,1,0,0|2,0,0]=4 3533 B15R2.79765 O=C(CCl)C1CCCc2ccccc21 Amb27828432 [0,1,0,1,0,0|1,0,0]=3 3534 B15R2.79765 O=C(CCl)N1CCCc2ccccc21 Amb6336213 [0,1,0,1,0,0|1,0,0]=3 3535 B15R2.79765 O=C(CCl)N1CCOc2ccccc21 Amb844200 [0,1,0,1,0,0|2,0,0]=4 3536 B15R2.79765 O=C(CCl)N1CCSc2ccccc21 Amb1107561 [0,1,0,1,0,0|2,0,0]=4 3537 B15R2.79765 O=C(CCl)N1COCc2ccccc21 Amb25181858 [0,1,0,1,0,0|2,0,0]=4 3538 B15R2.79765 O=C(CI)N1CCCc2ccccc21 Amb27263362 [0,1,0,1,0,0|1,0,0]=3 3539 B15R2.79765 O=C(CO)N1CCCc2ccccc21 Amb1110643 [0,1,0,1,0,0|1,0,0]=3 3540 B15R2.79765 O=C(CO)N1CCOc2ccccc21 Amb27755359 [0,1,0,1,0,0|2,0,0]=4 3541 B15R2.79765 O=C(CO)N1CCSc2ccccc21 Amb1110863 [0,1,0,1,0,0|2,0,0]=4 3542 B15R2.79765 O=C(CS)N1CCCc2ccccc21 Amb20413874 [0,1,0,1,0,0|1,0,0]=3 3543 B15R2.27 CC1=CC(=O)CC(c2ccccc2)C1 Amb20622435 [0,1,0,1,0,0|1,0,1]=4 3544 B15R2.27 CC1=NC(c2ccccc2)CC(O)C1 Amb27805112 [0,1,0,1,0,0|2,0,0]=4 3545 B15R2.27 CC1=NC(c2ccccc2)CC(O)N1 Amb27463118 [0,1,0,1,0,0|2,0,0]=4 3546 B15R2.27 CC1=N[C@@H](c2ccccc2)C[C@@H](O)C1 Amb27790376 [0,1,0,1,0,0|2,0,0]=4 3547 B15R2.27 CC1CC(=O)CC(c2ccccc2)C1 Amb17594891 [0,1,0,1,0,0|1,0,0]=3 3548 B15R2.27 CC1CC(=O)CC(c2ccccc2)N1 Amb18820075 [0,1,0,1,0,0|2,0,0]=4 3549 B15R2.27 CC1CC(=O)NC(c2ccccc2)C1 Amb27852382 [0,1,0,1,0,0|2,0,0]=4 3550 B15R2.27 CC1CC(c2ccccc2)CC(O)O1 Amb27594660 [0,1,0,1,0,0|0,0,2]=4 3551 B15R2.27 CC1C[C@@H](c2ccccc2)NC(=O)O1 Amb27387860 [0,1,0,1,0,0|1,0,0]=3 3552 B15R2.27 C[C@@H]1C[C@@H](c2ccccc2)CC(O)O1 Amb27218917 [0,1,0,1,0,0|0,0,2]=4 3553 B15R2.27 C[C@@H]1C[C@@H](c2ccccc2)NC(=O)O1 Amb27978460 [0,1,0,1,0,0|1,0,0]=3 3554 B15R2.27 C[C@H]1CC(=O)C[C@@H](c2ccccc2)N1 Amb28051959 [0,1,0,1,0,0|2,0,0]=4 3555 B15R2.27 C[C@H]1C[C@@H](c2ccccc2)NC(=O)O1 Amb27623873 [0,1,0,1,0,0|1,0,0]=3 3556 B15R2.27 C[C@H]1C[C@@H](c2ccccc2)OC(=O)N1 Amb27841052 [0,1,0,1,0,0|2,0,0]=4 3557 B15R2.27 NC1=CC(=O)CC(c2ccccc2)C1 Amb4453976 [0,1,0,1,0,0|1,0,1]=4 3558 B15R2.27 O=C1C=C(Cl)CC(c2ccccc2)C1 Amb9761368 [0,1,0,1,0,0|1,0,1]=4 3559 B15R2.27 O=C1C=C(O)CC(c2ccccc2)C1 Amb4410233 [0,1,0,1,0,0|1,0,1]=4 3560 B15R2.27 O=C1CC(=O)CC(c2ccccc2)C1 Amb6357274 [0,1,0,1,0,0|1,0,1]=4 3561 B15R2.27 O=C1CC(O)CC(c2ccccc2)C1 Amb28138674 [0,1,0,1,0,0|1,0,0]=3 3562 B15R2.27 O=C1CC(c2ccccc2)CC(=O)N1 Amb10553540 [0,1,0,1,0,0|1,0,1]=4 3563 B15R2.27 O=C1CC(c2ccccc2)CC(=O)O1 Amb17401374 [0,1,0,1,0,0|0,0,1]=3 3564 B15R2.27 O=C1CC(c2ccccc2)NC(=O)O1 Amb27395626 [0,1,0,1,0,0|1,0,1]=4 3565 B15R2.27 O=C1CC(c2ccccn2)CC(=O)O1 Amb17401477 [0,1,0,1,0,0|1,0,1]=4 3566 B15R2.27 O=C1CC(c2cccnc2)CC(=O)O1 Amb17401478 [0,1,0,1,0,0|1,0,1]=4 3567 B15R2.27 O=C1CC(c2ccncc2)CC(=O)O1 Amb17401479 [0,1,0,1,0,0|1,0,1]=4 3568 B15R2.27 O=C1CN(c2ccccc2)CC(=O)O1 Amb19651485 [0,1,0,1,0,0|1,0,1]=4 3569 B15R2.27 O=C1C[C@@H](O)C[C@H](c2ccccc2)C1 Amb27207364 [0,1,0,1,0,0|1,0,0]=3 3570 B15R2.27 O=C1C[C@@H](O)C[C@H](c2ccccc2)N1 Amb27841355 [0,1,0,1,0,0|2,0,0]=4 3571 B15R2.27 O=C1C[C@@H](O)C[C@H](c2ccccc2)O1 Amb27422525 [0,1,0,1,0,0|2,0,0]=4 3572 B15R2.27 O=C1C[C@H](O)C[C@H](c2ccccc2)N1 Amb28350364 [0,1,0,1,0,0|2,0,0]=4 3573 B15R2.325 C=C1OC(=O)NC1Cc2ccccc2 Amb28074032 [0,1,0,1,0,0|1,0,1]=4 3574 B15R2.325 CC1CC(=O)CN1Cc2ccccc2 Amb20668026 [0,1,0,1,0,0|2,0,0]=4 3575 B15R2.325 CC1OC(N)=NC1Cc2ccccc2 Amb27226049 [0,1,0,1,0,0|2,0,0]=4 3576 B15R2.325 C[C@@H]1OC(=O)N[C@H]1Cc2ccccc2 Amb27970872 [0,1,0,1,0,0|1,0,0]=3 3577 B15R2.325 C[C@H]1OC(=O)N[C@@H]1Cc2ccccc2 Amb27841327 [0,1,0,1,0,0|1,0,0]=3 3578 B15R2.325 C[C@H]1OC(=O)N[C@H]1Cc2ccccc2 Amb27816387 [0,1,0,1,0,0|1,0,0]=3 3579 B15R2.325 O=C1CC(Cc2ccccc2)C(=O)N1 Amb17470703 [0,1,0,1,0,0|1,0,1]=4 3580 B15R2.325 O=C1CC(Cc2ccccc2)C(=O)O1 Amb2775768 [0,1,0,1,0,0|0,0,1]=3 3581 B15R2.325 O=C1CC(Cc2cccnc2)C(=O)O1 Amb19108564 [0,1,0,1,0,0|1,0,1]=4 3582 B15R2.325 O=C1CC(O)C(Cc2ccccc2)N1 Amb28132724 [0,1,0,1,0,0|2,0,0]=4 3583 B15R2.325 O=C1C[C@H](Cc2ccccc2)C(=O)O1 Amb22226487 [0,1,0,1,0,0|0,0,1]=3 3584 B15R2.325 O=C1NC(Cc2ccccc2)C(=O)O1 Amb22496991 [0,1,0,1,0,0|1,0,1]=4 3585 B15R2.325 O=C1N[C@@H](Cc2ccccc2)C(=O)O1 Amb2684643 [0,1,0,1,0,0|1,0,1]=4 3586 B15R2.325 O=C1N[C@H](Cc2ccccc2)C(=O)O1 Amb2684642 [0,1,0,1,0,0|1,0,1]=4 3587 B15R2.1162 C=C(C)[C@H]1c2ccccc2CC[C@@H]1O Amb27789584 [0,1,0,1,0,0|2,0,0]=4 3588 B15R2.1162 C=C(C)[C@H]1c2ccccc2CC[C@H]1O Amb27853200 [0,1,0,1,0,0|2,0,0]=4 3589 B15R2.1162 CC(=O)C1C(=O)CCc2ccccc21 Amb31292542 [0,1,0,1,0,0|1,0,1]=4 3590 B15R2.1162 CC(=O)C1c2ccccc2OCC1C Amb27655169 [0,1,0,1,0,0|2,0,0]=4 3591 B15R2.1162 CC(=O)N1C(=O)CCc2ccccc21 Amb24686965 [0,1,0,1,0,0|1,0,1]=4 3592 B15R2.1162 CC(=O)N1c2ccccc2CCC1C Amb1908507 [0,1,0,1,0,0|1,0,0]=3 3593 B15R2.1162 CC(=O)N1c2ncccc2CCC1C Amb28137763 [0,1,0,1,0,0|2,0,0]=4 3594 B15R2.1162 CC1CCc2ccccc2C1C(=O)O Amb28128899 [0,1,0,1,0,0|2,0,0]=4 3595 B15R2.1162 C[C@H]1CCc2ccccc2[C@@H]1C(=O)O Amb27791834 [0,1,0,1,0,0|2,0,0]=4 3596 B15R2.1162 NC1CCc2ccccc2C1C(=O)O Amb27387933 [0,1,0,1,0,0|2,0,0]=4 3597 B15R2.1162 N[C@@H]1CCc2ccccc2[C@@H]1C(=O)O Amb28436891 [0,1,0,1,0,0|2,0,0]=4 3598 B15R2.1162 N[C@H]1CCc2ccccc2[C@@H]1C(=O)O Amb27845494 [0,1,0,1,0,0|2,0,0]=4 3599 B15R2.9420 CC1(COc2ccccc2)CC(=O)N1 Amb35672509 [0,1,0,1,0,0|2,0,0]=4 3600 B15R2.9420 CC1(CSc2ccccc2)CC(=O)N1 Amb27238493 [0,1,0,1,0,0|2,0,0]=4 3601 B15R2.19829 C=C(C)CC1(N)CCc2ccccc21 Amb30030523 [0,1,0,1,0,0|2,0,0]=4 3602 B15R2.19829 CC1(CC(=O)O)CCc2ccccc21 Amb17470747 [0,1,0,1,0,0|2,0,0]=4 3603 B15R2.133568 C=C(C)CC(O)C1Cc2ccccc21 Amb27791649 [0,1,0,1,0,0|2,0,0]=4 3604 B15R2.11 CS(=N)(=O)NC1CCc2ccccc21 Amb29851624 [0,1,0,1,0,0|2,0,0]=4 3605 B15R2.11 CS(=O)(=O)NC1CCc2ccccc21 Amb11260925 [0,1,0,1,0,0|2,0,0]=4 3606 B15R2.11 NS(=O)(=O)OC1CCc2ccccc21 Amb33262936 [0,1,0,1,0,0|2,0,0]=4 3607 B15R2.4444 CC(C)(C)O[C@H]1C[C@@H]1c2ccccc2 Amb27784522 [0,1,0,1,0,0|1,0,1]=4 3608 B15R2.4444 CS(=N)(=O)NC1CC1c2ccccc2 Amb29867302 [0,1,0,1,0,0|2,0,0]=4 3609 B15R2.4444 CS(=O)(=O)NC1CC1c2ccccc2 Amb11554699 [0,1,0,1,0,0|2,0,0]=4 3610 B15R2.109405 CS(=N)(=O)NCC1Cc2ccccc21 Amb35710898 [0,1,0,1,0,0|2,0,0]=4 3611 B15R2.109405 CS(=O)(=O)OCC1Cc2ccccc21 Amb19149038 [0,1,0,1,0,0|1,0,0]=3 3612 B15R2.109477 CS(=N)(=O)N1CCCc2ccccc21 Amb29867292 [0,1,0,1,0,0|2,0,0]=4 3613 B15R2.109477 CS(=O)(=O)N1CCCc2ccccc21 Amb6347513 [0,1,0,1,0,0|2,0,0]=4 3614 B15R2.94 C[C@@H]1CN[C@@H](c2ccccc2)CC1=O Amb27252199 [0,1,0,1,0,0|2,0,0]=4 3615 B15R2.94 C[C@H]1CC[C@@H](c2ccccc2)NC1=O Amb27197175 [0,1,0,1,0,0|2,0,0]=4 3616 B15R2.94 NC1CCC(c2ccccc2)NC1=O Amb18650609 [0,1,0,1,0,0|2,0,0]=4 3617 B15R2.94 O=C1CCC(c2ccccc2)CC1=O Amb27971467 [0,1,0,1,0,0|1,0,0]=3 3618 B15R2.314 CC1CN(Cc2ccccc2)CC1=O Amb20622818 [0,1,0,1,0,0|2,0,0]=4 3619 B15R2.314 CN1CC(Cc2ccccc2)OC1=O Amb18559294 [0,1,0,1,0,0|2,0,0]=4 3620 B15R2.314 C[C@H]1C[C@H](Cc2ccccc2)NC1=O Amb27441075 [0,1,0,1,0,0|2,0,0]=4 3621 B15R2.314 O=C1CC(Cc2ccccc2)CC1O Amb27835932 [0,1,0,1,0,0|1,0,0]=3 3622 B15R2.314 O=C1O[C@@H](Cc2ccccc2)C[C@@H]1O Amb27454878 [0,1,0,1,0,0|2,0,0]=4 3623 B15R2.314 O=C1O[C@H](Cc2ccccc2)C[C@H]1O Amb27218508 [0,1,0,1,0,0|2,0,0]=4 3624 B15R2.1255 C=C(C(=O)O)C1CCc2ccccc21 Amb24390831 [0,1,0,1,0,0|2,0,0]=4 3625 B15R2.1255 CC(=O)C(=O)N1CCc2ccccc21 Amb17401264 [0,1,0,1,0,0|2,0,0]=4 3626 B15R2.1255 CC(C(=O)O)C1CCc2ccccc21 Amb18819331 [0,1,0,1,0,0|2,0,0]=4 3627 B15R2.1255 CC(C(N)=O)C1CCc2ccccc21 Amb28436918 [0,1,0,1,0,0|2,0,0]=4 3628 B15R2.1255 C[C@@H](C(=O)O)C1CCc2ccccc21 Amb33727249 [0,1,0,1,0,0|2,0,0]=4 3629 B15R2.1255 C[C@H](C(=O)O)C1CCc2ccccc21 Amb33744632 [0,1,0,1,0,0|2,0,0]=4 3630 B15R2.1255 NC(C(=O)O)C1CCc2ccccc21 Amb20171617 [0,1,0,1,0,0|2,0,0]=4 3631 B15R2.1255 NC(C(=O)O)C1CCc2ccccc21 Amb33338864 [0,1,0,1,0,0|2,0,0]=4 3632 B15R2.1255 N[C@H](C(=O)O)[C@H]1CCc2ccccc21 Amb27983631 [0,1,0,1,0,0|2,0,0]=4 3633 B15R2.1255 O=C(O)C(=O)C1CCc2ccccc21 Amb33146105 [0,1,0,1,0,0|2,0,0]=4 3634 B15R2.1255 O=C(O)C(O)C1CCc2ccccc21 Amb27784262 [0,1,0,1,0,0|2,0,0]=4 3635 B15R2.4232 CC(C(=O)O)C1CC1c2ccccc2 Amb27872299 [0,1,0,1,0,0|2,0,0]=4 3636 B15R2.4232 CC(C(=O)O)[C@H]1C[C@@H]1c2ccccc2 Amb27232798 [0,1,0,1,0,0|2,0,0]=4 3637 B15R2.4232 NC(C(=O)O)C1CC1c2ccccc2 Amb28208216 [0,1,0,1,0,0|2,0,0]=4 3638 B15R2.4232 NC(C(=O)O)[C@H]1C[C@@H]1c2ccccc2 Amb27878617 [0,1,0,1,0,0|2,0,0]=4 3639 B15R2.8624 O=C1Nc2ccccc2CCCC1Br Amb27189561 [0,1,0,1,0,0|2,0,0]=4 3640 B15R2.16096 C[C@]1(C(=O)O)C[C@@H]1Cc2ccccc2 Amb33098427 [0,1,0,1,0,0|2,0,0]=4 3641 B15R2.16118 N[C@]1(C(=O)O)CC[C@@H]1c2ccccc2 Amb27872462 [0,1,0,1,0,0|2,0,0]=4 3642 B15R2.16118 N[C@]1(C(=O)O)CC[C@H]1c2ccccc2 Amb26657999 [0,1,0,1,0,0|2,0,0]=4 3643 B15R2.16364 CC1(C(=O)O)CCCc2ccccc21 Amb10844407 [0,1,0,1,0,0|2,0,0]=4 3644 B15R2.16364 NC(=O)[C@@]1(N)CCCc2ccccc21 Amb27746990 [0,1,0,1,0,0|2,0,0]=4 3645 B15R2.16364 NC1(C(=O)O)CCCc2ccccc21 Amb17622297 [0,1,0,1,0,0|2,0,0]=4 3646 B15R2.16364 NC1(C(=O)O)CCCc2ccccc21 Amb22492392 [0,1,0,1,0,0|2,0,0]=4 3647 B15R2.16364 NC1(C(=O)O)CCCc2ccccc21 Amb9728162 [0,1,0,1,0,0|2,0,0]=4 3648 B15R2.16364 N[C@@]1(C(=O)O)CCCc2ccccc21 Amb27640240 [0,1,0,1,0,0|2,0,0]=4 3649 B15R2.16364 N[C@]1(C(=O)O)CCCc2ccccc21 Amb27412988 [0,1,0,1,0,0|2,0,0]=4 3650 B15R2.16364 O=C(O)C1(Br)CCCc2ccccc21 Amb27747441 [0,1,0,1,0,0|2,0,0]=4 3651 B15R2.16364 O=C(O)C1(O)CCCc2ccccc21 Amb18944708 [0,1,0,1,0,0|2,0,0]=4 3652 B15R2.107888 CC(=O)C(C)CC1Cc2ccccc21 Amb27600605 [0,1,0,1,0,0|1,0,0]=3 3653 B15R2.107888 NC(CC1Cc2ccccc21)C(=O)O Amb28239447 [0,1,0,1,0,0|2,0,0]=4 3654 B15R2.107888 O=C(O)C(O)CC1Cc2ccccc21 Amb27621209 [0,1,0,1,0,0|2,0,0]=4 3655 B15R3.520 O=C1CC2(CCc3ccccc32)N1 Amb27198396 [0,0,0,2,0,0|1,0,0]=3 3656 B15R3.2009 NC1=NC2Cc3ccccc3C2O1 Amb28396548 [0,0,0,2,0,0|2,0,0]=4 3657 B15R3.2009 O=C1CC2Cc3ccccc3C2O1 Amb7090692 [0,0,0,2,0,0|0,0,0]=2 3658 B15R3.2009 O=C1CC2c3ccccc3CC2N1 Amb27754100 [0,0,0,2,0,0|2,0,0]=4 3659 B15R3.2009 O=C1C[C@H]2c3ccccc3C[C@H]2O1 Amb27471814 [0,0,0,2,0,0|2,0,0]=4 3660 B15R3.2009 O=C1NC2c3ccccc3CC2O1 Amb26904587 [0,0,0,2,0,0|2,0,0]=4 3661 B15R3.2009 O=C1N[C@H]2c3ccccc3C[C@H]2O1 Amb22336679 [0,0,0,2,0,0|2,0,0]=4 3662 B15R3.14764 O=C1Cc2cccc3c2C(CC3)C1 Amb27828876 [0,0,0,2,0,0|1,0,0]=3 3663 B15R3.89773 O=C(Cl)C1C2Cc3ccccc3C21 Amb25204231 [0,0,0,2,0,0|2,0,0]=4 3664 B15R3.89773 O=C(Cl)[C@@H]1[C@H]2Cc3ccccc3[C@H]21 Amb27668854 [0,0,0,2,0,0|2,0,0]=4 3665 B15R3.89773 O=C(O)C1C2Cc3ccccc3C21 Amb19148416 [0,0,0,2,0,0|2,0,0]=4 3666 B15R3.89773 O=C(O)[C@@H]1[C@H]2Cc3ccccc3[C@H]21 Amb27233556 [0,0,0,2,0,0|2,0,0]=4 3667 B15R3.514 O=C1C[C@@H]2C(c3ccccc3)[C@@H]2C1 Amb27802567 [0,0,0,2,0,0|1,0,0]=3 3668 B15R3.514 O=C1C[C@@H]2[C@H](c3ccccc3)[C@@H]2C1 Amb27861275 [0,0,0,2,0,0|1,0,0]=3 3669 B15R3.10083 O=C1CC[C@@H]2Cc3ccccc3[C@H]12 Amb28324331 [0,0,0,2,0,0|1,0,0]=3 3670 B15R3.10083 O=C1NNC2Cc3ccccc3C12 Amb4560415 [0,0,0,2,0,0|2,0,0]=4 3671 B15R3.131 O=C1C[C@@H](c2ccccc2)[C@@H]3C[C@H]13 Amb27427673 [0,0,0,2,0,0|1,0,0]=3 3672 B15R3.534 O=C1CCCC2c3ccccc3C12 Amb28366835 [0,0,0,2,0,0|1,0,0]=3 3673 B15R3.2013 CC1=CC2CCC1c3ccccc32 Amb6359911 [0,0,0,2,0,0|2,0,0]=4 3674 B15R3.2013 O=C1CC2CCC1c3ccccc32 Amb6359768 [0,0,0,2,0,0|1,0,0]=3 3675 B15R3.2013 O=C1CN2CCC1c3ccccc32 Amb27599385 [0,0,0,2,0,0|2,0,0]=4 3676 B15R3.2013 O=C1NC2CCC1c3ccccc32 Amb26068602 [0,0,0,2,0,0|2,0,0]=4 3677 B15R3.652 O=C1Cc2ccccc2[C@@H]3CC[C@H]13 Amb28057478 [0,0,0,2,0,0|1,0,0]=3 3678 B15R3.15114 O=C1CC2CNc3ccccc3N12 Amb27828632 [0,0,0,2,0,0|2,0,0]=4 3679 B15R3.14759 Cc1nc2cccc3c2n1CCC3 Amb17334898 [0,0,0,2,0,0|2,0,0]=4 3680 B15R3.14759 O=C1CN2C=CC=C3CCCC1=C32 Amb28243214 [0,0,0,2,0,0|2,0,0]=4 3681 B15R3.14759 O=C1Cc2cccc3c2C1NCC3 Amb24109569 [0,0,0,2,0,0|2,0,0]=4 3682 B15R3.14759 O=C1Cc2cccc3c2N1CCC3 Amb5718071 [0,0,0,2,0,0|1,0,0]=3 3683 B15R3.14759 O=C1Cc2cccc3c2N1CCN3 Amb18137683 [0,0,0,2,0,0|2,0,0]=4 3684 B15R3.14759 O=C1Cc2cccc3c2N1CCO3 Amb17335037 [0,0,0,2,0,0|2,0,0]=4 3685 B15R3.14759 O=C1Cc2cccc3c2N1CCS3 Amb27952715 [0,0,0,2,0,0|2,0,0]=4 3686 B15R3.14759 O=C1Nc2cccc3c2C1CCC3 Amb2754950 [0,0,0,2,0,0|2,0,0]=4 3687 B15R3.14759 O=C1Nc2cccc3c2N1CCC3 Amb18034015 [0,0,0,2,0,0|2,0,0]=4 3688 B11R1.4 O=CCCCCc1cccs1 Amb18048615 [1,0,0,0,1,0|2,0,0]=4 3689 B11R1.4 O=CCCCCc1ccsc1 Amb33449957 [1,0,0,0,1,0|2,0,0]=4 3690 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [0,0,0,0,2,0|1,0,0]=3 3691 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [0,0,0,0,2,0|2,0,0]=4 3692 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [0,0,0,0,2,0|2,0,0]=4 3693 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [0,0,0,0,2,0|2,0,0]=4 3694 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [0,0,0,0,2,0|2,0,0]=4 3695 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [0,0,0,0,2,0|1,0,0]=3 3696 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [0,0,0,0,2,0|0,0,2]=4 3697 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,0,0,0,2,0|2,0,0]=4 3698 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,0,0,0,2,0|1,1,0]=4 3699 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [0,0,0,0,2,0|0,0,2]=4 3700 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [0,0,0,0,2,0|0,0,0]=2 3701 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,0,0,0,2,0|1,0,0]=3 3702 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,0,0,0,2,0|1,0,0]=3 3703 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,0,0,0,2,0|1,0,0]=3 3704 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [0,0,0,0,2,0|1,0,0]=3 3705 B11R1.91 CC(=O)CCc1ccncn1 Amb27399166 [0,0,0,0,2,0|2,0,0]=4 3706 B11R1.91 CC(=O)CCc1cnccn1 Amb25307907 [0,0,0,0,2,0|2,0,0]=4 3707 B11R1.91 CC(=O)CCc1cncnc1 Amb28285350 [0,0,0,0,2,0|2,0,0]=4 3708 B11R1.91 CC(=O)CCc1ncccn1 Amb24726140 [0,0,0,0,2,0|2,0,0]=4 3709 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,0,0,0,2,0|1,0,0]=3 3710 B11R1.91 CC(=O)CNc1ccccn1 Amb26542003 [0,0,0,0,2,0|2,0,0]=4 3711 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [0,0,0,0,2,0|1,0,0]=3 3712 B11R1.91 CC(=O)COc1ccccn1 Amb26557634 [0,0,0,0,2,0|2,0,0]=4 3713 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [0,0,0,0,2,0|1,0,0]=3 3714 B11R1.91 CC(=O)CSc1ccccn1 Amb9215975 [0,0,0,0,2,0|2,0,0]=4 3715 B11R1.91 CC(=O)CSc1cccnc1 Amb28351579 [0,0,0,0,2,0|2,0,0]=4 3716 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,0,0,0,2,0|1,0,0]=3 3717 B11R1.91 CC(=O)NCc1ccccn1 Amb3358089 [0,0,0,0,2,0|2,0,0]=4 3718 B11R1.91 CC(=O)NCc1ccccn1 Amb6892496 [0,0,0,0,2,0|2,0,0]=4 3719 B11R1.91 CC(=O)NCc1ccncc1 Amb2694533 [0,0,0,0,2,0|2,0,0]=4 3720 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [0,0,0,0,2,0|2,0,0]=4 3721 B11R1.91 CC(=O)OC[n+]1ccccc1 Amb27259021 [0,0,0,0,2,0|1,0,0]=3 3722 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [0,0,0,0,2,0|0,0,0]=2 3723 B11R1.91 CC(=O)OCc1ccccn1 Amb9780355 [0,0,0,0,2,0|1,0,0]=3 3724 B11R1.91 CC(=O)OCc1cccnc1 Amb8388631 [0,0,0,0,2,0|1,0,0]=3 3725 B11R1.91 CC(=O)OCc1ncccn1 Amb22756932 [0,0,0,0,2,0|2,0,0]=4 3726 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [0,0,0,0,2,0|1,0,0]=3 3727 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [0,0,0,0,2,0|0,1,0]=3 3728 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,0,0,0,2,0|0,0,2]=4 3729 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [0,0,0,0,2,0|0,0,2]=4 3730 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [0,0,0,0,2,0|2,0,0]=4 3731 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,0,0,0,2,0|1,1,0]=4 3732 B11R1.91 CC(Br)CCc1ccccc1 Amb8835399 [0,0,0,0,2,0|1,0,1]=4 3733 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [0,0,0,0,2,0|1,0,1]=4 3734 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [0,0,0,0,2,0|2,0,0]=4 3735 B11R1.91 CC(C)CCc1ccccc1 Amb4477358 [0,0,0,0,2,0|1,0,1]=4 3736 B11R1.91 CC(C)OCc1ccccc1 Amb3988003 [0,0,0,0,2,0|1,0,1]=4 3737 B11R1.91 CC(Cl)CCc1ccccc1 Amb9205035 [0,0,0,0,2,0|1,0,1]=4 3738 B11R1.91 CC(N)CCc1ccccc1 Amb5740105 [0,0,0,0,2,0|1,0,1]=4 3739 B11R1.91 CC(N)CCc1ccccc1 Amb6383144 [0,0,0,0,2,0|1,0,1]=4 3740 B11R1.91 CC(O)CCc1ccccc1 Amb4009672 [0,0,0,0,2,0|0,0,2]=4 3741 B11R1.91 CC(S)CCc1ccccc1 Amb7784713 [0,0,0,0,2,0|0,1,1]=4 3742 B11R1.91 CN(C)CCc1ccccc1 Amb3428717 [0,0,0,0,2,0|2,0,0]=4 3743 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,0,0,0,2,0|2,0,0]=4 3744 B11R1.91 CN(O)CCc1ccccc1 Amb32953149 [0,0,0,0,2,0|1,0,1]=4 3745 B11R1.91 C[C@@H](N)CCc1ccccc1 Amb8516709 [0,0,0,0,2,0|1,0,1]=4 3746 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,0,0,0,2,0|0,0,2]=4 3747 B11R1.91 C[C@H](Br)CCc1ccccc1 Amb27592949 [0,0,0,0,2,0|1,0,1]=4 3748 B11R1.91 C[C@H](N)CCc1ccccc1 Amb8516076 [0,0,0,0,2,0|1,0,1]=4 3749 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,0,0,0,2,0|0,0,2]=4 3750 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [0,0,0,0,2,0|1,0,0]=3 3751 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [0,0,0,0,2,0|2,0,0]=4 3752 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [0,0,0,0,2,0|2,0,0]=4 3753 B11R1.91 N=C(N)OCc1ccccc1 Amb6773970 [0,0,0,0,2,0|2,0,0]=4 3754 B11R1.91 NC(=O)CC[n+]1ccccc1 Amb4010710 [0,0,0,0,2,0|2,0,0]=4 3755 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [0,0,0,0,2,0|1,0,0]=3 3756 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,0,0,0,2,0|2,0,0]=4 3757 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,0,0,0,2,0|2,0,0]=4 3758 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [0,0,0,0,2,0|2,0,0]=4 3759 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [0,0,0,0,2,0|2,0,0]=4 3760 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [0,0,0,0,2,0|2,0,0]=4 3761 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,0,0,0,2,0|2,0,0]=4 3762 B11R1.91 NC(=O)OCc1ccccc1 Amb4404204 [0,0,0,0,2,0|1,0,0]=3 3763 B11R1.91 NC(=O)OCc1cccnc1 Amb26464124 [0,0,0,0,2,0|2,0,0]=4 3764 B11R1.91 NC(=O)SCc1ccccc1 Amb28342215 [0,0,0,0,2,0|1,1,0]=4 3765 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,0,0,0,2,0|1,1,0]=4 3766 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [0,0,0,0,2,0|1,0,0]=3 3767 B11R1.91 O=C(Cl)CCc1ccccn1 Amb2696649 [0,0,0,0,2,0|2,0,0]=4 3768 B11R1.91 O=C(Cl)CCc1cccnc1 Amb24077445 [0,0,0,0,2,0|2,0,0]=4 3769 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [0,0,0,0,2,0|2,0,0]=4 3770 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [0,0,0,0,2,0|2,0,0]=4 3771 B11R1.91 O=C(Cl)OCc1ccccc1 Amb6296595 [0,0,0,0,2,0|1,0,0]=3 3772 B11R1.91 O=C(Cl)OCc1ccccn1 Amb33297000 [0,0,0,0,2,0|2,0,0]=4 3773 B11R1.91 O=C(Cl)OCc1cccnc1 Amb25852784 [0,0,0,0,2,0|2,0,0]=4 3774 B11R1.91 O=C(Cl)OCc1cccnc1 Amb33465543 [0,0,0,0,2,0|2,0,0]=4 3775 B11R1.91 O=C(Cl)OCc1ccncc1 Amb24559531 [0,0,0,0,2,0|2,0,0]=4 3776 B11R1.91 O=C(F)OCc1ccccc1 Amb27879062 [0,0,0,0,2,0|1,0,0]=3 3777 B11R1.91 O=C(O)CC[n+]1ccccc1 Amb31127608 [0,0,0,0,2,0|2,0,0]=4 3778 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [0,0,0,0,2,0|1,0,0]=3 3779 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [0,0,0,0,2,0|2,0,0]=4 3780 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [0,0,0,0,2,0|2,0,0]=4 3781 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [0,0,0,0,2,0|2,0,0]=4 3782 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [0,0,0,0,2,0|2,0,0]=4 3783 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [0,0,0,0,2,0|2,0,0]=4 3784 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [0,0,0,0,2,0|2,0,0]=4 3785 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [0,0,0,0,2,0|2,0,0]=4 3786 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [0,0,0,0,2,0|2,0,0]=4 3787 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [0,0,0,0,2,0|2,0,0]=4 3788 B11R1.91 O=C([O-])CCc1ccccn1 Amb32882485 [0,0,0,0,2,0|2,0,0]=4 3789 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [0,0,0,0,2,0|2,0,0]=4 3790 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [0,0,0,0,2,0|2,0,0]=4 3791 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [0,0,0,0,2,0|2,0,0]=4 3792 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [0,0,0,0,2,0|2,0,0]=4 3793 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [0,0,0,0,2,0|2,0,0]=4 3794 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [0,0,0,0,2,0|2,0,0]=4 3795 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [0,0,0,0,2,0|2,0,0]=4 3796 B11R1.172 CC(=O)CCCc1ccco1 Amb17232099 [0,0,0,0,2,0|1,0,0]=3 3797 B11R1.172 CC(=O)CCCc1cccs1 Amb17232678 [0,0,0,0,2,0|1,0,0]=3 3798 B11R1.172 CC(=O)CCCc1ccoc1 Amb28080133 [0,0,0,0,2,0|1,0,0]=3 3799 B11R1.172 CC(=O)CCCc1ccsc1 Amb27492050 [0,0,0,0,2,0|1,0,0]=3 3800 B11R1.172 CC(=O)CCCc1nccs1 Amb27492117 [0,0,0,0,2,0|2,0,0]=4 3801 B11R1.172 CC(=O)CCCn1cccn1 Amb9659583 [0,0,0,0,2,0|2,0,0]=4 3802 B11R1.172 CC(=O)CCNc1ccsc1 Amb32675826 [0,0,0,0,2,0|2,0,0]=4 3803 B11R1.172 CC(=O)CCSc1ccco1 Amb27672627 [0,0,0,0,2,0|2,0,0]=4 3804 B11R1.172 CC(=O)CSCc1ccco1 Amb6357577 [0,0,0,0,2,0|2,0,0]=4 3805 B11R1.172 CC(=O)CSCc1ccoc1 Amb27672517 [0,0,0,0,2,0|2,0,0]=4 3806 B11R1.172 CC(=O)NCCc1ccco1 Amb8336373 [0,0,0,0,2,0|2,0,0]=4 3807 B11R1.172 CC(=O)NCCc1ccoc1 Amb22643451 [0,0,0,0,2,0|2,0,0]=4 3808 B11R1.172 CC(=O)NCCn1cccc1 Amb2409180 [0,0,0,0,2,0|2,0,0]=4 3809 B11R1.172 CC(=O)OCCc1ccco1 Amb27272289 [0,0,0,0,2,0|1,0,0]=3 3810 B11R1.172 CC(=O)OCCc1cccs1 Amb24756179 [0,0,0,0,2,0|1,0,0]=3 3811 B11R1.172 CC(=O)OCCc1cscn1 Amb27989529 [0,0,0,0,2,0|2,0,0]=4 3812 B11R1.172 CC(=O)OCSc1cccs1 Amb27270358 [0,0,0,0,2,0|2,0,0]=4 3813 B11R1.172 NC(=O)CCCc1cccs1 Amb8858354 [0,0,0,0,2,0|2,0,0]=4 3814 B11R1.172 NC(=O)CCCn1cccc1 Amb13865744 [0,0,0,0,2,0|2,0,0]=4 3815 B11R1.172 NC(=O)OCCn1cccc1 Amb27271168 [0,0,0,0,2,0|2,0,0]=4 3816 B11R1.172 O=C(Cl)OCCc1cccs1 Amb27269565 [0,0,0,0,2,0|2,0,0]=4 3817 B11R1.172 O=C(Cl)OCCc1ccoc1 Amb33297070 [0,0,0,0,2,0|2,0,0]=4 3818 B11R1.172 O=C(Cl)OCCc1ccsc1 Amb27989801 [0,0,0,0,2,0|2,0,0]=4 3819 B11R1.172 O=C(O)CCCc1ccco1 Amb18125675 [0,0,0,0,2,0|2,0,0]=4 3820 B11R1.172 O=C(O)CCCc1cccs1 Amb1152340 [0,0,0,0,2,0|2,0,0]=4 3821 B11R1.172 O=C(O)CCCc1ccoc1 Amb25385034 [0,0,0,0,2,0|2,0,0]=4 3822 B11R1.172 O=C(O)CCCc1ccsc1 Amb22000608 [0,0,0,0,2,0|2,0,0]=4 3823 B11R1.172 O=C(O)CCCn1cccc1 Amb1130872 [0,0,0,0,2,0|2,0,0]=4 3824 B11R1.172 O=C([O-])CCCc1cccs1 Amb33513078 [0,0,0,0,2,0|2,0,0]=4 3825 B15R1.504 CC(=O)CCCCSCc1ccccc1 Amb9660327 [0,0,0,0,0,2|1,0,0]=3 3826 B15R1.504 CC(=O)NCCNCCc1ccccc1 Amb6732507 [0,0,0,0,0,2|1,0,0]=3 3827 B15R1.504 CC(=O)OCCCNCc1ccccc1 Amb18266489 [0,0,0,0,0,2|0,0,0]=2 3828 B15R1.504 CC(=O)\C=C\CCNCc1ccccc1 Amb24577398 [0,0,0,0,0,2|1,0,0]=3 3829 B15R1.504 CC(C)COCCNCc1ccccc1 Amb27773596 [0,0,0,0,0,2|1,0,1]=4 3830 B15R1.504 CC(C)OCCCNCc1ccccc1 Amb875689 [0,0,0,0,0,2|1,0,1]=4 3831 B15R1.504 CC(C)OCCNOCc1ccccc1 Amb28457959 [0,0,0,0,0,2|1,0,1]=4 3832 B15R1.504 NC(=S)COCCOCc1ccccc1 Amb27751946 [0,0,0,0,0,2|1,1,0]=4 3833 B15R1.504 O=C(Cl)CCCCOCc1ccccc1 Amb27825545 [0,0,0,0,0,2|2,0,0]=4 3834 B15R1.504 O=C(O)CCCCCCc1ccccc1 Amb2690289 [0,0,0,0,0,2|2,0,0]=4 3835 B15R1.504 O=C(O)CCCCCOc1ccccc1 Amb21935952 [0,0,0,0,0,2|2,0,0]=4 3836 B15R1.504 O=C(O)CCCCCSc1ccccc1 Amb32410665 [0,0,0,0,0,2|2,0,0]=4 3837 B15R1.504 O=C(O)CCCCNCc1ccccc1 Amb16494852 [0,0,0,0,0,2|2,0,0]=4 3838 B15R1.504 O=C(O)CCCCNCc1ccccc1 Amb32412923 [0,0,0,0,0,2|2,0,0]=4 3839 B15R1.504 O=C(O)CCCCOCc1ccccc1 Amb7782921 [0,0,0,0,0,2|2,0,0]=4 3840 B15R1.504 O=C(O)CCCNCCc1ccccc1 Amb10609387 [0,0,0,0,0,2|2,0,0]=4 3841 B15R1.504 O=C(O)CCCNCCc1ccccc1 Amb8961042 [0,0,0,0,0,2|2,0,0]=4 3842 B15R1.504 O=C(O)CCCOCCc1ccccc1 Amb7790060 [0,0,0,0,0,2|2,0,0]=4 3843 B15R1.504 O=C(O)CCSCCCc1ccccc1 Amb6258617 [0,0,0,0,0,2|1,1,0]=4 3844 B15R1.504 O=C(O)CNCCNCc1ccccc1 Amb27401112 [0,0,0,0,0,2|2,0,0]=4 3845 B15R1.504 O=C(O)COCCOCc1ccccc1 Amb18866096 [0,0,0,0,0,2|1,0,0]=3