0 B14R1.158 CC(Cc1ccccc1)NCCC#N Amb22055262 [0,0,0,0,0,0|1,0,1]=2 1 B14R1.158 CCCC#CC(O)Cc1ccccc1 Amb25190738 [0,0,0,0,0,0|3,0,1]=4 2 B14R1.158 CCCCCC(=O)Cc1ccccc1 Amb19061100 [0,0,0,0,0,0|3,0,1]=4 3 B14R1.158 CCCCNC(=N)Nc1ccccc1 Amb19073543 [0,0,0,0,0,0|3,0,1]=4 4 B14R1.158 CCCCNC(=S)Cc1ccccc1 Amb10561700 [0,0,0,0,0,0|2,0,1]=3 5 B14R1.158 CCCCNC(=S)Nc1ccccc1 Amb1804766 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.158 CCCCNC(C)Cc1ccccc1 Amb19041462 [0,0,0,0,0,0|1,0,0]=1 7 B14R1.158 CCCNCC(C)Oc1ccccc1 Amb19079694 [0,0,0,0,0,0|4,0,0]=4 8 B14R1.158 CCNCCN(C)Cc1ccccc1 Amb19041873 [0,0,0,0,0,0|4,0,0]=4 9 B14R1.158 CN(CCCCBr)Cc1ccccc1 Amb25043982 [0,0,0,0,0,0|2,1,0]=3 10 B14R1.158 CN(C\C=C\CCl)Cc1ccccc1 Amb25731277 [0,0,0,0,0,0|2,0,2]=4 11 B14R1.158 COCCCN(Cc1ccccc1)C Amb17235703 [0,0,0,0,0,0|4,0,0]=4 12 B14R1.158 ClCCCCN(Cc1ccccc1)C Amb17339782 [0,0,0,0,0,0|2,0,0]=2 13 B14R1.158 FCCCNC(=S)Nc1ccccc1 Amb25281222 [0,0,0,0,0,0|2,1,1]=4 14 B14R1.158 N#CCCNC(=O)Cc1ccccc1 Amb17401185 [0,0,0,0,0,0|2,0,2]=4 15 B14R1.158 N=C(Nc1ccccc1)NCCCF Amb24385489 [0,0,0,0,0,0|2,1,1]=4 16 B14R1.158 N=C(Nc1ccccc1)NCCCO Amb19061807 [0,0,0,0,0,0|3,0,1]=4 17 B14R1.158 N=C(Nc1ccccc1)NCCCS Amb25698832 [0,0,0,0,0,0|3,0,1]=4 18 B14R1.158 NCCCNC(=O)Nc1ccccc1 Amb10808642 [0,0,0,0,0,0|3,0,1]=4 19 B14R1.158 NCCCNC(=O)Nc1ccccc1 Amb18330404 [0,0,0,0,0,0|3,0,1]=4 20 B14R1.158 NCCCNC(=S)Nc1ccccc1 Amb24336503 [0,0,0,0,0,0|3,0,1]=4 21 B14R1.158 NOCCCN(Cc1ccccc1)C Amb17104882 [0,0,0,0,0,0|4,0,0]=4 22 B14R1.158 O=C(Nc1cccc[n]1)NCCCCl Amb25834607 [0,0,0,0,0,0|3,0,1]=4 23 B14R1.158 O=C(Nc1ccccc1)NCCCF Amb25766553 [0,0,0,0,0,0|2,1,1]=4 24 B14R1.158 O=C(Nc1ccccc1)NCCCS Amb24366688 [0,0,0,0,0,0|3,0,1]=4 25 B14R1.158 O=C(Nc1ccccc1)NOCCCl Amb24063969 [0,0,0,0,0,0|3,0,1]=4 26 B14R1.158 OCCCN\C(\S)=N\c1ccccc1 Amb22330467 [0,0,0,0,0,0|3,0,1]=4 27 B13R1.28 BrCCCCCOc1ccccc1 Amb22730694 [1,0,0,0,0,0|2,1,0]=4 28 B13R1.28 C#CCCNOCc1ccccc1 Amb24609352 [1,0,0,0,0,0|2,0,1]=4 29 B13R1.28 C=CCCNCCc1ccccc1 Amb19737352 [1,0,0,0,0,0|1,0,1]=3 30 B13R1.28 CCCCCCCc1c[n]ccc1 Amb22235253 [1,0,0,0,0,0|3,0,0]=4 31 B13R1.28 CCCCCCCc1cc[n]cc1 Amb22235258 [1,0,0,0,0,0|3,0,0]=4 32 B13R1.28 CCCCCCCc1cccc[n]1 Amb22235249 [1,0,0,0,0,0|3,0,0]=4 33 B13R1.28 CCCCNCCc1c[n]ccc1 Amb18180859 [1,0,0,0,0,0|2,0,0]=3 34 B13R1.28 CCCCNCCc1ccccc1 Amb2172322 [1,0,0,0,0,0|1,0,0]=2 35 B13R1.28 CCCCOCCc1ccccc1 Amb24065444 [1,0,0,0,0,0|2,0,0]=3 36 B13R1.28 CCCNCCCc1ccccc1 Amb20673529 [1,0,0,0,0,0|3,0,0]=4 37 B13R1.28 CCCOCCCc1ccccc1 Amb24063573 [1,0,0,0,0,0|3,0,0]=4 38 B13R1.28 CNCCNCCc1ccccc1 Amb20140448 [1,0,0,0,0,0|2,0,0]=3 39 B13R1.28 COCCNCCc1ccccc1 Amb2119876 [1,0,0,0,0,0|2,0,0]=3 40 B13R1.28 COCCNCCc1ccncc1 Amb16191750 [1,0,0,0,0,0|3,0,0]=4 41 B13R1.28 ClCCCC#CCc1c[n]ccc1 Amb25336104 [1,0,0,0,0,0|2,0,1]=4 42 B13R1.28 ClCCCC#CCc1cc[n]cc1 Amb25842802 [1,0,0,0,0,0|2,0,1]=4 43 B13R1.28 ClCCCCC#Cc1ccccc1 Amb24693851 [1,0,0,0,0,0|1,0,2]=4 44 B13R1.28 ClCCCCCCc1c[n]c[n]c1 Amb24070772 [1,0,0,0,0,0|3,0,0]=4 45 B13R1.28 ClCCCCCCc1ccccc1 Amb10807864 [1,0,0,0,0,0|1,0,0]=2 46 B13R1.28 ClCCCCOCc1ccccc1 Amb19084569 [1,0,0,0,0,0|2,0,0]=3 47 B13R1.28 ClCCCNCCc1ccccc1 Amb20620360 [1,0,0,0,0,0|0,0,0]=1 48 B13R1.28 ClCCCSC#Cc1ccccc1 Amb25117453 [1,0,0,0,0,0|1,0,2]=4 49 B13R1.28 ClCC\C=N\OCc1ccccc1 Amb25299430 [1,0,0,0,0,0|1,0,2]=4 50 B13R1.28 Cl[Mg]CCCCCc1ccccc1 Amb22897683 [1,0,0,0,0,0|2,0,0]=3 51 B13R1.28 Cl[Zn]CCCCCc1ccccc1 Amb22897865 [1,0,0,0,0,0|2,0,0]=3 52 B13R1.28 Cl\C=C\CNOCc1ccccc1 Amb24383522 [1,0,0,0,0,0|1,0,2]=4 53 B13R1.28 ICCCCNCc1ccccc1 Amb25823282 [1,0,0,0,0,0|2,1,0]=4 54 B13R1.28 N#CCCCCCc1ccccc1 Amb22230104 [1,0,0,0,0,0|2,0,1]=4 55 B13R1.28 N#CCCNCCc1ccccc1 Amb21953980 [1,0,0,0,0,0|1,0,1]=3 56 B13R1.28 NCCCCCCc1ccccc1 Amb17233312 [1,0,0,0,0,0|2,0,0]=3 57 B13R1.28 NCCCCCCc1ccccc1 Amb17619338 [1,0,0,0,0,0|2,0,0]=3 58 B13R1.28 NCCCCNCc1ccccc1 Amb17335258 [1,0,0,0,0,0|3,0,0]=4 59 B13R1.28 NCCCNCCc1ccccc1 Amb17315277 [1,0,0,0,0,0|1,0,0]=2 60 B13R1.28 NCCCNOCc1ccccc1 Amb24373107 [1,0,0,0,0,0|2,0,0]=3 61 B13R1.28 NCCNCCCc1ccccc1 Amb17091041 [1,0,0,0,0,0|3,0,0]=4 62 B13R1.28 OCCC#CCCc1ccccc1 Amb25787200 [1,0,0,0,0,0|2,0,1]=4 63 B13R1.28 OCCCCCNc1ccccc1 Amb17335345 [1,0,0,0,0,0|3,0,0]=4 64 B13R1.28 OCCCOCCc1ccccc1 Amb10609118 [1,0,0,0,0,0|2,0,0]=3 65 B13R1.28 OCCC\C=N\Cc1ccccc1 Amb25763928 [1,0,0,0,0,0|3,0,0]=4 66 B13R1.28 SCCCCOCc1ccccc1 Amb24489555 [1,0,0,0,0,0|3,0,0]=4 67 B13R1.28 [NH3+]CCCCCCc1ccccc1 Amb22729464 [1,0,0,0,0,0|2,0,0]=3 68 B13R1.44 CC(CCCO)Nc1ccccc1 Amb21984572 [1,0,0,0,0,0|2,0,0]=3 69 B13R1.44 CC(Cc1ccccc1)NCC#C Amb17618673 [1,0,0,0,0,0|0,0,2]=3 70 B13R1.44 CC(Cc1ccccc1)NCC#C Amb19148861 [1,0,0,0,0,0|0,0,2]=3 71 B13R1.44 CCC#CC(Cl)Cc1ccccc1 Amb24571685 [1,0,0,0,0,0|2,0,1]=4 72 B13R1.44 CCCCC(Cc1ccccn1)O Amb10573728 [1,0,0,0,0,0|3,0,0]=4 73 B13R1.44 CCCCN(Cc1ccccc1)C Amb1828371 [1,0,0,0,0,0|2,0,0]=3 74 B13R1.44 CCCNC(=N)Nc1ccccc1 Amb18184209 [1,0,0,0,0,0|2,0,1]=4 75 B13R1.44 CCCNC(=O)Nc1ccccc1 Amb1233730 [1,0,0,0,0,0|2,0,1]=4 76 B13R1.44 CCCNC(=S)Nc1ccccc1 Amb2458951 [1,0,0,0,0,0|2,0,1]=4 77 B13R1.44 CCCNC(C)Cc1ccccc1 Amb18180702 [1,0,0,0,0,0|0,0,0]=1 78 B13R1.44 CCC\N=C(\N)/Cc1ccccc1 Amb23569054 [1,0,0,0,0,0|1,0,2]=4 79 B13R1.44 CCNCC(C)Oc1ccccc1 Amb18186428 [1,0,0,0,0,0|3,0,0]=4 80 B13R1.44 CC\C=C\C(C)Nc1ccccc1 Amb25176158 [1,0,0,0,0,0|2,0,1]=4 81 B13R1.44 CN(CCCF)Cc1ccccc1 Amb25098301 [1,0,0,0,0,0|1,1,0]=3 82 B13R1.44 CN(CCCN)Cc1ccccc1 Amb22001972 [1,0,0,0,0,0|2,0,0]=3 83 B13R1.44 CN(C\C=C\Cl)Cc1ccccc1 Amb24688896 [1,0,0,0,0,0|1,0,2]=4 84 B13R1.44 CN(Cc1ccccc1)CCC#C Amb25681570 [1,0,0,0,0,0|2,0,1]=4 85 B13R1.44 CN(Cc1ccccc1)CCC#N Amb10812390 [1,0,0,0,0,0|2,0,1]=4 86 B13R1.44 CN(Cc1ccccc1)CCC=O Amb18178416 [1,0,0,0,0,0|2,0,1]=4 87 B13R1.44 CN(Cc1ccccc1)CCNN Amb24741208 [1,0,0,0,0,0|3,0,0]=4 88 B13R1.44 CN(Cc1ccccc1)CCON Amb22446488 [1,0,0,0,0,0|3,0,0]=4 89 B13R1.44 ClCCCC(=O)Nc1ccccc1 Amb1125144 [1,0,0,0,0,0|2,0,1]=4 90 B13R1.44 ClCCCN(Cc1ccccc1)C Amb17337263 [1,0,0,0,0,0|1,0,0]=2 91 B13R1.44 ClCCCN(Cc1ccncc1)C Amb17337375 [1,0,0,0,0,0|2,0,0]=3 92 B13R1.44 ClCCNC(=O)Cc1ccccc1 Amb2429404 [1,0,0,0,0,0|1,0,1]=3 93 B13R1.44 NCCCN(Cc1ccccc1)C Amb2371220 [1,0,0,0,0,0|2,0,0]=3 94 B13R1.44 NN(CCCO)Cc1ccccc1 Amb24475815 [1,0,0,0,0,0|3,0,0]=4 95 B13R1.44 NOCCN(Cc1ccccc1)C Amb17104856 [1,0,0,0,0,0|3,0,0]=4 96 B13R1.44 O=C(Cc1ccccc1)OCCCl Amb24065572 [1,0,0,0,0,0|2,0,1]=4 97 B13R1.44 OCCNC(=O)Cc1ccccc1 Amb2437031 [1,0,0,0,0,0|2,0,1]=4 98 B13R1.44 [BH3]N(CCCC)Cc1ccccc1 Amb25766401 [1,0,0,0,0,0|3,0,0]=4 99 B15R1.83 CCCCCCC(C)Sc1ccccc1 Amb22359390 [0,1,0,0,0,0|3,0,0]=4 100 B15R1.83 CCCCCNC(C)Cc1ccccc1 Amb20222579 [0,1,0,0,0,0|1,0,0]=2 101 B15R1.83 CCCCNCC(C)Oc1ccccc1 Amb20077841 [0,1,0,0,0,0|2,0,0]=3 102 B15R1.83 CCCNCCN(C)Cc1ccccc1 Amb20080433 [0,1,0,0,0,0|3,0,0]=4 103 B15R1.83 CN(Cc1ccccc1)CCCCC#N Amb22340408 [0,1,0,0,0,0|3,0,0]=4 104 B15R1.83 CN(Cc1ccccc1)CCNCCF Amb24594756 [0,1,0,0,0,0|2,1,0]=4 105 B15R1.83 CN(Cc1ccccc1)CCNCCN Amb25273293 [0,1,0,0,0,0|3,0,0]=4 106 B15R1.83 CN(Cc1ccccc1)CCNCCO Amb24545742 [0,1,0,0,0,0|3,0,0]=4 107 B15R1.83 CN(Cc1ccccc1)CCOCCBr Amb25085803 [0,1,0,0,0,0|2,1,0]=4 108 B15R1.83 CN(Cc1ccccc1)CCOCCS Amb24363383 [0,1,0,0,0,0|3,0,0]=4 109 B15R1.83 CNCCCCN(C)Cc1ccccc1 Amb24430854 [0,1,0,0,0,0|3,0,0]=4 110 B15R1.83 COCCNCC(C)Oc1ccccc1 Amb20172930 [0,1,0,0,0,0|3,0,0]=4 111 B15R1.83 C\C(\CNCCCC)=C/c1ccccc1 Amb20673564 [0,1,0,0,0,0|1,0,2]=4 112 B15R1.83 C\C(\CNCCCC)=C/c1ccccc1 Amb20673566 [0,1,0,0,0,0|1,0,2]=4 113 B15R1.83 C\C(\CNCCCO)=C\c1ccccc1 Amb25389587 [0,1,0,0,0,0|1,0,2]=4 114 B15R1.83 NCCOCCN(Cc1ccccc1)C Amb17140368 [0,1,0,0,0,0|3,0,0]=4 115 B15R1.83 NCCSCCN(Cc1ccccc1)C Amb17108978 [0,1,0,0,0,0|3,0,0]=4 116 B15R1.83 NOCCCNC(=O)Cc1ccccc1 Amb17140322 [0,1,0,0,0,0|2,0,1]=4 117 B15R1.83 OCCCCCN(Cc1ccccc1)C Amb17338912 [0,1,0,0,0,0|3,0,0]=4 118 B15R1.83 OCCCCNC(=O)Cc1ccccc1 Amb17103012 [0,1,0,0,0,0|2,0,1]=4 119 B15R1.93 CC(NCCCC)C(O)c1ccccc1 Amb18604512 [0,1,0,0,0,0|1,0,0]=2 120 B15R1.93 CC(NCCCO)C(O)c1ccccc1 Amb18604506 [0,1,0,0,0,0|1,0,0]=2 121 B15R1.93 CC(NCCOC)C(O)c1ccccc1 Amb18604524 [0,1,0,0,0,0|2,0,0]=3 122 B15R1.93 NCCCSC(C(=O)c1ccccc1)C Amb17500709 [0,1,0,0,0,0|2,0,1]=4 123 B15R1.93 OCCCNC(=O)C(c1ccccc1)Cl Amb17324272 [0,1,0,0,0,0|2,0,1]=4 124 B15R1.128 CC(Cc1ccc(N)cc1)NCCCO Amb18550312 [0,1,0,0,0,0|1,0,0]=2 125 B15R1.128 CCCCCN(C)Cc1ccc(Cl)cc1 Amb20784250 [0,1,0,0,0,0|3,0,0]=4 126 B15R1.128 CCCCNC(=O)Cc1ccc(N)cc1 Amb25388133 [0,1,0,0,0,0|2,0,1]=4 127 B15R1.128 CCCCNC(C)Cc1ccc(N)cc1 Amb18050262 [0,1,0,0,0,0|1,0,0]=2 128 B15R1.128 CN(Cc1ccc(F)cc1)CCCCBr Amb20669057 [0,1,0,0,0,0|2,1,0]=4 129 B15R1.128 CN(Cc1ccc(F)cc1)CCCCBr Amb22058973 [0,1,0,0,0,0|2,1,0]=4 130 B15R1.128 COCCNC(C)Cc1ccc(Br)cc1 Amb18553086 [0,1,0,0,0,0|2,0,0]=3 131 B15R1.128 COCCNC(C)Cc1ccc(Cl)cc1 Amb18553087 [0,1,0,0,0,0|2,0,0]=3 132 B15R1.128 COCCNC(C)Cc1ccc(N)cc1 Amb18050738 [0,1,0,0,0,0|2,0,0]=3 133 B15R1.128 COCCNC(Cc1ccc(cc1)F)C Amb10815078 [0,1,0,0,0,0|2,0,0]=3 134 B15R1.128 Cc1ccc(CC(=O)NCCCN)cc1 Amb25388946 [0,1,0,0,0,0|2,0,1]=4 135 B15R1.128 Cc1ccc(CC(C)NCCCC)cc1 Amb18053926 [0,1,0,0,0,0|1,0,0]=2 136 B15R1.128 Cc1ccc(CC(C)NCCOC)cc1 Amb18553082 [0,1,0,0,0,0|2,0,0]=3 137 B15R1.128 NCCCNC(=O)Cc1ccc(Br)cc1 Amb25388441 [0,1,0,0,0,0|2,0,1]=4 138 B15R1.128 NCCCNC(=O)Cc1ccc(Cl)cc1 Amb25388507 [0,1,0,0,0,0|2,0,1]=4 139 B15R1.128 NCCCNC(=O)Cc1ccc(F)cc1 Amb25388442 [0,1,0,0,0,0|2,0,1]=4 140 B15R1.129 CCCCNC(=O)Cc1cccc(Br)c1 Amb23111176 [0,1,0,0,0,0|2,0,1]=4 141 B15R1.129 CCCCNC(=O)Cc1cccc(Cl)c1 Amb23253599 [0,1,0,0,0,0|2,0,1]=4 142 B15R1.129 CCCCNC(C)Cc1cccc(Br)c1 Amb18053952 [0,1,0,0,0,0|1,0,0]=2 143 B15R1.129 COCCNC(C)Cc1cccc(Br)c1 Amb18054021 [0,1,0,0,0,0|2,0,0]=3 144 B15R1.129 NCCCNC(=O)Cc1cccc(Br)c1 Amb24772326 [0,1,0,0,0,0|2,0,1]=4 145 B15R1.129 NCCCNC(=O)Cc1cccc(F)c1 Amb25388474 [0,1,0,0,0,0|2,0,1]=4 146 B15R1.551 C#CCCN(C(Cc1cccnc1)C)C Amb17619612 [0,1,0,0,0,0|2,0,1]=4 147 B15R1.551 CC(CCCN)N(C)Cc1ccccc1 Amb25239954 [0,1,0,0,0,0|3,0,0]=4 148 B15R1.551 CN(Cc1ccccc1)C(=O)CCCN Amb25388599 [0,1,0,0,0,0|3,0,0]=4 149 B15R1.551 ClCCCC(=O)N(Cc1ccccn1)C Amb17330220 [0,1,0,0,0,0|3,0,0]=4 150 B15R1.551 O=C(CCCCl)N(P)Cc1ccccc1 Amb22053372 [0,1,0,0,0,0|3,0,0]=4 151 B15R1.551 OCCCC(=O)N(Cc1ccccc1)C Amb17239267 [0,1,0,0,0,0|3,0,0]=4 152 B15R1.809 BrCCC(=O)NC(Cc1ccccc1)C Amb17327276 [0,1,0,0,0,0|0,1,1]=3 153 B15R1.809 BrCCC(=O)NC(Cc1ccccn1)C Amb17324947 [0,1,0,0,0,0|1,1,1]=4 154 B15R1.809 BrCCC(=O)NC(Cc1ccncc1)C Amb17323262 [0,1,0,0,0,0|1,1,1]=4 155 B15R1.809 CCCC(O)CN(C)Cc1ccccc1 Amb25051630 [0,1,0,0,0,0|3,0,0]=4 156 B15R1.809 CN(CC(N)CCO)Cc1ccccc1 Amb25761011 [0,1,0,0,0,0|3,0,0]=4 157 B15R1.809 CN(CC(O)CCN)Cc1ccccc1 Amb18568574 [0,1,0,0,0,0|3,0,0]=4 158 B15R1.809 ClCCC(=O)NC(=O)Cc1ccccc1 Amb17872658 [0,1,0,0,0,0|1,0,2]=4 159 B15R1.809 ClCCC(=O)NC(Cc1cccnc1)C Amb17331763 [0,1,0,0,0,0|1,0,1]=3 160 B15R1.809 NCCC(CN(Cc1ccccc1)C)C Amb17338609 [0,1,0,0,0,0|3,0,0]=4 161 B15R1.964 CN(Cc1ccccc1)CCC(O)CN Amb25204085 [0,1,0,0,0,0|3,0,0]=4 162 B15R1.964 NCC(CCN(Cc1ccccc1)C)C Amb17338596 [0,1,0,0,0,0|3,0,0]=4 163 B15R1.1035 CCN(CCCCBr)Cc1ccccc1 Amb25727835 [0,1,0,0,0,0|2,1,0]=4 164 B15R1.1035 CCN(CCCCS)Cc1ccccc1 Amb25846631 [0,1,0,0,0,0|3,0,0]=4 165 B15R1.1035 ClCCCCN(Cc1ccccc1)CC Amb17343514 [0,1,0,0,0,0|2,0,0]=3 166 B15R1.1081 CC(Cc1ccccc1)NCCC(N)=O Amb20207671 [0,1,0,0,0,0|1,0,1]=3 167 B15R1.1081 CC(Cc1ccccc1)NCCC(O)=O Amb20207676 [0,1,0,0,0,0|1,0,1]=3 168 B15R1.1081 CC(N)CCCN(C)Cc1ccccc1 Amb24443668 [0,1,0,0,0,0|3,0,0]=4 169 B15R1.1081 CC(O)CCCN(C)Cc1ccccc1 Amb25367114 [0,1,0,0,0,0|3,0,0]=4 170 B15R1.1081 CN(Cc1ccccc1)CCCC(=O)Cl Amb17144056 [0,1,0,0,0,0|2,0,1]=4 171 B15R1.1409 CCCCCN(C)Cc1ccccc1F Amb20784249 [0,1,0,0,0,0|3,0,0]=4 172 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl Amb21373314 [0,1,0,0,0,0|2,0,1]=4 173 B15R1.1409 CCCCNC(=O)Cc1ccccc1F Amb23014334 [0,1,0,0,0,0|2,0,1]=4 174 B15R1.1409 Cc1ccccc1CC(=O)NCCCN Amb25388477 [0,1,0,0,0,0|2,0,1]=4 175 B15R1.1409 Cc1ccccc1CN(C)CCCCC Amb20783759 [0,1,0,0,0,0|3,0,0]=4 176 B15R1.1409 NCCCNC(=O)Cc1ccccc1F Amb25388459 [0,1,0,0,0,0|2,0,1]=4 177 B15R1.2074 NCCCNS(=O)(=O)Cc1ccccc1 Amb25388204 [0,1,0,0,0,0|3,0,0]=4 178 B15R2.15 BrCC1CN(Cc2ccccc2)CC1 Amb21861135 [0,0,0,1,0,0|2,1,0]=4 179 B15R2.15 CCC1COC(Cc2ccccc2)N1 Amb25809037 [0,0,0,1,0,0|3,0,0]=4 180 B15R2.15 CC[C@@H]1CN(Cc2ccccc2)CC1 Amb24535886 [0,0,0,1,0,0|3,0,0]=4 181 B15R2.15 CC[C@H]1COC(Cc2ccccc2)N1 Amb24451035 [0,0,0,1,0,0|3,0,0]=4 182 B15R2.15 ClCC1CC(Cc2ccccc2)=NO1 Amb23453846 [0,0,0,1,0,0|1,0,2]=4 183 B15R2.15 ClCC1CCN(C1)Cc2ccccc2 Amb15701503 [0,0,0,1,0,0|2,0,0]=3 184 B15R2.15 ClCC1CN(Cc2ccccc2)CC1 Amb21959762 [0,0,0,1,0,0|2,0,0]=3 185 B15R2.15 ClCC1COC(Cc2ccccc2)O1 Amb25104927 [0,0,0,1,0,0|2,0,0]=3 186 B15R2.15 ICC1CCC(Cc2ccccc2)O1 Amb25719270 [0,0,0,1,0,0|2,1,0]=4 187 B15R2.15 ICC1CN(Cc2ccccc2)CC1 Amb21861138 [0,0,0,1,0,0|2,1,0]=4 188 B15R2.15 NCC1CCC(O1)Cc2ccccc2 Amb17595001 [0,0,0,1,0,0|3,0,0]=4 189 B15R2.15 NCC1CCN(C1)Cc2ccccc2 Amb2236428 [0,0,0,1,0,0|3,0,0]=4 190 B15R2.15 NCC1CCN(C1)Cc2ccccc2 Amb2237156 [0,0,0,1,0,0|3,0,0]=4 191 B15R2.15 NC[C@H]1CN(Cc2ccccc2)CC1 Amb22388641 [0,0,0,1,0,0|3,0,0]=4 192 B15R2.15 OCC1CC(Cc2ccccc2)CN1 Amb25275270 [0,0,0,1,0,0|3,0,0]=4 193 B15R2.15 OCC1CNC(Cc2ccccc2)=N1 Amb24727143 [0,0,0,1,0,0|2,0,1]=4 194 B15R2.15 OC[C@@H]1CCN(C1)Cc2ccccc2 Amb10067142 [0,0,0,1,0,0|3,0,0]=4 195 B15R2.15 OC[C@@H]1CC[C@@H](Cc2ccccc2)O1 Amb25346402 [0,0,0,1,0,0|3,0,0]=4 196 B15R2.31 BrC1CC(Cc2cccc[n]2)CCC1 Amb24336278 [0,0,0,1,0,0|2,1,0]=4 197 B15R2.31 BrC1CC(Cc2ccccc2)CCC1 Amb25306925 [0,0,0,1,0,0|1,1,0]=3 198 B15R2.31 BrC1CN(Cc2ccccc2)CCC1 Amb22227863 [0,0,0,1,0,0|2,1,0]=4 199 B15R2.31 Br[C@@H]1CN(Cc2ccccc2)CCC1 Amb22225473 [0,0,0,1,0,0|2,1,0]=4 200 B15R2.31 Br[C@H]1CN(Cc2ccccc2)CCC1 Amb22225142 [0,0,0,1,0,0|2,1,0]=4 201 B15R2.31 C=C1CC(Cc2ccccc2)NCC1 Amb18649678 [0,0,0,1,0,0|1,0,1]=3 202 B15R2.31 CC1CC(CNC1)Cc2ccccc2 Amb25198104 [0,0,0,1,0,0|3,0,0]=4 203 B15R2.31 CC1CC(Cc2ccc[n]c2)NCC1 Amb24376932 [0,0,0,1,0,0|2,0,0]=3 204 B15R2.31 CC1CC(Cc2cccc[n]2)NCC1 Amb25732138 [0,0,0,1,0,0|2,0,0]=3 205 B15R2.31 CC1CC(Cc2ccccc2)NCC1 Amb25324346 [0,0,0,1,0,0|1,0,0]=2 206 B15R2.31 CC1CCNC(Cc2ccccc2)=N1 Amb25664123 [0,0,0,1,0,0|2,0,1]=4 207 B15R2.31 CC1CCNC(Cc2ccccc2)S1 Amb24746444 [0,0,0,1,0,0|2,0,0]=3 208 B15R2.31 CC1CCOC(Cc2ccccc2)O1 Amb24081158 [0,0,0,1,0,0|3,0,0]=4 209 B15R2.31 CN1CC(Cc2c[n]ccc2)NCC1 Amb18565009 [0,0,0,1,0,0|3,0,0]=4 210 B15R2.31 CN1CC(Cc2cc[n]cc2)NCC1 Amb18565013 [0,0,0,1,0,0|3,0,0]=4 211 B15R2.31 CN1CC(Cc2cccc[n]2)NCC1 Amb18565005 [0,0,0,1,0,0|3,0,0]=4 212 B15R2.31 CN1CC(Cc2ccccc2)NCC1 Amb18564794 [0,0,0,1,0,0|2,0,0]=3 213 B15R2.31 CN1C[C@@H](Cc2ccccc2)NCC1 Amb25381177 [0,0,0,1,0,0|2,0,0]=3 214 B15R2.31 C[C@@H]1CCC[C@H](Cc2ccccc2)N1 Amb25176190 [0,0,0,1,0,0|3,0,0]=4 215 B15R2.31 C[C@H]1CCC[C@H](Cc2ccccc2)N1 Amb24566229 [0,0,0,1,0,0|3,0,0]=4 216 B15R2.31 ClC1CC(Cc2cc[n]cc2)CCC1 Amb24587994 [0,0,0,1,0,0|2,0,0]=3 217 B15R2.31 ClC1CC(Cc2ccc[n]c2)CCC1 Amb25094074 [0,0,0,1,0,0|2,0,0]=3 218 B15R2.31 ClC1CC(Cc2cccc[n]2)CCC1 Amb24336236 [0,0,0,1,0,0|2,0,0]=3 219 B15R2.31 ClC1CC(Cc2ccccc2)CCC1 Amb25115277 [0,0,0,1,0,0|1,0,0]=2 220 B15R2.31 ClC1CC(Cc2ccccc2)OCC1 Amb24406966 [0,0,0,1,0,0|1,0,0]=2 221 B15R2.31 ClC1CN(Cc2c[n]ccc2)CCC1 Amb25847275 [0,0,0,1,0,0|3,0,0]=4 222 B15R2.31 ClC1CN(Cc2cccc[n]2)CCC1 Amb24749003 [0,0,0,1,0,0|3,0,0]=4 223 B15R2.31 ClC1CN(Cc2ccccc2)CCC1 Amb21860271 [0,0,0,1,0,0|2,0,0]=3 224 B15R2.31 ClC1CN(Cc2ccccc2)CCO1 Amb24061207 [0,0,0,1,0,0|3,0,0]=4 225 B15R2.31 Cl[C@@H]1CN(Cc2ccccc2)CCC1 Amb22225475 [0,0,0,1,0,0|2,0,0]=3 226 B15R2.31 Cl[C@@H]1C[C@H](Cc2ccccc2)OCC1 Amb25237293 [0,0,0,1,0,0|1,0,0]=2 227 B15R2.31 Cl[C@H]1CN(Cc2ccccc2)CCC1 Amb22225144 [0,0,0,1,0,0|2,0,0]=3 228 B15R2.31 FC1CCCN(C1)Cc2ccccc2 Amb13888991 [0,0,0,1,0,0|2,1,0]=4 229 B15R2.31 F[C@H]1CN(Cc2ccccc2)CCC1 Amb25841751 [0,0,0,1,0,0|2,1,0]=4 230 B15R2.31 IC1CN(Cc2ccccc2)CCC1 Amb21860278 [0,0,0,1,0,0|2,1,0]=4 231 B15R2.31 I[C@@H]1CN(Cc2ccccc2)CCC1 Amb22225478 [0,0,0,1,0,0|2,1,0]=4 232 B15R2.31 I[C@H]1CN(Cc2ccccc2)CCC1 Amb22225148 [0,0,0,1,0,0|2,1,0]=4 233 B15R2.31 NC1CC(CCC1)Nc2ccccc2 Amb24443578 [0,0,0,1,0,0|3,0,0]=4 234 B15R2.31 NC1CC(CCC1)Sc2ccccc2 Amb24741516 [0,0,0,1,0,0|3,0,0]=4 235 B15R2.31 NC1CC(Cc2ccccc2)NCC1 Amb25209462 [0,0,0,1,0,0|1,0,0]=2 236 B15R2.31 NC1CN(Cc2ccccc2)CCC1 Amb19375505 [0,0,0,1,0,0|3,0,0]=4 237 B15R2.31 N[C@@H]1CCCN(C1)Cc2ccccc2 Amb10068361 [0,0,0,1,0,0|3,0,0]=4 238 B15R2.31 N[C@@H]1C[C@@H](Cc2ccccc2)NCC1 Amb24663136 [0,0,0,1,0,0|1,0,0]=2 239 B15R2.31 N[C@H]1CN(Cc2ccccc2)CCC1 Amb22504247 [0,0,0,1,0,0|3,0,0]=4 240 B15R2.31 O=C1CC(Cc2ccccc2)CCC1 Amb21959248 [0,0,0,1,0,0|2,0,1]=4 241 B15R2.31 O=C1CC(Cc2ccccc2)NCC1 Amb22235280 [0,0,0,1,0,0|1,0,1]=3 242 B15R2.31 O=C1C[C@@H](Cc2ccccc2)NCC1 Amb25244167 [0,0,0,1,0,0|1,0,1]=3 243 B15R2.31 O=C1C[C@H](Cc2ccccc2)NCC1 Amb24554093 [0,0,0,1,0,0|1,0,1]=3 244 B15R2.31 O=S1CC(Cc2ccccc2)NCC1 Amb25814941 [0,0,0,1,0,0|2,0,0]=3 245 B15R2.31 OC1CC(CCC1)Oc2ccccc2 Amb25664765 [0,0,0,1,0,0|3,0,0]=4 246 B15R2.31 OC1CC(Cc2ccc[n]c2)CCC1 Amb24665259 [0,0,0,1,0,0|3,0,0]=4 247 B15R2.31 OC1CC(Cc2ccccc2)OCC1 Amb25338759 [0,0,0,1,0,0|2,0,0]=3 248 B15R2.31 O[C@@H]1CCCN(C1)Cc2ccccc2 Amb10807696 [0,0,0,1,0,0|3,0,0]=4 249 B15R2.31 O[C@@H]1C[C@@H](Cc2ccccc2)OCC1 Amb25257208 [0,0,0,1,0,0|2,0,0]=3 250 B15R2.31 O[C@H]1C[C@H](Cc2ccccc2)CCC1 Amb24661139 [0,0,0,1,0,0|2,0,0]=3 251 B15R2.50 BrCCC1CN(C1)Cc2ccccc2 Amb22274702 [0,0,0,1,0,0|2,1,0]=4 252 B15R2.50 ClCCC1CN(C1)Cc2ccccc2 Amb22299856 [0,0,0,1,0,0|2,0,0]=3 253 B15R2.50 ICCC1CN(C1)Cc2ccccc2 Amb22296930 [0,0,0,1,0,0|2,1,0]=4 254 B15R2.50 NCCC1CN(C1)Cc2ccccc2 Amb22297156 [0,0,0,1,0,0|3,0,0]=4 255 B15R2.50 OCCC1CN(C1)Cc2ccccc2 Amb22298373 [0,0,0,1,0,0|3,0,0]=4 256 B15R2.50 SCCC1CN(C1)Cc2ccccc2 Amb22298489 [0,0,0,1,0,0|3,0,0]=4 257 B15R2.54 CC1SCCCNC1c2ccccc2 Amb24393060 [0,0,0,1,0,0|2,0,0]=3 258 B15R2.54 NC1CCCCCC1c2ccccc2 Amb19072716 [0,0,0,1,0,0|3,0,0]=4 259 B15R2.54 N[C@H]1CCCCN[C@@H]1c2ccccc2 Amb25218195 [0,0,0,1,0,0|3,0,0]=4 260 B15R2.54 O=C1NCCCCC1c2ccccc2 Amb24056374 [0,0,0,1,0,0|2,0,1]=4 261 B15R2.54 O=C1NCCCNC1c2ccccc2 Amb24498231 [0,0,0,1,0,0|2,0,1]=4 262 B15R2.54 O[C@@H]1CCCCC[C@H]1c2ccccc2 Amb25284409 [0,0,0,1,0,0|3,0,0]=4 263 B15R2.54 O[C@H]1CCCCC[C@H]1c2ccccc2 Amb24519915 [0,0,0,1,0,0|3,0,0]=4 264 B15R2.64 BrC(Cc1ccccc1)C2CCCC2 Amb25303786 [0,0,0,1,0,0|3,0,0]=4 265 B15R2.64 CC(Cc1ccccc1)C=2NCCN2 Amb25348415 [0,0,0,1,0,0|3,0,0]=4 266 B15R2.64 CC(Nc1ccccc1)C2CCCC2 Amb19072722 [0,0,0,1,0,0|3,0,0]=4 267 B15R2.64 C[C@@H](Cc1ccccc1)C=2NCCN2 Amb25814687 [0,0,0,1,0,0|3,0,0]=4 268 B15R2.64 C[C@H](Cc1ccccc1)C=2NCCN2 Amb25713526 [0,0,0,1,0,0|3,0,0]=4 269 B15R2.64 C\C(=C\c1ccccc1)\N2CCCC2 Amb24410545 [0,0,0,1,0,0|1,0,2]=4 270 B15R2.64 ClC(Cc1ccccc1)C2CCCC2 Amb24645875 [0,0,0,1,0,0|3,0,0]=4 271 B15R2.64 N=C(Cc1ccccc1)N2CCCC2 Amb23447112 [0,0,0,1,0,0|2,0,1]=4 272 B15R2.64 NC(C1CCCC1)Cc2ccccc2 Amb17139238 [0,0,0,1,0,0|3,0,0]=4 273 B15R2.64 NC(Cc1ccccc1)C2CCCC2 Amb19373445 [0,0,0,1,0,0|3,0,0]=4 274 B15R2.64 NC(Cc1ccccc1)C2CCCS2 Amb24387176 [0,0,0,1,0,0|3,0,0]=4 275 B15R2.64 NC(Cc1ccccc1)C=2CCCC2 Amb18295069 [0,0,0,1,0,0|3,0,0]=4 276 B15R2.64 O=C(Cc1ccccc1)N2CCCO2 Amb25186097 [0,0,0,1,0,0|2,0,1]=4 277 B15R2.64 OC(C1CCCC1)Cc2ccccc2 Amb17139284 [0,0,0,1,0,0|3,0,0]=4 278 B15R2.64 OC(C1CCCN1)Cc2ccccc2 Amb17235117 [0,0,0,1,0,0|3,0,0]=4 279 B15R2.64 OC(Cc1ccccc1)C=2CCCC2 Amb19077259 [0,0,0,1,0,0|3,0,0]=4 280 B15R2.405 CC1(Cc2ccccc2)CCCC1O Amb24457842 [0,0,0,1,0,0|2,0,0]=3 281 B15R2.405 CC1(Cc2ccccc2)NCCC1F Amb24396128 [0,0,0,1,0,0|0,1,0]=2 282 B15R2.405 CC1CCCC1(N)Cc2ccccc2 Amb24753092 [0,0,0,1,0,0|3,0,0]=4 283 B15R2.405 C[C@@]1(CCC[C@H]1O)Nc2ccccc2 Amb24694052 [0,0,0,1,0,0|3,0,0]=4 284 B15R2.405 O[C@@H]1CCC[C@]1(O)Cc2ccccc2 Amb25357355 [0,0,0,1,0,0|3,0,0]=4 285 B15R2.541 CC1CCCN(C)C1c2ccccc2 Amb25242710 [0,0,0,1,0,0|3,0,0]=4 286 B15R2.541 CN1CCC[C@@H](N)[C@H]1c2ccccc2 Amb24539953 [0,0,0,1,0,0|3,0,0]=4 287 B15R2.541 CN1CCC[C@@H](O)[C@@H]1c2ccccc2 Amb24583758 [0,0,0,1,0,0|3,0,0]=4 288 B15R2.1256 CC(Cc1ccccc1)NCC2CC2 Amb19040801 [0,0,0,1,0,0|1,0,0]=2 289 B15R2.1256 CN(Cc1ccccc1)CCC2CO2 Amb25184018 [0,0,0,1,0,0|3,0,0]=4 290 B15R2.1262 CC#CCNC1CC1c2ccccc2 Amb19069433 [0,0,0,1,0,0|1,0,2]=4 291 B15R2.1435 CC1Cc2ccccc2C1NCCC Amb19072633 [0,0,0,1,0,0|3,0,0]=4 292 B15R2.1435 CC1Cc2ccccc2N1CCC#C Amb25058630 [0,0,0,1,0,0|1,0,1]=3 293 B15R2.1435 CC1Cc2ccccc2N1CCC=O Amb19040708 [0,0,0,1,0,0|1,0,1]=3 294 B15R2.1435 CC1Cc2ccccc2N1CCCBr Amb25739955 [0,0,0,1,0,0|0,1,0]=2 295 B15R2.1435 CC1Cc2ccccc2N1CCON Amb25348266 [0,0,0,1,0,0|2,0,0]=3 296 B15R2.1435 CCCCn1c(C)nc2c1cccc2 Amb10561017 [0,0,0,1,0,0|2,0,1]=4 297 B15R2.1435 CCCCn1c(C)nc2c1cccc2 Amb1663306 [0,0,0,1,0,0|2,0,1]=4 298 B15R2.1435 C[C@@H]1Nc2ccccc2[C@@H]1CCCC Amb25194703 [0,0,0,1,0,0|3,0,0]=4 299 B15R2.1435 Cc1[nH]c2ccccc2c1CCCCl Amb24536582 [0,0,0,1,0,0|2,0,1]=4 300 B15R2.1435 Cc1cc2ccccc2[n]1CCCBr Amb25083686 [0,0,0,1,0,0|0,1,2]=4 301 B15R2.1435 Cc1cc2ccccc2[n]1CCCF Amb25705379 [0,0,0,1,0,0|0,1,2]=4 302 B15R2.1435 ClCCCN1C(C)Cc2c1cccc2 Amb17339429 [0,0,0,1,0,0|0,0,0]=1 303 B15R2.1435 O=C1Nc2ccccc2N1CCCCl Amb19389422 [0,0,0,1,0,0|2,0,1]=4 304 B15R2.1435 O=C1Oc2ccccc2N1CCCCl Amb19514627 [0,0,0,1,0,0|2,0,1]=4 305 B15R2.1435 OC1Cc2ccccc2C1CCCO Amb25846180 [0,0,0,1,0,0|3,0,0]=4 306 B15R2.2167 C(C1CCCCCN1)c2ccccc2 Amb22473463 [0,0,0,1,0,0|1,0,0]=2 307 B15R2.2167 C(C=1NCCCCN1)c2ccccc2 Amb25689607 [0,0,0,1,0,0|2,0,1]=4 308 B15R2.2167 C1CCCC(CN1)Oc2ccccc2 Amb17040624 [0,0,0,1,0,0|3,0,0]=4 309 B15R2.2167 C1CCCC(CN1)Sc2ccccc2 Amb17040638 [0,0,0,1,0,0|3,0,0]=4 310 B15R2.2167 C1CCCCN(C1)Cc2ccccc2 Amb1925686 [0,0,0,1,0,0|3,0,0]=4 311 B15R2.2167 C1CCNC(CC1)Cc2ccccn2 Amb2237254 [0,0,0,1,0,0|2,0,0]=3 312 B15R2.2167 C1CCNC(CN1)Cc2ccccc2 Amb17578545 [0,0,0,1,0,0|1,0,0]=2 313 B15R2.2167 C1NCCCCC1Cc2cccc[n]2 Amb25136144 [0,0,0,1,0,0|3,0,0]=4 314 B15R2.2167 C1NCCCCC1Cc2ccccc2 Amb25167909 [0,0,0,1,0,0|2,0,0]=3 315 B15R2.2167 C1NCCCOC1Cc2ccccc2 Amb25246997 [0,0,0,1,0,0|2,0,0]=3 316 B15R2.2167 C1SCCCNC1Cc2ccccc2 Amb25041594 [0,0,0,1,0,0|1,0,0]=2 317 B15R2.2203 C#CCCNC1Cc2ccccc2C1 Amb24650814 [0,0,0,1,0,0|1,0,1]=3 318 B15R2.2203 CC#CCNC1Cc2ccccc2C1 Amb25287884 [0,0,0,1,0,0|1,0,2]=4 319 B15R2.2203 C\C=C\CNC1Cc2ccccc2C1 Amb24425158 [0,0,0,1,0,0|1,0,2]=4 320 B15R2.2203 NCCCCN1Cc2c(C1)cccc2 Amb17480609 [0,0,0,1,0,0|3,0,0]=4 321 B15R2.2216 CC1CN(CCN)C1c2ccccc2 Amb24423220 [0,0,0,1,0,0|3,0,0]=4 322 B15R2.2216 CCCC1NC(=O)C1c2ccccc2 Amb24647614 [0,0,0,1,0,0|2,0,1]=4 323 B15R2.2216 OC1CC(CCO)[C@H]1c2ccccc2 Amb25813803 [0,0,0,1,0,0|3,0,0]=4 324 B15R2.2280 CC1CNC(CC)C1c2ccccc2 Amb24569085 [0,0,0,1,0,0|3,0,0]=4 325 B15R2.2280 CN1CCC(CN)C1c2ccccc2 Amb19515136 [0,0,0,1,0,0|3,0,0]=4 326 B15R2.2280 CN1CCC(CN)C1c2ccccc2 Amb22713517 [0,0,0,1,0,0|3,0,0]=4 327 B15R2.2280 CN1CCC(CO)C1c2ccccc2 Amb22713502 [0,0,0,1,0,0|3,0,0]=4 328 B15R2.2280 CN1CC[C@H](CN)[C@H]1c2ccccc2 Amb24597691 [0,0,0,1,0,0|3,0,0]=4 329 B15R2.2280 C[C@H]1NC[C@H](CC)[C@@H]1c2ccccc2 Amb25194666 [0,0,0,1,0,0|1,0,0]=2 330 B15R2.4392 CC1CC(CCC)c2ccccc2N1 Amb25124542 [0,0,0,1,0,0|3,0,0]=4 331 B15R2.4392 CC1CC(CCN)c2ccccc2O1 Amb18818229 [0,0,0,1,0,0|3,0,0]=4 332 B15R2.4392 CC1CC(CCO)c2ccccc2C1 Amb24466197 [0,0,0,1,0,0|2,0,0]=3 333 B15R2.4392 CC1Cc2ccccc2C(C1)NCC Amb25255845 [0,0,0,1,0,0|3,0,0]=4 334 B15R2.4392 CC1Cc2ccccc2C(CCN)N1 Amb25664186 [0,0,0,1,0,0|1,0,0]=2 335 B15R2.4392 CC1Cc2ccccc2N(CCN)C1 Amb25678304 [0,0,0,1,0,0|3,0,0]=4 336 B15R2.4392 CC1Cc2ccccc2N(CCS)C1 Amb24673344 [0,0,0,1,0,0|3,0,0]=4 337 B15R2.4392 CCCC1NC(=O)Cc2ccccc21 Amb25752823 [0,0,0,1,0,0|2,0,1]=4 338 B15R2.4815 CC1CCC(CN)c2ccccc2O1 Amb18818228 [0,0,0,1,0,0|3,0,0]=4 339 B15R2.7956 CC1(CNCCN1)Cc2ccccc2 Amb24729596 [0,0,0,1,0,0|2,0,0]=3 340 B15R2.7956 CC1(COCCN1)Cc2ccccc2 Amb24606577 [0,0,0,1,0,0|2,0,0]=3 341 B15R2.7956 CC1(Cc2ccccc2)NCCCN1 Amb25312227 [0,0,0,1,0,0|1,0,0]=2 342 B15R2.7956 C[N+]1(CCCCC1)Cc2ccccc2 Amb15690857 [0,0,0,1,0,0|3,0,0]=4 343 B15R2.16446 CC(CC1CCC1)Nc2ccccc2 Amb25717869 [0,0,0,1,0,0|3,0,0]=4 344 B13R1.24 C=CCCNC(c1ccccc1)C Amb10568493 [0,0,0,0,1,0|1,0,1]=3 345 B13R1.24 CC#CCNC(C)c1ccccc1 Amb18183770 [0,0,0,0,1,0|1,0,2]=4 346 B13R1.24 CC#CCN[C@@H](C)c1ccccc1 Amb25815428 [0,0,0,0,1,0|1,0,2]=4 347 B13R1.24 CC(NCCCO)c1c[n]ccc1 Amb21880109 [0,0,0,0,1,0|2,0,0]=3 348 B13R1.24 CC(NCCCO)c1cccc[n]1 Amb22283685 [0,0,0,0,1,0|2,0,0]=3 349 B13R1.24 CCCCC[C@@H](N)c1ccccc1 Amb22288650 [0,0,0,0,1,0|3,0,0]=4 350 B13R1.24 CCCCNC(=S)c1ccccc1 Amb10561699 [0,0,0,0,1,0|2,0,1]=4 351 B13R1.24 CCCNCC(c1ccccc1)C Amb2119487 [0,0,0,0,1,0|3,0,0]=4 352 B13R1.24 CNCCNC(C)c1ccccc1 Amb18648173 [0,0,0,0,1,0|2,0,0]=3 353 B13R1.24 C\C(=C/CCCN)\c1ccccc1 Amb18065585 [0,0,0,0,1,0|2,0,1]=4 354 B13R1.24 ClCCCNC(=O)c1cccnc1 Amb2125791 [0,0,0,0,1,0|2,0,1]=4 355 B13R1.24 NCCCNC(c1ccccc1)C Amb17315288 [0,0,0,0,1,0|1,0,0]=2 356 B13R1.24 NCCCOC(c1ccccc1)C Amb1217768 [0,0,0,0,1,0|2,0,0]=3 357 B13R1.24 NCCCSC(c1ccccc1)C Amb17500696 [0,0,0,0,1,0|2,0,0]=3 358 B13R1.24 O=C(OCCCCl)c1ccccc1 Amb24099970 [0,0,0,0,1,0|2,0,1]=4 359 B13R1.24 OCCCNC(c1ccccn1)C Amb1071370 [0,0,0,0,1,0|2,0,0]=3 360 B13R1.24 OCCCNC(c1cccnc1)C Amb1070102 [0,0,0,0,1,0|2,0,0]=3 361 B13R1.24 OCCNCC(c1ccccc1)C Amb1851160 [0,0,0,0,1,0|3,0,0]=4 362 B13R1.156 COCCNC(C)Cc1ccc[s]1 Amb18054012 [0,0,0,0,1,0|3,0,0]=4 363 B15R1.78 BrCCCNC(=O)OCc1ccccc1 Amb10608829 [0,0,0,0,0,1|1,1,1]=4 364 B15R1.78 CC(CCCCBr)NCc1ccccc1 Amb25367798 [0,0,0,0,0,1|1,1,0]=3 365 B15R1.78 CC(CCCCN)OCc1ccccc1 Amb25309656 [0,0,0,0,0,1|2,0,0]=3 366 B15R1.78 CC(CCCCO)NCc1ccccc1 Amb24387545 [0,0,0,0,0,1|2,0,0]=3 367 B15R1.78 CC(COCCO)OCc1ccccc1 Amb25682664 [0,0,0,0,0,1|3,0,0]=4 368 B15R1.78 CC(COc1ccccc1)OCCCO Amb22641852 [0,0,0,0,0,1|2,0,0]=3 369 B15R1.78 CC(NCCC#N)CCc1ccccc1 Amb1805915 [0,0,0,0,0,1|1,0,1]=3 370 B15R1.78 CCCCC[C@H](C)NCc1ccccc1 Amb24666751 [0,0,0,0,0,1|2,0,0]=3 371 B15R1.78 CCCCNC(=O)CNc1ccccc1 Amb17140118 [0,0,0,0,0,1|2,0,1]=4 372 B15R1.78 CCCCNC(=O)CSc1ccccc1 Amb1229680 [0,0,0,0,0,1|2,0,1]=4 373 B15R1.78 CCCCNC(=O)NCc1ccccc1 Amb2236966 [0,0,0,0,0,1|2,0,1]=4 374 B15R1.78 CCCNCC(C)NCc1ccccc1 Amb25702141 [0,0,0,0,0,1|3,0,0]=4 375 B15R1.78 CCC\C=C\C(C)NCc1ccccc1 Amb24410074 [0,0,0,0,0,1|2,0,1]=4 376 B15R1.78 COCCCC(C)NCc1ccccc1 Amb24414576 [0,0,0,0,0,1|3,0,0]=4 377 B15R1.78 NCCCNC(=O)CCc1ccccc1 Amb25388444 [0,0,0,0,0,1|2,0,1]=4 378 B15R1.78 NCCCNC(=O)CNc1ccccc1 Amb24770564 [0,0,0,0,0,1|2,0,1]=4 379 B15R1.78 NCCCNC(=O)COc1ccccc1 Amb25388464 [0,0,0,0,0,1|2,0,1]=4 380 B15R1.78 NCCCNC(=O)CSc1ccccc1 Amb24772632 [0,0,0,0,0,1|2,0,1]=4 381 B15R1.78 NCCCNC(=O)NCc1ccccc1 Amb24706325 [0,0,0,0,0,1|2,0,1]=4 382 B15R1.78 NCCCNC(=O)OCc1ccccc1 Amb10844746 [0,0,0,0,0,1|2,0,1]=4 383 B15R1.78 O=C(NCc1ccccc1)OCCCCl Amb24758392 [0,0,0,0,0,1|2,0,1]=4 384 B15R1.78 OCCCNC(=S)CCc1ccccc1 Amb10562569 [0,0,0,0,0,1|2,0,1]=4 385 B15R1.78 [NH3+]CCCNC(=O)OCc1ccccc1 Amb22452694 [0,0,0,0,0,1|2,0,1]=4 386 B12R1.8 BrCCCNCc1ccccc1 Amb18134994 [2,0,0,0,0,0|0,1,0]=3 387 B12R1.8 BrCCNCCc1ccncc1 Amb1030873 [2,0,0,0,0,0|1,1,0]=4 388 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [2,0,0,0,0,0|1,0,1]=4 389 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [2,0,0,0,0,0|0,0,2]=4 390 B12R1.8 CCCCCCc1cc[n]cc1 Amb22235257 [2,0,0,0,0,0|2,0,0]=4 391 B12R1.8 CCCCCCc1cccnc1 Amb10807465 [2,0,0,0,0,0|2,0,0]=4 392 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [2,0,0,0,0,0|2,0,0]=4 393 B12R1.8 CCCCNCc1c[n]ccc1 Amb20673559 [2,0,0,0,0,0|2,0,0]=4 394 B12R1.8 CCCCNCc1cc[n]cc1 Amb20673560 [2,0,0,0,0,0|2,0,0]=4 395 B12R1.8 CCCCNCc1cccc[n]1 Amb20673556 [2,0,0,0,0,0|2,0,0]=4 396 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [2,0,0,0,0,0|0,0,0]=2 397 B12R1.8 CCCN\C=C\c1ccccc1 Amb24565827 [2,0,0,0,0,0|0,0,2]=4 398 B12R1.8 CCCONCc1ccccc1 Amb25031180 [2,0,0,0,0,0|2,0,0]=4 399 B12R1.8 CCCSCCc1ccncc1 Amb1864661 [2,0,0,0,0,0|2,0,0]=4 400 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [2,0,0,0,0,0|1,0,1]=4 401 B12R1.8 CCC\C=N\Cc1ccccc1 Amb10562392 [2,0,0,0,0,0|2,0,0]=4 402 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [2,0,0,0,0,0|2,0,0]=4 403 B12R1.8 CCOCCCc1ccccc1 Amb24063530 [2,0,0,0,0,0|2,0,0]=4 404 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [2,0,0,0,0,0|2,0,0]=4 405 B12R1.8 CSCCNCc1ccccc1 Amb18187025 [2,0,0,0,0,0|2,0,0]=4 406 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [2,0,0,0,0,0|0,0,0]=2 407 B12R1.8 ClCCCNCc1c[n]ccc1 Amb20573314 [2,0,0,0,0,0|1,0,0]=3 408 B12R1.8 ClCCCNCc1cc[n]cc1 Amb20573340 [2,0,0,0,0,0|1,0,0]=3 409 B12R1.8 ClCCCNCc1cc[n]cc1 Amb20623668 [2,0,0,0,0,0|1,0,0]=3 410 B12R1.8 ClCCCNCc1cccc[n]1 Amb20573480 [2,0,0,0,0,0|1,0,0]=3 411 B12R1.8 ClCCCNCc1ccccc1 Amb10766327 [2,0,0,0,0,0|0,0,0]=2 412 B12R1.8 Cl[Zn]CCCCc1ccccc1 Amb22897864 [2,0,0,0,0,0|1,0,0]=3 413 B12R1.8 FCCCSCc1ccccc1 Amb22008717 [2,0,0,0,0,0|1,1,0]=4 414 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [2,0,0,0,0,0|1,0,0]=3 415 B12R1.8 NCCCNCc1ccccc1 Amb17720405 [2,0,0,0,0,0|1,0,0]=3 416 B12R1.8 NCCCNCc1ccccn1 Amb17315287 [2,0,0,0,0,0|2,0,0]=4 417 B12R1.8 NCCCNCc1cccnc1 Amb17315286 [2,0,0,0,0,0|2,0,0]=4 418 B12R1.8 NCCCNCc1ccncc1 Amb17315285 [2,0,0,0,0,0|2,0,0]=4 419 B12R1.8 NCCCOCc1ccccc1 Amb1217769 [2,0,0,0,0,0|2,0,0]=4 420 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [2,0,0,0,0,0|1,0,0]=3 421 B12R1.8 NCCNCCc1ccccc1 Amb22283881 [2,0,0,0,0,0|1,0,0]=3 422 B12R1.8 NCCOCCc1ccccc1 Amb19374389 [2,0,0,0,0,0|2,0,0]=4 423 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [2,0,0,0,0,0|1,0,1]=4 424 B12R1.8 OCCCCCc1cccc[n]1 Amb23441163 [2,0,0,0,0,0|2,0,0]=4 425 B12R1.8 OCCCNCc1cc[n]cc1 Amb22588118 [2,0,0,0,0,0|2,0,0]=4 426 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [2,0,0,0,0,0|1,0,0]=3 427 B12R1.8 OCCCNCc1cccnc1 Amb2114454 [2,0,0,0,0,0|2,0,0]=4 428 B12R1.8 OCCNCCc1cc[n]cc1 Amb22282674 [2,0,0,0,0,0|2,0,0]=4 429 B12R1.8 OCCNCCc1cc[n]cc1 Amb22282814 [2,0,0,0,0,0|2,0,0]=4 430 B12R1.8 OCCNCCc1ccccc1 Amb2119205 [2,0,0,0,0,0|1,0,0]=3 431 B12R1.8 OCCNCCc1ccncc1 Amb1028249 [2,0,0,0,0,0|2,0,0]=4 432 B12R1.8 SCCCNCc1ccccc1 Amb25751336 [2,0,0,0,0,0|1,0,0]=3 433 B12R1.32 BrCCC(Br)Cc1ccccc1 Amb23456171 [2,0,0,0,0,0|1,1,0]=4 434 B12R1.32 CC(CCCl)Nc1cc[n]cc1 Amb24524799 [2,0,0,0,0,0|2,0,0]=4 435 B12R1.32 CC(Cc1ccccc1)NC#N Amb18177707 [2,0,0,0,0,0|1,0,1]=4 436 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [2,0,0,0,0,0|1,0,1]=4 437 B12R1.32 CC(NCC)Cc1cnccn1 Amb1995172 [2,0,0,0,0,0|2,0,0]=4 438 B12R1.32 CCCC(C)Cc1c[n]ccc1 Amb24094032 [2,0,0,0,0,0|1,0,0]=3 439 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [2,0,0,0,0,0|0,0,0]=2 440 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [2,0,0,0,0,0|1,0,0]=3 441 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [2,0,0,0,0,0|1,0,0]=3 442 B12R1.32 CCNC(=S)Cc1ccccc1 Amb24066800 [2,0,0,0,0,0|1,0,1]=4 443 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [2,0,0,0,0,0|0,0,0]=2 444 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [2,0,0,0,0,0|0,0,0]=2 445 B12R1.32 CCNC(Cc1ccccn1)C Amb1995151 [2,0,0,0,0,0|1,0,0]=3 446 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [2,0,0,0,0,0|2,0,0]=4 447 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [2,0,0,0,0,0|1,1,0]=4 448 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [2,0,0,0,0,0|1,0,0]=3 449 B12R1.32 CN(CCF)Cc1ccccc1 Amb25318241 [2,0,0,0,0,0|1,1,0]=4 450 B12R1.32 CN(CCI)Cc1ccccc1 Amb25235494 [2,0,0,0,0,0|1,1,0]=4 451 B12R1.32 CNCC(C)Oc1ccccc1 Amb19025044 [2,0,0,0,0,0|2,0,0]=4 452 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [2,0,0,0,0,0|2,0,0]=4 453 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [2,0,0,0,0,0|2,0,0]=4 454 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [2,0,0,0,0,0|2,0,0]=4 455 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [2,0,0,0,0,0|2,0,0]=4 456 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [2,0,0,0,0,0|2,0,0]=4 457 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [2,0,0,0,0,0|2,0,0]=4 458 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [2,0,0,0,0,0|1,0,1]=4 459 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [2,0,0,0,0,0|2,0,0]=4 460 B12R1.32 ClCCN(Cc1ccccn1)C Amb17335728 [2,0,0,0,0,0|2,0,0]=4 461 B12R1.32 ClCCN(Cc1cccnc1)C Amb17335729 [2,0,0,0,0,0|2,0,0]=4 462 B12R1.32 ClCCN(Cc1ccncc1)C Amb17335730 [2,0,0,0,0,0|2,0,0]=4 463 B12R1.32 NCCC(Cc1ccccc1)C Amb17232439 [2,0,0,0,0,0|1,0,0]=3 464 B12R1.32 NCCC(Cc1ccccc1)O Amb17232552 [2,0,0,0,0,0|2,0,0]=4 465 B12R1.32 NCCC(Oc1ccccc1)C Amb17232556 [2,0,0,0,0,0|2,0,0]=4 466 B12R1.32 OC(CCCl)Nc1ccccc1 Amb24635759 [2,0,0,0,0,0|2,0,0]=4 467 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [2,0,0,0,0,0|1,0,0]=3 468 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [2,0,0,0,0,0|2,0,0]=4 469 B12R1.32 OCCC(Oc1ccccc1)C Amb17232598 [2,0,0,0,0,0|2,0,0]=4 470 B12R1.32 SCCN(Cc1ccccc1)C Amb13881720 [2,0,0,0,0,0|2,0,0]=4 471 B12R1.32 [BH3]N(CCC)Cc1ccccc1 Amb24678772 [2,0,0,0,0,0|2,0,0]=4 472 B14R1.14 CCCCCCCc1ccc(I)cc1 Amb22052731 [1,1,0,0,0,0|2,0,0]=4 473 B14R1.14 CCCCNCCc1ccc(Br)cc1 Amb18053697 [1,1,0,0,0,0|1,0,0]=3 474 B14R1.14 COCCNCCc1ccc(Br)cc1 Amb18053716 [1,1,0,0,0,0|2,0,0]=4 475 B14R1.14 COCCNCCc1ccc(Cl)cc1 Amb20172929 [1,1,0,0,0,0|2,0,0]=4 476 B14R1.14 NCCCNCCc1ccc(cc1)F Amb17315308 [1,1,0,0,0,0|1,0,0]=3 477 B14R1.14 Nc1ccc(CCNCCCO)cc1 Amb18050943 [1,1,0,0,0,0|1,0,0]=3 478 B14R1.14 OCCCNCCc1ccc(cc1)F Amb17317888 [1,1,0,0,0,0|1,0,0]=3 479 B14R1.26 CCCCNCCc1cccc(Br)c1 Amb18053729 [1,1,0,0,0,0|1,0,0]=3 480 B14R1.26 CCCCNCCc1cccc(N)c1 Amb18550381 [1,1,0,0,0,0|1,0,0]=3 481 B14R1.26 COCCNCCc1cccc(Br)c1 Amb18053754 [1,1,0,0,0,0|2,0,0]=4 482 B14R1.26 COCCNCCc1cccc(N)c1 Amb18050453 [1,1,0,0,0,0|2,0,0]=4 483 B14R1.26 Nc1cc(CCNCCCO)ccc1 Amb18550371 [1,1,0,0,0,0|1,0,0]=3 484 B14R1.38 CCCCNCC(c1ccccc1)C Amb2119259 [1,1,0,0,0,0|1,0,0]=3 485 B14R1.38 OC(C#CCCCCl)c1ccccc1 Amb25739034 [1,1,0,0,0,0|1,0,1]=4 486 B14R1.38 O[C@H](C#CCCCCl)c1ccccc1 Amb24426293 [1,1,0,0,0,0|1,0,1]=4 487 B14R1.123 BrCCCCCCOc1ccccc1 Amb24323602 [1,1,0,0,0,0|1,1,0]=4 488 B14R1.123 BrCCCCCNCc1ccccc1 Amb25050489 [1,1,0,0,0,0|1,1,0]=4 489 B14R1.123 BrCCCCCOCc1ccccc1 Amb24089339 [1,1,0,0,0,0|1,1,0]=4 490 B14R1.123 C#CCCCNOCc1ccccc1 Amb25068515 [1,1,0,0,0,0|2,0,0]=4 491 B14R1.123 C=CCCCNOCc1ccccc1 Amb25807008 [1,1,0,0,0,0|2,0,0]=4 492 B14R1.123 CCCCCNCCc1ccccc1 Amb2119505 [1,1,0,0,0,0|1,0,0]=3 493 B14R1.123 CCCCNCC#Cc1ccccc1 Amb1923321 [1,1,0,0,0,0|1,0,1]=4 494 B14R1.123 CCCCNCCCc1ccccc1 Amb10559435 [1,1,0,0,0,0|1,0,0]=3 495 B14R1.123 CCCCNCCNc1ccccc1 Amb19050862 [1,1,0,0,0,0|1,0,0]=3 496 B14R1.123 CCCCNCCOc1ccccc1 Amb17235713 [1,1,0,0,0,0|1,0,0]=3 497 B14R1.123 CCNCCNCCc1ccccc1 Amb20140447 [1,1,0,0,0,0|1,0,0]=3 498 B14R1.123 CCSCCNOCc1ccccc1 Amb25354069 [1,1,0,0,0,0|2,0,0]=4 499 B14R1.123 CNCCCNCCc1ccccc1 Amb2120498 [1,1,0,0,0,0|1,0,0]=3 500 B14R1.123 COCCNCCNc1ccccc1 Amb19062920 [1,1,0,0,0,0|2,0,0]=4 501 B14R1.123 COCCNCCOc1ccccc1 Amb10608623 [1,1,0,0,0,0|2,0,0]=4 502 B14R1.123 COCCNCCOc1ccccc1 Amb1243497 [1,1,0,0,0,0|2,0,0]=4 503 B14R1.123 COCCNCCOc1ccccc1 Amb22587632 [1,1,0,0,0,0|2,0,0]=4 504 B14R1.123 CSCCCNOCc1ccccc1 Amb24675717 [1,1,0,0,0,0|2,0,0]=4 505 B14R1.123 ClCCCCCCCc1ccccc1 Amb10807878 [1,1,0,0,0,0|1,0,0]=3 506 B14R1.123 ClCCCOC\C=C\c1ccccc1 Amb24113677 [1,1,0,0,0,0|1,0,1]=4 507 B14R1.123 ClCCOCCNCc1ccccc1 Amb24521917 [1,1,0,0,0,0|2,0,0]=4 508 B14R1.123 ClCCOCCOCc1ccccc1 Amb2583262 [1,1,0,0,0,0|2,0,0]=4 509 B14R1.123 ClC\C=C\CNOCc1ccccc1 Amb25165446 [1,1,0,0,0,0|1,0,1]=4 510 B14R1.123 ICCCCCOCc1ccccc1 Amb25126877 [1,1,0,0,0,0|1,1,0]=4 511 B14R1.123 N#CCCCNOCc1ccccc1 Amb25037557 [1,1,0,0,0,0|2,0,0]=4 512 B14R1.123 NCCCCCOCc1ccccc1 Amb19051268 [1,1,0,0,0,0|2,0,0]=4 513 B14R1.123 NCCCCNOCc1ccccc1 Amb24707828 [1,1,0,0,0,0|2,0,0]=4 514 B14R1.123 NCCCNCCCc1ccccc1 Amb19050820 [1,1,0,0,0,0|1,0,0]=3 515 B14R1.123 NCCCNCCOc1ccccc1 Amb19080348 [1,1,0,0,0,0|1,0,0]=3 516 B14R1.123 NCCCNC\C=C\c1ccccc1 Amb23595752 [1,1,0,0,0,0|1,0,1]=4 517 B14R1.123 NCCCSCCCc1ccccc1 Amb17500700 [1,1,0,0,0,0|2,0,0]=4 518 B14R1.123 OCCCCCCCc1ccccc1 Amb10807513 [1,1,0,0,0,0|2,0,0]=4 519 B14R1.123 OCCCCCNCc1ccccc1 Amb2172440 [1,1,0,0,0,0|2,0,0]=4 520 B14R1.123 OCCCCNOCc1ccccc1 Amb25037681 [1,1,0,0,0,0|2,0,0]=4 521 B14R1.123 OCCCNC\C=C\c1ccccc1 Amb1926882 [1,1,0,0,0,0|1,0,1]=4 522 B14R1.123 OCCCNC\C=C\c1ccccc1 Amb2114455 [1,1,0,0,0,0|1,0,1]=4 523 B14R1.156 CC(CCCCl)NCc1ccccc1 Amb25795896 [1,1,0,0,0,0|2,0,0]=4 524 B14R1.156 CCCCN(C)CCc1ccccc1 Amb22476539 [1,1,0,0,0,0|1,0,0]=3 525 B14R1.156 ClCCCN(CCc1ccccc1)C Amb17339771 [1,1,0,0,0,0|0,0,0]=2 526 B14R1.156 O=C(CCCCl)OCc1ccccc1 Amb19960308 [1,1,0,0,0,0|2,0,0]=4 527 B14R1.156 OCCCN(CCc1ccccc1)C Amb17336737 [1,1,0,0,0,0|1,0,0]=3 528 B14R1.156 OCCCN(CCc1ccncc1)C Amb17336886 [1,1,0,0,0,0|2,0,0]=4 529 B14R1.422 CC(C)CCOCCc1ccccc1 Amb22732326 [1,1,0,0,0,0|2,0,0]=4 530 B14R1.422 CC(Cl)CCCNCc1ccccc1 Amb24638816 [1,1,0,0,0,0|2,0,0]=4 531 B14R1.422 CC(Cl)CCCOCc1ccccc1 Amb25824299 [1,1,0,0,0,0|2,0,0]=4 532 B14R1.422 CC(O)CCNOCc1ccccc1 Amb25166601 [1,1,0,0,0,0|2,0,0]=4 533 B14R1.422 CN(CCNCCc1ccccc1)C Amb1136705 [1,1,0,0,0,0|2,0,0]=4 534 B14R1.422 NC(=O)CCNCCc1ccccc1 Amb22587630 [1,1,0,0,0,0|1,0,1]=4 535 B14R1.422 OC(=O)CCNCCc1ccccc1 Amb1111405 [1,1,0,0,0,0|1,0,1]=4 536 B14R1.422 OC(=O)CCNCCc1ccccc1 Amb13952728 [1,1,0,0,0,0|1,0,1]=4 537 B14R1.520 CC(CCN)NCCc1ccccc1 Amb20090493 [1,1,0,0,0,0|1,0,0]=3 538 B14R1.520 ClCCC(=O)NCCc1ccccc1 Amb1132002 [1,1,0,0,0,0|0,0,1]=3 539 B14R1.520 ClCCC(=O)NCCc1ccncc1 Amb17329185 [1,1,0,0,0,0|1,0,1]=4 540 B14R1.520 ClCCN(CCCc1ccccc1)C Amb17339772 [1,1,0,0,0,0|2,0,0]=4 541 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb1131212 [1,1,0,0,0,0|1,0,1]=4 542 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb15741009 [1,1,0,0,0,0|1,0,1]=4 543 B14R1.716 CC(CO)CNOCc1ccccc1 Amb24429250 [1,1,0,0,0,0|2,0,0]=4 544 B14R1.716 CCC(C)CNOCc1ccccc1 Amb25114482 [1,1,0,0,0,0|2,0,0]=4 545 B14R1.716 CCC(C)COCCc1ccccc1 Amb24100310 [1,1,0,0,0,0|2,0,0]=4 546 B14R1.716 CCC(O)CNOCc1ccccc1 Amb24715303 [1,1,0,0,0,0|2,0,0]=4 547 B14R1.716 NCC(CNCCc1ccccc1)O Amb10811138 [1,1,0,0,0,0|1,0,0]=3 548 B14R1.716 NCC(O)CNCCc1ccccc1 Amb21953920 [1,1,0,0,0,0|1,0,0]=3 549 B14R1.716 OCC(O)CNOCc1ccccc1 Amb24530388 [1,1,0,0,0,0|2,0,0]=4 550 B14R1.716 OC[C@@H](O)CNOCc1ccccc1 Amb25167876 [1,1,0,0,0,0|2,0,0]=4 551 B14R1.716 O[C@H](CCl)CCOCc1ccccc1 Amb24700356 [1,1,0,0,0,0|2,0,0]=4 552 B14R1.882 Cc1ccccc1CCNCCCC Amb19078681 [1,1,0,0,0,0|1,0,0]=3 553 B14R1.882 Cc1ccccc1CCNCCOC Amb19062020 [1,1,0,0,0,0|2,0,0]=4 554 B14R1.33 CC(CCCO)Nc1ccc(Cl)cc1 Amb21984580 [1,1,0,0,0,0|2,0,0]=4 555 B14R1.33 CC(CCCO)Nc1ccc(F)cc1 Amb21984573 [1,1,0,0,0,0|2,0,0]=4 556 B14R1.33 CC(Cc1ccc(N)cc1)NCC=C Amb18550321 [1,1,0,0,0,0|0,0,2]=4 557 B14R1.33 CC(Cc1ccc(N)cc1)NCCO Amb18550311 [1,1,0,0,0,0|1,0,0]=3 558 B14R1.33 CCCCC(N)Cc1ccc(Br)cc1 Amb18049675 [1,1,0,0,0,0|2,0,0]=4 559 B14R1.33 CCCCN(C)Cc1ccc(Br)cc1 Amb21131737 [1,1,0,0,0,0|2,0,0]=4 560 B14R1.33 CCCCN(Cc1ccc(cc1)C)C Amb1828073 [1,1,0,0,0,0|2,0,0]=4 561 B14R1.33 CCCCN(Cc1ccc(cc1)Cl)C Amb1820923 [1,1,0,0,0,0|2,0,0]=4 562 B14R1.33 CCCCN(Cc1ccc(cc1)O)C Amb10815491 [1,1,0,0,0,0|2,0,0]=4 563 B14R1.33 CCCNC(=O)Cc1ccc(cc1)N Amb1116639 [1,1,0,0,0,0|1,0,1]=4 564 B14R1.33 CCCNC(C)Cc1ccc(N)cc1 Amb18050881 [1,1,0,0,0,0|0,0,0]=2 565 B14R1.33 CN(Cc1ccc(Br)cc1)CCCO Amb19421671 [1,1,0,0,0,0|2,0,0]=4 566 B14R1.33 Cc1ccc(cc1)NC(C)CCCO Amb21984576 [1,1,0,0,0,0|2,0,0]=4 567 B14R1.33 ClCCNC(=O)Cc1ccc(cc1)Cl Amb17103222 [1,1,0,0,0,0|1,0,1]=4 568 B14R1.33 ClCCNC(=O)Cc1ccc(cc1)F Amb17103221 [1,1,0,0,0,0|1,0,1]=4 569 B14R1.33 NCCCN(Cc1ccc(cc1)Cl)C Amb17339916 [1,1,0,0,0,0|2,0,0]=4 570 B14R1.33 OCCCN(Cc1ccc(cc1)Cl)C Amb13971293 [1,1,0,0,0,0|2,0,0]=4 571 B14R1.34 CC(CCCO)Nc1cccc(F)c1 Amb21984574 [1,1,0,0,0,0|2,0,0]=4 572 B14R1.34 CC(Cc1cccc(Cl)c1)NCCN Amb25387187 [1,1,0,0,0,0|1,0,0]=3 573 B14R1.34 CCCCC(N)Cc1cccc(Br)c1 Amb18049696 [1,1,0,0,0,0|2,0,0]=4 574 B14R1.34 CCCNC(=O)Cc1cccc(Cl)c1 Amb23366362 [1,1,0,0,0,0|1,0,1]=4 575 B14R1.34 CCCNC(C)Cc1cc(Br)ccc1 Amb18053864 [1,1,0,0,0,0|0,0,0]=2 576 B14R1.34 Cc1cccc(c1)NC(C)CCCO Amb21984577 [1,1,0,0,0,0|2,0,0]=4 577 B14R1.60 CC(Cc1ccccc1)N(C)CC#C Amb22730039 [1,1,0,0,0,0|0,0,2]=4 578 B14R1.60 CCCN(C)C(=S)Cc1ccccc1 Amb24096713 [1,1,0,0,0,0|1,0,1]=4 579 B14R1.60 CN(Cc1ccccc1)C(N)CCN Amb24348159 [1,1,0,0,0,0|2,0,0]=4 580 B14R1.60 C[C@@H](Cc1ccccc1)N(C)CC#C Amb19131588 [1,1,0,0,0,0|0,0,2]=4 581 B14R1.60 C[C@@H](Cc1ccccc1)N(C)CC#C Amb22337571 [1,1,0,0,0,0|0,0,2]=4 582 B14R1.60 NCCC(N(Cc1ccccc1)C)C Amb17101137 [1,1,0,0,0,0|2,0,0]=4 583 B14R1.166 C#CCNC(C(c1ccccc1)O)C Amb1078314 [1,1,0,0,0,0|0,0,2]=4 584 B14R1.166 CC(NCC#C)C(O)c1ccccc1 Amb22283761 [1,1,0,0,0,0|0,0,2]=4 585 B14R1.166 CC(NCC=C)C(O)c1ccccc1 Amb18092962 [1,1,0,0,0,0|0,0,2]=4 586 B14R1.166 CC(NCCC)C(O)c1ccccc1 Amb18604509 [1,1,0,0,0,0|0,0,0]=2 587 B14R1.166 CCCNC(=O)C(c1ccccc1)O Amb17401749 [1,1,0,0,0,0|1,0,1]=4 588 B14R1.166 CCCNC(C(=O)c1ccccc1)C Amb17619593 [1,1,0,0,0,0|0,0,1]=3 589 B14R1.423 CC(Br)CCN(C)Cc1ccccc1 Amb25726302 [1,1,0,0,0,0|1,1,0]=4 590 B14R1.423 CC(C)NNC(C)Cc1ccccc1 Amb22446427 [1,1,0,0,0,0|1,0,0]=3 591 B14R1.423 CC(Cl)CCN(C)Cc1ccccc1 Amb24499485 [1,1,0,0,0,0|1,0,0]=3 592 B14R1.423 CC(O)CCN(C)Cc1ccccc1 Amb19079596 [1,1,0,0,0,0|2,0,0]=4 593 B14R1.423 CN(Cc1ccccc1)CCC(=O)Cl Amb17143522 [1,1,0,0,0,0|1,0,1]=4 594 B14R1.467 CCN(CCCS)Cc1ccccc1 Amb24402059 [1,1,0,0,0,0|2,0,0]=4 595 B14R1.467 ClCCCN(Cc1ccccc1)CC Amb17339783 [1,1,0,0,0,0|1,0,0]=3 596 B14R1.467 NCCCN(CO)Cc1ccccc1 Amb24739707 [1,1,0,0,0,0|2,0,0]=4 597 B14R1.743 BrCC(=O)NC(Cc1ccccc1)C Amb17333679 [1,1,0,0,0,0|0,1,1]=4 598 B14R1.743 CC(Cc1ccccc1)NC(=O)CN Amb19036468 [1,1,0,0,0,0|1,0,1]=4 599 B14R1.743 CCC(O)CN(C)Cc1ccccc1 Amb19051168 [1,1,0,0,0,0|2,0,0]=4 600 B14R1.743 CC[C@@H](N)CN(C)Cc1ccccc1 Amb24658270 [1,1,0,0,0,0|2,0,0]=4 601 B14R1.743 CC[C@H](N)CN(C)Cc1ccccc1 Amb25195206 [1,1,0,0,0,0|2,0,0]=4 602 B14R1.743 CC[C@H](O)CN(C)Cc1ccccc1 Amb25170581 [1,1,0,0,0,0|2,0,0]=4 603 B14R1.743 CN(CC(O)CF)Cc1ccccc1 Amb24707644 [1,1,0,0,0,0|1,1,0]=4 604 B14R1.743 CN(C[C@@H](O)CCl)Cc1ccccc1 Amb25300392 [1,1,0,0,0,0|1,0,0]=3 605 B14R1.743 CN(C[C@@H](O)CN)Cc1ccccc1 Amb25209920 [1,1,0,0,0,0|2,0,0]=4 606 B14R1.743 CN(C[C@H](O)CCl)Cc1ccccc1 Amb24710415 [1,1,0,0,0,0|1,0,0]=3 607 B14R1.743 CN(C[C@H](O)CN)Cc1ccccc1 Amb24452837 [1,1,0,0,0,0|2,0,0]=4 608 B14R1.743 CNC(=N)NC(C)Cc1ccccc1 Amb19041369 [1,1,0,0,0,0|1,0,1]=4 609 B14R1.743 CNC(=O)NC(C)Cc1ccccc1 Amb25277231 [1,1,0,0,0,0|1,0,1]=4 610 B14R1.743 CNC(=S)NC(C)Cc1ccccc1 Amb25678616 [1,1,0,0,0,0|1,0,1]=4 611 B14R1.946 CC(CCCO)Nc1ccccc1Cl Amb21984581 [1,1,0,0,0,0|2,0,0]=4 612 B14R1.946 CC(CCCO)Nc1ccccc1F Amb21984575 [1,1,0,0,0,0|2,0,0]=4 613 B14R1.946 CCCCN(Cc1ccccc1Cl)C Amb1809816 [1,1,0,0,0,0|2,0,0]=4 614 B14R1.946 CCCCN(Cc1ccccc1F)C Amb1826677 [1,1,0,0,0,0|2,0,0]=4 615 B14R1.946 CCCCN(Cc1ccccc1O)C Amb17511169 [1,1,0,0,0,0|2,0,0]=4 616 B14R1.946 CCCNC(=O)Cc1ccccc1C Amb10671704 [1,1,0,0,0,0|1,0,1]=4 617 B14R1.946 CCCNC(=O)Cc1ccccc1Cl Amb23014121 [1,1,0,0,0,0|1,0,1]=4 618 B14R1.946 CCCNC(=O)Cc1ccccc1F Amb23014333 [1,1,0,0,0,0|1,0,1]=4 619 B14R1.946 CCCNC(=O)Cc1ccccc1N Amb1119442 [1,1,0,0,0,0|1,0,1]=4 620 B14R1.946 CN(Cc1ccccc1Br)CCCO Amb19421645 [1,1,0,0,0,0|2,0,0]=4 621 B14R1.946 Cc1ccccc1NC(C)CCCO Amb21984578 [1,1,0,0,0,0|2,0,0]=4 622 B14R1.946 NCCCN(Cc1ccccc1Cl)C Amb17339915 [1,1,0,0,0,0|2,0,0]=4 623 B14R1.946 OCCCN(Cc1ccccc1Cl)C Amb17340145 [1,1,0,0,0,0|2,0,0]=4 624 B14R1.4528 CC(C)(NCCO)Oc1ccccc1 Amb22231022 [1,1,0,0,0,0|2,0,0]=4 625 B14R1.4528 CCCC[N+](Cc1ccccc1)(C)C Amb10561099 [1,1,0,0,0,0|2,0,0]=4 626 B14R1.19 CCCCOC(C)c1ccc(Br)cc1 Amb23443742 [0,1,0,0,1,0|2,0,0]=4 627 B14R1.20 ClCCCNC(=O)c1cccc(c1)F Amb2124700 [0,1,0,0,1,0|1,0,1]=4 628 B14R1.29 BrCCC(=O)NC(c1ccccc1)C Amb17330864 [0,1,0,0,1,0|0,1,1]=4 629 B14R1.29 CC(NC(C)CCN)c1ccccc1 Amb20090497 [0,1,0,0,1,0|1,0,0]=3 630 B14R1.29 ClCCC(=O)NC(c1ccccc1)C Amb1106284 [0,1,0,0,1,0|0,0,1]=3 631 B14R1.29 OCCC(=O)NC(c1ccccc1)C Amb17336606 [0,1,0,0,1,0|1,0,1]=4 632 B14R1.121 CNCCNC(CC)c1ccccc1 Amb19966343 [0,1,0,0,1,0|2,0,0]=4 633 B14R1.121 ClCCCCN(c1ccccc1)CC Amb17339784 [0,1,0,0,1,0|2,0,0]=4 634 B14R1.163 ClCC(CNC(=O)c1ccccc1)O Amb17595793 [0,1,0,0,1,0|1,0,1]=4 635 B14R1.420 CC(NCCC(N)=O)c1ccccc1 Amb24273095 [0,1,0,0,1,0|1,0,1]=4 636 B14R1.420 CC(c1ccccc1)NCCC(=O)O Amb2372473 [0,1,0,0,1,0|1,0,1]=4 637 B14R1.420 C\C(\Cl)=C/CNC(C)c1ccccc1 Amb21953975 [0,1,0,0,1,0|0,0,2]=4 638 B14R1.1035 CNCCNC(C)c1ccccc1Cl Amb25387732 [0,1,0,0,1,0|2,0,0]=4 639 B14R1.1035 C\C(\NCCCC)=C\1/C=CC=CC1=O Amb25179137 [0,1,0,0,1,0|1,0,1]=4 640 B14R1.1035 C\C(\NCCCO)=C/1\C=CC=CC1=O Amb24451064 [0,1,0,0,1,0|1,0,1]=4 641 B14R1.1035 ClCCCNC(=O)c1ccccc1C Amb1806472 [0,1,0,0,1,0|1,0,1]=4 642 B14R1.107 CC(NCCCC)C(O)c1ccc[s]1 Amb18605685 [0,1,0,0,1,0|2,0,0]=4 643 B14R1.107 CC(NCCCO)C(O)c1ccc[s]1 Amb18606113 [0,1,0,0,1,0|2,0,0]=4 644 B14R1.621 ClCCC(=O)NC(Cn1cccc1)C Amb17327773 [0,1,0,0,1,0|1,0,1]=4 645 B16R1.51 ClCCCNC(=O)COc1ccc(cc1)C Amb2126386 [0,1,0,0,0,1|1,0,1]=4 646 B16R1.688 CC(CCc1ccccc1)NCCCCO Amb25394200 [0,1,0,0,0,1|1,0,0]=3 647 B16R1.688 CCCCCC[C@H](C)NCc1ccccc1 Amb25237609 [0,1,0,0,0,1|2,0,0]=4 648 B16R1.688 CCCCNCC(COc1ccccc1)O Amb1922317 [0,1,0,0,0,1|2,0,0]=4 649 B16R1.688 CCNCCCC(C)OCc1ccccc1 Amb25743120 [0,1,0,0,0,1|2,0,0]=4 650 B16R1.688 COCCNCC(C)NCc1ccccc1 Amb24517999 [0,1,0,0,0,1|2,0,0]=4 651 B16R1.688 OCCCNCC(COc1ccccc1)O Amb1049222 [0,1,0,0,0,1|2,0,0]=4 652 B16R1.1343 OCC(CNC(CCc1ccccc1)C)O Amb20613 [0,1,0,0,0,1|1,0,0]=3 653 B16R1.1516 CC(OCc1ccccc1)C(N)CCCC Amb25130514 [0,1,0,0,0,1|2,0,0]=4 654 B16R1.1516 CCCCC(=O)[C@@H](C)NCc1ccccc1 Amb25288330 [0,1,0,0,0,1|2,0,0]=4 655 B16R1.1516 CCCCC(=O)[C@H](C)NCc1ccccc1 Amb25276276 [0,1,0,0,0,1|2,0,0]=4 656 B16R1.1570 CC(CCc1ccccc1)NC(=O)CCN Amb25392487 [0,1,0,0,0,1|1,0,1]=4 657 B16R1.1570 CCCC(=O)NC(C)CNc1ccccc1 Amb22164527 [0,1,0,0,0,1|1,0,1]=4 658 B16R1.1758 CCCCCC(CC)NCc1ccccc1 Amb18118586 [0,1,0,0,0,1|2,0,0]=4 659 B16R1.1758 CCCCCC(CN)NCc1ccccc1 Amb25347875 [0,1,0,0,0,1|2,0,0]=4 660 B16R1.20527 CCCCCC(C)(C)NCc1ccccc1 Amb25270060 [0,1,0,0,0,1|2,0,0]=4 661 B16R1.54 CC(Cc1ccc(F)cc1)NCCCCO Amb24779102 [0,2,0,0,0,0|1,0,0]=3 662 B16R1.54 CCCCCNC(C)Cc1ccc(N)cc1 Amb18550314 [0,2,0,0,0,0|1,0,0]=3 663 B16R1.54 CCCCNCC(C)Oc1ccc(Cl)cc1 Amb20077845 [0,2,0,0,0,0|2,0,0]=4 664 B16R1.54 CCOCCNC(C)Cc1ccc(F)cc1 Amb24779110 [0,2,0,0,0,0|1,0,0]=3 665 B16R1.54 COCCCNC(C)Cc1ccc(N)cc1 Amb18050877 [0,2,0,0,0,0|1,0,0]=3 666 B16R1.54 COCCCNC(Cc1ccc(cc1)F)C Amb10815261 [0,2,0,0,0,0|1,0,0]=3 667 B16R1.54 CSCCCNC(C)Cc1ccc(F)cc1 Amb24779133 [0,2,0,0,0,0|1,0,0]=3 668 B16R1.54 Cc1ccc(cc1)OC(C)CNCCCC Amb20077835 [0,2,0,0,0,0|2,0,0]=4 669 B16R1.55 Cc1cccc(c1)OC(C)CNCCCC Amb20077836 [0,2,0,0,0,0|2,0,0]=4 670 B16R1.610 CC(C)CCNCC(C)Oc1ccccc1 Amb24777937 [0,2,0,0,0,0|2,0,0]=4 671 B16R1.693 CCCCCCNC(C)Cc1ccccc1 Amb20222575 [0,2,0,0,0,0|1,0,0]=3 672 B16R1.693 CCCCNCCN(C)Cc1ccccc1 Amb20080418 [0,2,0,0,0,0|2,0,0]=4 673 B16R1.693 COCCCNCC(C)Oc1ccccc1 Amb20204874 [0,2,0,0,0,0|2,0,0]=4 674 B16R1.705 CC(NCCCCC)C(O)c1ccccc1 Amb18604517 [0,2,0,0,0,0|1,0,0]=3 675 B16R1.705 CC(NCCCOC)C(O)c1ccccc1 Amb18092958 [0,2,0,0,0,0|1,0,0]=3 676 B16R1.934 CC(CCCl)CCN(C)Cc1ccccc1 Amb25712280 [0,2,0,0,0,0|2,0,0]=4 677 B16R1.934 ClCCC(=O)NCC(Oc1ccccc1)C Amb17324924 [0,2,0,0,0,0|1,0,1]=4 678 B16R1.1407 CCCCNCC(CC)Oc1ccccc1 Amb20077851 [0,2,0,0,0,0|2,0,0]=4 679 B16R1.1407 CCN(CCCCCCl)Cc1ccccc1 Amb24728007 [0,2,0,0,0,0|2,0,0]=4 680 B16R1.1497 CC(Cc1ccccc1)NC(=O)NCCCl Amb22343992 [0,2,0,0,0,0|0,0,1]=3 681 B16R1.1497 ClCCCC(=O)NC(Cc1ccccc1)C Amb17332905 [0,2,0,0,0,0|0,0,0]=2 682 B16R1.1497 ClCCCC(=O)NC(Cc1ccncc1)C Amb17327521 [0,2,0,0,0,0|1,0,0]=3 683 B16R1.4621 CCCCNCC(C)Oc1ccccc1Cl Amb20077852 [0,2,0,0,0,0|2,0,0]=4 684 B16R1.4621 CSCCCNC(C)Cc1ccccc1F Amb25396502 [0,2,0,0,0,0|1,0,0]=3 685 B16R1.4621 Cc1ccccc1OC(C)CNCCCC Amb20077838 [0,2,0,0,0,0|2,0,0]=4 686 B16R1.61 CC(NCCCC)C(O)c1ccc(Cl)cc1 Amb18093544 [0,2,0,0,0,0|1,0,0]=3 687 B16R1.61 CC(NCCCC)C(O)c1ccc(F)cc1 Amb18093631 [0,2,0,0,0,0|1,0,0]=3 688 B16R1.61 CC(NCCCO)C(=O)c1ccc(N)cc1 Amb18051374 [0,2,0,0,0,0|1,0,1]=4 689 B16R1.61 CC(NCCCO)C(O)c1ccc(Cl)cc1 Amb18093538 [0,2,0,0,0,0|1,0,0]=3 690 B16R1.61 CC(NCCCO)C(O)c1ccc(F)cc1 Amb18093625 [0,2,0,0,0,0|1,0,0]=3 691 B16R1.61 CC(NCCOC)C(O)c1ccc(Cl)cc1 Amb18605024 [0,2,0,0,0,0|2,0,0]=4 692 B16R1.61 CC(NCCOC)C(O)c1ccc(F)cc1 Amb18093640 [0,2,0,0,0,0|2,0,0]=4 693 B16R1.61 CCCCNC(C)C(=O)c1ccc(N)cc1 Amb18550821 [0,2,0,0,0,0|1,0,1]=4 694 B16R1.61 Cc1ccc(cc1)C(O)C(C)NCCCC Amb18604620 [0,2,0,0,0,0|1,0,0]=3 695 B16R1.61 Cc1ccc(cc1)C(O)C(C)NCCCO Amb18604618 [0,2,0,0,0,0|1,0,0]=3 696 B16R1.61 Cc1ccc(cc1)C(O)C(C)NCCOC Amb18093160 [0,2,0,0,0,0|2,0,0]=4 697 B16R1.613 CC(C)CCNC(C)C(O)c1ccccc1 Amb18604543 [0,2,0,0,0,0|1,0,0]=3 698 B16R1.613 CC(NCCN(C)C)C(O)c1ccccc1 Amb18092990 [0,2,0,0,0,0|2,0,0]=4 699 B16R1.915 CC(NC(=O)CCN)C(C)c1ccccc1 Amb24903555 [0,2,0,0,0,0|1,0,1]=4 700 B16R1.1244 CC(C(O)c1ccccc1)N(C)CCC#N Amb18133024 [0,2,0,0,0,0|1,0,1]=4 701 B16R1.1244 CC(C(O)c1ccccc1)N(C)CCC#N Amb24122677 [0,2,0,0,0,0|1,0,1]=4 702 B16R1.1420 CCC(NCCCO)C(O)c1ccccc1 Amb18604556 [0,2,0,0,0,0|1,0,0]=3 703 B16R1.1420 CCC(NCCOC)C(O)c1ccccc1 Amb18093014 [0,2,0,0,0,0|2,0,0]=4 704 B16R1.1420 CCCCNC(CC)C(O)c1ccccc1 Amb18604559 [0,2,0,0,0,0|1,0,0]=3 705 B16R1.658 CCCCN(C)C(C)Cc1ccc(N)cc1 Amb18050254 [0,2,0,0,0,0|1,0,0]=3 706 B16R1.658 CN(CCC#N)C(C)Cc1ccc(Cl)cc1 Amb19512414 [0,2,0,0,0,0|1,0,1]=4 707 B16R1.658 ClCCCC(=O)N(Cc1ccc(cc1)Cl)C Amb17330736 [0,2,0,0,0,0|2,0,0]=4 708 B16R1.955 BrCCC(=O)NC(Cc1ccc(cc1)C)C Amb17324576 [0,2,0,0,0,0|0,1,1]=4 709 B16R1.955 CC(Cc1ccc(Br)cc1)NC(C)COC Amb24777668 [0,2,0,0,0,0|2,0,0]=4 710 B16R1.1067 CC(C)CCNC(C)Cc1ccc(N)cc1 Amb18050933 [0,2,0,0,0,0|1,0,0]=3 711 B16R1.1067 CC(Cc1ccc(N)cc1)NCCC(O)=O Amb18050916 [0,2,0,0,0,0|1,0,1]=4 712 B16R1.1067 CN(C)CCNC(C)Cc1ccc(N)cc1 Amb18050923 [0,2,0,0,0,0|2,0,0]=4 713 B16R1.7382 CCc1ccc(CC(C)NCCCC)cc1 Amb18053928 [0,2,0,0,0,0|1,0,0]=3 714 B16R1.7382 CCc1ccc(CC(C)NCCOC)cc1 Amb18053980 [0,2,0,0,0,0|2,0,0]=4 715 B16R1.7393 CCCCNC(C)Cc1cc(C)c(C)cc1 Amb18053927 [0,2,0,0,0,0|1,0,0]=3 716 B16R1.7393 CCCCNC(C)Cc1cc(Cl)c(Cl)cc1 Amb18053938 [0,2,0,0,0,0|1,0,0]=3 717 B16R1.7393 CCCCNC(C)Cc1cc(F)c(F)cc1 Amb18553046 [0,2,0,0,0,0|1,0,0]=3 718 B16R1.7393 COCCNC(C)Cc1cc(Cl)c(Cl)cc1 Amb18054007 [0,2,0,0,0,0|2,0,0]=4 719 B16R1.7393 COCCNC(C)Cc1cc(F)c(F)cc1 Amb18553115 [0,2,0,0,0,0|2,0,0]=4 720 B16R1.7393 Cc1cc(CC(C)NCCCC)ccc1Cl Amb18053934 [0,2,0,0,0,0|1,0,0]=3 721 B16R1.7393 Cc1cc(CC(C)NCCCC)ccc1F Amb18553037 [0,2,0,0,0,0|1,0,0]=3 722 B16R1.7393 Cc1cc(CC(C)NCCOC)ccc1Cl Amb18054005 [0,2,0,0,0,0|2,0,0]=4 723 B16R1.7393 Cc1cc(CC(C)NCCOC)ccc1F Amb18553106 [0,2,0,0,0,0|2,0,0]=4 724 B16R1.7393 Cc1ccc(CC(C)NCCOC)cc1C Amb18553083 [0,2,0,0,0,0|2,0,0]=4 725 B16R1.22955 CCCCNC(C)Cc1ccc(C)cc1C Amb18053932 [0,2,0,0,0,0|1,0,0]=3 726 B16R1.22955 CCCCNC(C)Cc1ccc(Cl)cc1Cl Amb18053929 [0,2,0,0,0,0|1,0,0]=3 727 B16R1.22955 COCCNC(C)Cc1ccc(Cl)cc1Cl Amb18553088 [0,2,0,0,0,0|2,0,0]=4 728 B16R1.22955 Cc1cc(C)c(CC(C)NCCOC)cc1 Amb18054003 [0,2,0,0,0,0|2,0,0]=4 729 B16R1.659 ClCCCC(=O)N(Cc1cccc(c1)Cl)C Amb17332787 [0,2,0,0,0,0|2,0,0]=4 730 B16R1.7379 CCCCNC(C)Cc1cc(F)ccc1F Amb18553045 [0,2,0,0,0,0|1,0,0]=3 731 B16R1.7379 COCCNC(C)Cc1cc(F)ccc1F Amb18054032 [0,2,0,0,0,0|2,0,0]=4 732 B16R1.7389 CCCCNC(C)Cc1cc(ccc1)OC Amb18553026 [0,2,0,0,0,0|1,0,0]=3 733 B16R1.7389 COc1cc(CC(C)NCCOC)ccc1 Amb18553094 [0,2,0,0,0,0|2,0,0]=4 734 B16R1.126 CCC(Cc1ccccc1)N(C)CCCO Amb22109127 [0,2,0,0,0,0|1,0,0]=3 735 B16R1.126 ClCCCC(=O)N(Cc1ccccc1)CC Amb17254999 [0,2,0,0,0,0|2,0,0]=4 736 B16R1.7523 ClCCCC(=O)N(Cc1ccccc1Cl)C Amb17328698 [0,2,0,0,0,0|2,0,0]=4 737 B16R1.7523 ClCCCC(=O)N(Cc1ccccc1F)C Amb17328819 [0,2,0,0,0,0|2,0,0]=4 738 B16R1.936 CCCC(=O)N[C@@H](CO)Cc1ccccc1 Amb18533744 [0,2,0,0,0,0|1,0,1]=4 739 B16R1.936 CCCC(=O)N[C@@H](Cc1ccccc1)CCl Amb17103594 [0,2,0,0,0,0|1,0,1]=4 740 B16R1.4235 BrCCC(=O)NC(Cc1ccccc1C)C Amb17332810 [0,2,0,0,0,0|0,1,1]=4 741 B16R1.4235 CC(Cc1ccccc1F)NC(=O)CCN Amb25569941 [0,2,0,0,0,0|1,0,1]=4 742 B16R1.4235 COCC(NC(Cc1ccccc1F)C)C Amb10815187 [0,2,0,0,0,0|2,0,0]=4 743 B16R1.4235 Cc1ccccc1CC(C)NC(C)COC Amb24777584 [0,2,0,0,0,0|2,0,0]=4 744 B16R1.1438 C=CCC(Cc1ccccc1)NCCC=C Amb10572365 [0,2,0,0,0,0|1,0,1]=4 745 B16R1.1438 OCCN(CCCCCl)Cc1ccccc1 Amb24442384 [0,2,0,0,0,0|2,0,0]=4 746 B16R1.7414 Cc1ccccc1CC(C)NCCN(C)C Amb24272331 [0,2,0,0,0,0|2,0,0]=4 747 B14R2.3 CCCCC1CCc2ccccc21 Amb25228155 [1,0,0,1,0,0|2,0,0]=4 748 B14R2.3 CCCCN1CCc2c[n]ccc12 Amb25796068 [1,0,0,1,0,0|2,0,0]=4 749 B14R2.3 CSCCN1CCc2ccccc12 Amb24476505 [1,0,0,1,0,0|2,0,0]=4 750 B14R2.3 ClCCCC1CCc2ccc[n]c21 Amb25317975 [1,0,0,1,0,0|2,0,0]=4 751 B14R2.3 ClCCCN1CCc2c1cccc2 Amb17337049 [1,0,0,1,0,0|0,0,0]=2 752 B14R2.3 ClCCC[n]1[n]cc2ccccc12 Amb19052139 [1,0,0,1,0,0|1,0,1]=4 753 B14R2.3 ClCCCn1cnc2c1cccc2 Amb1130021 [1,0,0,1,0,0|1,0,1]=4 754 B14R2.3 ClCCCn1nnc2c1cccc2 Amb10567174 [1,0,0,1,0,0|2,0,0]=4 755 B14R2.3 Cl\C=C\CN1CCc2ccccc12 Amb25033089 [1,0,0,1,0,0|0,0,2]=4 756 B14R2.3 FCCCN1CCc2[n]cccc12 Amb25762743 [1,0,0,1,0,0|1,1,0]=4 757 B14R2.3 NCCCN1CCc2c1cccc2 Amb1108321 [1,0,0,1,0,0|1,0,0]=3 758 B14R2.3 NOCCN1CCc2c1cccc2 Amb17104862 [1,0,0,1,0,0|2,0,0]=4 759 B14R2.3 O=CCCN1CCc2ccccc12 Amb18178194 [1,0,0,1,0,0|1,0,1]=4 760 B14R2.3 OCCCC1CCc2ccccc21 Amb24353166 [1,0,0,1,0,0|2,0,0]=4 761 B14R2.3 SCCCN1CCc2ccccc12 Amb24489496 [1,0,0,1,0,0|1,0,0]=3 762 B14R2.3 SCCCN1CSc2ccccc12 Amb24061897 [1,0,0,1,0,0|2,0,0]=4 763 B14R2.3 [C-]#[N+]CCN1CCc2ccccc12 Amb19928690 [1,0,0,1,0,0|2,0,0]=4 764 B14R2.6 C(C1C=CCCN1)c2ccccc2 Amb18127112 [1,0,0,1,0,0|1,0,1]=4 765 B14R2.6 C(C1CCCCN1)c2c[n]ccc2 Amb24085209 [1,0,0,1,0,0|2,0,0]=4 766 B14R2.6 C(C1CCCCN1)c2ccccc2 Amb17659191 [1,0,0,1,0,0|1,0,0]=3 767 B14R2.6 C(C1OCCCO1)c2ccccc2 Amb24081148 [1,0,0,1,0,0|2,0,0]=4 768 B14R2.6 C(C1SCCCS1)c2ccccc2 Amb22484089 [1,0,0,1,0,0|2,0,0]=4 769 B14R2.6 C(C=1NCCCN1)c2ccccc2 Amb25123799 [1,0,0,1,0,0|1,0,1]=4 770 B14R2.6 C([C@@H]1CCCCN1)c2ccccc2 Amb22892828 [1,0,0,1,0,0|1,0,0]=3 771 B14R2.6 C1CCC(NC1)Cc2ccccc2 Amb1087934 [1,0,0,1,0,0|1,0,0]=3 772 B14R2.6 C1CCC(NC1)Cc2ccccc2 Amb2236228 [1,0,0,1,0,0|1,0,0]=3 773 B14R2.6 C1CCC(NC1)Cc2ccccn2 Amb2237229 [1,0,0,1,0,0|2,0,0]=4 774 B14R2.6 C1CCC(NC1)Cc2ccncc2 Amb2235427 [1,0,0,1,0,0|2,0,0]=4 775 B14R2.6 C1CNC(OC1)Cc2ccccc2 Amb17506195 [1,0,0,1,0,0|1,0,0]=3 776 B14R2.6 C1NCCNC1Cc2ccccc2 Amb20240950 [1,0,0,1,0,0|2,0,0]=4 777 B14R2.6 C1NCCN[C@@H]1Cc2ccccc2 Amb19515800 [1,0,0,1,0,0|2,0,0]=4 778 B14R2.6 C1NCCN[C@@H]1Cc2ccccc2 Amb22752072 [1,0,0,1,0,0|2,0,0]=4 779 B14R2.6 C1NCCN[C@@H]1Cc2ccccc2 Amb22752073 [1,0,0,1,0,0|2,0,0]=4 780 B14R2.6 C1OCCN[C@@H]1Cc2ccccc2 Amb20242985 [1,0,0,1,0,0|2,0,0]=4 781 B14R2.6 C1OCCN[C@@H]1Cc2ccccc2 Amb24077524 [1,0,0,1,0,0|2,0,0]=4 782 B14R2.6 C1OCCN[C@H]1Cc2ccccc2 Amb20242986 [1,0,0,1,0,0|2,0,0]=4 783 B14R2.6 C1OCCN[C@H]1Cc2ccccc2 Amb22226651 [1,0,0,1,0,0|2,0,0]=4 784 B14R2.6 C1SCCNC1Cc2ccccc2 Amb18565445 [1,0,0,1,0,0|2,0,0]=4 785 B14R2.6 C1SCCN[C@H]1Cc2ccccc2 Amb24627357 [1,0,0,1,0,0|2,0,0]=4 786 B14R2.6 N1CCNC(C1)Cc2ccccc2 Amb10068437 [1,0,0,1,0,0|2,0,0]=4 787 B14R2.6 N1CCN[C@H](C1)Cc2ccccc2 Amb15690734 [1,0,0,1,0,0|2,0,0]=4 788 B14R2.6 O1CCNC(C1)Cc2ccccc2 Amb10068897 [1,0,0,1,0,0|2,0,0]=4 789 B14R2.14 CCC1CNCC1c2ccccc2 Amb24563782 [1,0,0,1,0,0|1,0,0]=3 790 B14R2.14 COC1CNCC1c2ccccc2 Amb24496970 [1,0,0,1,0,0|2,0,0]=4 791 B14R2.14 CO[C@@H]1CNC[C@H]1c2ccccc2 Amb20241554 [1,0,0,1,0,0|2,0,0]=4 792 B14R2.14 ClCC1CCOC1c2ccccc2 Amb25698101 [1,0,0,1,0,0|2,0,0]=4 793 B14R2.14 N#CC1CNCC1c2ccccc2 Amb23597889 [1,0,0,1,0,0|1,0,1]=4 794 B14R2.14 N#C[C@@H]1CNC[C@H]1c2ccccc2 Amb25175728 [1,0,0,1,0,0|1,0,1]=4 795 B14R2.14 NCC1CNCC1c2ccccc2 Amb18647992 [1,0,0,1,0,0|1,0,0]=3 796 B14R2.14 NCC1CSCC1c2ccccc2 Amb24653906 [1,0,0,1,0,0|2,0,0]=4 797 B14R2.14 NC[C@@H]1CNC[C@H]1c2ccccc2 Amb19516314 [1,0,0,1,0,0|1,0,0]=3 798 B14R2.14 NC[C@@H]1CNC[C@H]1c2ccccc2 Amb24723283 [1,0,0,1,0,0|1,0,0]=3 799 B14R2.14 O=CC1CNCC1c2ccccc2 Amb25339180 [1,0,0,1,0,0|1,0,1]=4 800 B14R2.14 OCC1CCCC1c2ccccc2 Amb24363590 [1,0,0,1,0,0|2,0,0]=4 801 B14R2.14 OC[C@@H]1CCC[C@@H]1c2ccccc2 Amb25215686 [1,0,0,1,0,0|2,0,0]=4 802 B14R2.14 OC[C@@H]1CNC[C@H]1c2ccccc2 Amb22756588 [1,0,0,1,0,0|1,0,0]=3 803 B14R2.24 CN1CCNCC1c2ccccc2 Amb21954179 [1,0,0,1,0,0|2,0,0]=4 804 B14R2.24 CN1CCNCC1c2ccccc2 Amb22499001 [1,0,0,1,0,0|2,0,0]=4 805 B14R2.24 CN1CCNCC1c2ccccc2 Amb22586681 [1,0,0,1,0,0|2,0,0]=4 806 B14R2.24 ClC1CCCCC1c2ccc[n]c2 Amb19064472 [1,0,0,1,0,0|2,0,0]=4 807 B14R2.24 ClC1CCCCC1c2ccccc2 Amb19063298 [1,0,0,1,0,0|1,0,0]=3 808 B14R2.24 ClC1CCCOC1c2ccccc2 Amb24099915 [1,0,0,1,0,0|2,0,0]=4 809 B14R2.24 Cl[C@@H]1CCCC[C@H]1c2ccccc2 Amb25233946 [1,0,0,1,0,0|1,0,0]=3 810 B14R2.24 Cl[C@@H]1CCCO[C@@H]1c2ccccc2 Amb24740815 [1,0,0,1,0,0|2,0,0]=4 811 B14R2.24 Cl[C@H]1CCCO[C@H]1c2ccccc2 Amb25210425 [1,0,0,1,0,0|2,0,0]=4 812 B14R2.24 FC1CCNCC1c2ccccc2 Amb25247423 [1,0,0,1,0,0|0,1,0]=3 813 B14R2.24 NC1CCNCC1c2ccccc2 Amb24398671 [1,0,0,1,0,0|1,0,0]=3 814 B14R2.24 N[C@@H]1CCCC[C@@H]1c2ccccc2 Amb25348535 [1,0,0,1,0,0|2,0,0]=4 815 B14R2.24 N[C@@H]1CCCC[C@H]1c2ccccc2 Amb22757825 [1,0,0,1,0,0|2,0,0]=4 816 B14R2.24 O=C1CCNCC1c2ccccc2 Amb18197173 [1,0,0,1,0,0|1,0,1]=4 817 B14R2.24 O=C1CCNCC1c2ccccc2 Amb22229400 [1,0,0,1,0,0|1,0,1]=4 818 B14R2.24 O=S1CCNCC1c2ccccc2 Amb18864028 [1,0,0,1,0,0|2,0,0]=4 819 B14R2.24 O[C@H]1CCCC[C@@H]1c2ccccc2 Amb20242422 [1,0,0,1,0,0|2,0,0]=4 820 B14R2.24 O[C@H]1CCNC[C@@H]1c2ccccc2 Amb24519302 [1,0,0,1,0,0|1,0,0]=3 821 B14R2.30 BrC1CCCC1Cc2ccccc2 Amb24420076 [1,0,0,1,0,0|1,1,0]=4 822 B14R2.30 C[C@@H]1CCN[C@H]1Cc2ccccc2 Amb18197090 [1,0,0,1,0,0|1,0,0]=3 823 B14R2.30 ClC1CCCC1Cc2cccc[n]2 Amb25035591 [1,0,0,1,0,0|2,0,0]=4 824 B14R2.30 ClC1CCCC1Cc2ccccc2 Amb19080529 [1,0,0,1,0,0|1,0,0]=3 825 B14R2.30 ClC1CCCC1Sc2ccccc2 Amb25725936 [1,0,0,1,0,0|2,0,0]=4 826 B14R2.30 ClC1CCOC1Sc2ccccc2 Amb24676898 [1,0,0,1,0,0|2,0,0]=4 827 B14R2.30 ClC1CSCC1Cc2ccccc2 Amb24688782 [1,0,0,1,0,0|2,0,0]=4 828 B14R2.30 Cl[C@@H]1CCO[C@@H]1Sc2ccccc2 Amb25176393 [1,0,0,1,0,0|2,0,0]=4 829 B14R2.30 Cl[C@@H]1CCO[C@H]1Sc2ccccc2 Amb25176394 [1,0,0,1,0,0|2,0,0]=4 830 B14R2.30 Cl[C@H]1CCO[C@@H]1Sc2ccccc2 Amb25240081 [1,0,0,1,0,0|2,0,0]=4 831 B14R2.30 NC1CCCC1Cc2ccccc2 Amb18284144 [1,0,0,1,0,0|2,0,0]=4 832 B14R2.30 NC1CCNC1Cc2ccccc2 Amb25731805 [1,0,0,1,0,0|1,0,0]=3 833 B14R2.30 NC1CCN[C@@H]1Cc2ccccc2 Amb18196512 [1,0,0,1,0,0|1,0,0]=3 834 B14R2.30 NC1CCN[C@H]1Cc2ccccc2 Amb25081465 [1,0,0,1,0,0|1,0,0]=3 835 B14R2.30 N[C@@H]1CCC[C@@H]1Cc2ccccc2 Amb25259168 [1,0,0,1,0,0|2,0,0]=4 836 B14R2.30 O=C1CCN[C@@H]1Cc2ccccc2 Amb18197192 [1,0,0,1,0,0|1,0,1]=4 837 B14R2.30 O=C1CCN[C@H]1Cc2ccccc2 Amb24489314 [1,0,0,1,0,0|1,0,1]=4 838 B14R2.30 OC1CCCC1Cc2ccccc2 Amb18808902 [1,0,0,1,0,0|2,0,0]=4 839 B14R2.30 OC1CCNC1Cc2ccccc2 Amb25775108 [1,0,0,1,0,0|1,0,0]=3 840 B14R2.30 OC1CCN[C@@H]1Cc2ccccc2 Amb18195900 [1,0,0,1,0,0|1,0,0]=3 841 B14R2.30 OC1CCN[C@H]1Cc2ccccc2 Amb24489269 [1,0,0,1,0,0|1,0,0]=3 842 B14R2.30 O[C@@H]1CCN[C@@H]1Cc2ccccc2 Amb24649744 [1,0,0,1,0,0|1,0,0]=3 843 B14R2.30 O[C@H]1CCC[C@H]1Cc2ccccc2 Amb25236068 [1,0,0,1,0,0|2,0,0]=4 844 B14R2.30 O[C@H]1CCN[C@H]1Cc2cc[n]cc2 Amb24632237 [1,0,0,1,0,0|2,0,0]=4 845 B14R2.31 NC1CCC1CCc2ccccc2 Amb25757178 [1,0,0,1,0,0|2,0,0]=4 846 B14R2.78 ClCC1CCN1Cc2ccccc2 Amb24441450 [1,0,0,1,0,0|2,0,0]=4 847 B14R2.78 ClC[C@H]1CCN1Cc2ccccc2 Amb24476206 [1,0,0,1,0,0|2,0,0]=4 848 B14R2.101 C(CN1CCCC1)c2ccccc2 Amb24064864 [1,0,0,1,0,0|1,0,0]=3 849 B14R2.101 C1CCN(C1)CCc2ccccc2 Amb10555331 [1,0,0,1,0,0|1,0,0]=3 850 B14R2.101 C1CCN(C1)CSc2ccccc2 Amb10553265 [1,0,0,1,0,0|2,0,0]=4 851 B14R2.101 C1CC[C@H](CCc2ccccc2)N1 Amb25105019 [1,0,0,1,0,0|2,0,0]=4 852 B14R2.101 C1CNC(C1)CCc2ccccc2 Amb10609225 [1,0,0,1,0,0|2,0,0]=4 853 B14R2.101 c1ccc(cc1)CCC2=NCCC2 Amb17619263 [1,0,0,1,0,0|2,0,0]=4 854 B14R2.1253 C1CCNC(CC1)c2ccccc2 Amb10609226 [1,0,0,1,0,0|2,0,0]=4 855 B14R2.1253 C1CCNC(CC1)c2ccccc2 Amb2234659 [1,0,0,1,0,0|2,0,0]=4 856 B14R2.1253 C1NCCCCC1c2cc[n]cc2 Amb25331889 [1,0,0,1,0,0|2,0,0]=4 857 B14R2.1253 C1NCCCCC1c2ccccc2 Amb21937009 [1,0,0,1,0,0|1,0,0]=3 858 B14R2.1253 C1NCCCOC1c2ccccc2 Amb20668525 [1,0,0,1,0,0|1,0,0]=3 859 B14R2.1253 C1NCCOCC1c2ccccc2 Amb18065703 [1,0,0,1,0,0|2,0,0]=4 860 B14R2.1253 C1NCCSCC1c2ccccc2 Amb25198560 [1,0,0,1,0,0|2,0,0]=4 861 B14R2.1253 C1SCCCNC1c2ccccc2 Amb25341704 [1,0,0,1,0,0|2,0,0]=4 862 B14R2.2014 BrCC1CCCCc2ccccc21 Amb25099536 [1,0,0,1,0,0|1,1,0]=4 863 B14R2.2014 ClCC1CCCCc2ccccc21 Amb25085388 [1,0,0,1,0,0|1,0,0]=3 864 B14R2.2014 OCC1CCCCc2ccccc21 Amb25777320 [1,0,0,1,0,0|2,0,0]=4 865 B14R2.7150 BrCCC1OCCc2ccccc21 Amb22642238 [1,0,0,1,0,0|1,1,0]=4 866 B14R2.7150 C#CCC1NCCc2ccccc21 Amb25774688 [1,0,0,1,0,0|1,0,1]=4 867 B14R2.7150 C=CCC1NCCc2ccccc21 Amb18127113 [1,0,0,1,0,0|1,0,1]=4 868 B14R2.7150 CCCC1NCCc2ccccc21 Amb18961209 [1,0,0,1,0,0|1,0,0]=3 869 B14R2.7150 CCC[C@H]1NCCc2ccccc21 Amb24443833 [1,0,0,1,0,0|1,0,0]=3 870 B14R2.7150 CNCC1NCCc2ccccc21 Amb18956501 [1,0,0,1,0,0|2,0,0]=4 871 B14R2.7150 ClCCC1CCCc2ccc[n]c21 Amb25334174 [1,0,0,1,0,0|2,0,0]=4 872 B14R2.7150 ClCCN1CCCc2c1cccc2 Amb17337045 [1,0,0,1,0,0|2,0,0]=4 873 B14R2.7150 ClCOC1CCCc2ccccc21 Amb24526935 [1,0,0,1,0,0|2,0,0]=4 874 B14R2.7150 N#CCC1NCCc2c1cccc2 Amb1993743 [1,0,0,1,0,0|1,0,1]=4 875 B14R2.7150 N#CCC1NCCc2c1cccc2 Amb1993774 [1,0,0,1,0,0|1,0,1]=4 876 B14R2.7150 N#CC[C@@H]1NCCc2ccccc21 Amb24712051 [1,0,0,1,0,0|1,0,1]=4 877 B14R2.7150 NCCC1CCCc2c1cccc2 Amb17226685 [1,0,0,1,0,0|2,0,0]=4 878 B14R2.7150 NCCC1NCCc2[n]cccc21 Amb18824948 [1,0,0,1,0,0|2,0,0]=4 879 B14R2.7150 NCCC1OCCc2ccccc21 Amb22642244 [1,0,0,1,0,0|2,0,0]=4 880 B14R2.7150 OCCC1CCCc2c1cccc2 Amb17233225 [1,0,0,1,0,0|2,0,0]=4 881 B14R2.7150 OCCC1NCCc2c1cccc2 Amb17193933 [1,0,0,1,0,0|1,0,0]=3 882 B14R2.7150 OCC[C@@H]1OCCc2ccccc21 Amb22757041 [1,0,0,1,0,0|2,0,0]=4 883 B14R2.24101 CC1CCNCCc2ccccc21 Amb24613291 [1,0,0,1,0,0|1,0,0]=3 884 B14R2.24101 ClC1CCCCCc2ccccc21 Amb25693506 [1,0,0,1,0,0|1,0,0]=3 885 B14R2.24101 O[C@@H]1CCCCCc2ccccc21 Amb25753337 [1,0,0,1,0,0|2,0,0]=4 886 B14R2.19 BrC1CC(CC1)Cc2cc[n]cc2 Amb25080419 [1,0,0,1,0,0|1,1,0]=4 887 B14R2.19 BrC1CC(CC1)Cc2cccc[n]2 Amb25762441 [1,0,0,1,0,0|1,1,0]=4 888 B14R2.19 BrC1CC(CC1)Cc2ccccc2 Amb25345569 [1,0,0,1,0,0|0,1,0]=3 889 B14R2.19 BrC1CN(Cc2ccccc2)CC1 Amb21861133 [1,0,0,1,0,0|1,1,0]=4 890 B14R2.19 Br[C@@H]1CN(Cc2ccccc2)CC1 Amb22225474 [1,0,0,1,0,0|1,1,0]=4 891 B14R2.19 Br[C@H]1CN(Cc2ccccc2)CC1 Amb22225143 [1,0,0,1,0,0|1,1,0]=4 892 B14R2.19 CC1CC(CC1)Nc2ccccc2 Amb25295035 [1,0,0,1,0,0|2,0,0]=4 893 B14R2.19 CC1CCC(Cc2ccccc2)N1 Amb24606534 [1,0,0,1,0,0|2,0,0]=4 894 B14R2.19 CC1CNC(Cc2ccccc2)=N1 Amb25758620 [1,0,0,1,0,0|1,0,1]=4 895 B14R2.19 CC1CNC(O1)Cc2ccccc2 Amb17506178 [1,0,0,1,0,0|1,0,0]=3 896 B14R2.19 CC1COC(Cc2ccccc2)O1 Amb24081159 [1,0,0,1,0,0|2,0,0]=4 897 B14R2.19 CC1COC(N1)Cc2ccccc2 Amb17506177 [1,0,0,1,0,0|2,0,0]=4 898 B14R2.19 CC1CSC(Cc2ccccc2)N1 Amb24666187 [1,0,0,1,0,0|2,0,0]=4 899 B14R2.19 C[C@@H]1CC[C@@H](Cc2ccccc2)N1 Amb24519291 [1,0,0,1,0,0|2,0,0]=4 900 B14R2.19 C[C@@H]1C[C@H](Cc2ccccc2)NC1 Amb18197087 [1,0,0,1,0,0|0,0,0]=2 901 B14R2.19 C[C@H]1CC[C@@H](Cc2ccccc2)N1 Amb24608882 [1,0,0,1,0,0|2,0,0]=4 902 B14R2.19 C[C@H]1CNC(Cc2ccccc2)=N1 Amb25738619 [1,0,0,1,0,0|1,0,1]=4 903 B14R2.19 ClC1CC(CC1)Cc2c[n]ccc2 Amb24546265 [1,0,0,1,0,0|1,0,0]=3 904 B14R2.19 ClC1CCC(Cc2ccccc2)=C1 Amb25365788 [1,0,0,1,0,0|0,0,2]=4 905 B14R2.19 ClC1CN(Cc2cc[n]cc2)CC1 Amb25136514 [1,0,0,1,0,0|2,0,0]=4 906 B14R2.19 ClC1CN(Cc2ccccc2)CC1 Amb21861131 [1,0,0,1,0,0|1,0,0]=3 907 B14R2.19 Cl[C@@H]1CN(Cc2ccccc2)CC1 Amb22225476 [1,0,0,1,0,0|1,0,0]=3 908 B14R2.19 Cl[C@H]1CN(Cc2ccccc2)CC1 Amb22225145 [1,0,0,1,0,0|1,0,0]=3 909 B14R2.19 FC1CN(Cc2ccccc2)CC1 Amb22296908 [1,0,0,1,0,0|1,1,0]=4 910 B14R2.19 F[C@@H]1CN(Cc2ccccc2)CC1 Amb22296665 [1,0,0,1,0,0|1,1,0]=4 911 B14R2.19 F[C@H]1CN(Cc2ccccc2)CC1 Amb22296663 [1,0,0,1,0,0|1,1,0]=4 912 B14R2.19 IC1CN(Cc2ccccc2)CC1 Amb21861136 [1,0,0,1,0,0|1,1,0]=4 913 B14R2.19 I[C@@H]1CN(Cc2ccccc2)CC1 Amb22225479 [1,0,0,1,0,0|1,1,0]=4 914 B14R2.19 I[C@H]1CN(Cc2ccccc2)CC1 Amb22225149 [1,0,0,1,0,0|1,1,0]=4 915 B14R2.19 NC1CC(CC1)Cc2cc[n]cc2 Amb24381129 [1,0,0,1,0,0|2,0,0]=4 916 B14R2.19 NC1CC(CC1)Cc2cccc[n]2 Amb24419541 [1,0,0,1,0,0|2,0,0]=4 917 B14R2.19 NC1CC(CC1)Cc2ccccc2 Amb25337996 [1,0,0,1,0,0|1,0,0]=3 918 B14R2.19 NC1CCN(C1)Cc2ccccc2 Amb1680318 [1,0,0,1,0,0|2,0,0]=4 919 B14R2.19 NC1CN(Cc2ccccc2)CC1 Amb24064582 [1,0,0,1,0,0|2,0,0]=4 920 B14R2.19 N[C@@H]1CCN(Cc2ccccc2)C1 Amb17739648 [1,0,0,1,0,0|2,0,0]=4 921 B14R2.19 N[C@@H]1CN(Cc2ccccc2)CC1 Amb18548682 [1,0,0,1,0,0|2,0,0]=4 922 B14R2.19 N[C@H]1CN(Cc2ccccc2)CC1 Amb20242773 [1,0,0,1,0,0|2,0,0]=4 923 B14R2.19 O=C1CC(Cc2ccccc2)CC1 Amb24455173 [1,0,0,1,0,0|1,0,1]=4 924 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CC1 Amb24723978 [1,0,0,1,0,0|1,0,1]=4 925 B14R2.19 OC1CC(CC1)Cc2c[n]ccc2 Amb25087703 [1,0,0,1,0,0|2,0,0]=4 926 B14R2.19 OC1CC(CC1)Nc2ccccc2 Amb25082538 [1,0,0,1,0,0|2,0,0]=4 927 B14R2.19 OC1CC(CC1)Oc2ccccc2 Amb25759220 [1,0,0,1,0,0|2,0,0]=4 928 B14R2.19 OC1CC(Cc2ccccc2)CO1 Amb22752560 [1,0,0,1,0,0|2,0,0]=4 929 B14R2.19 OC1CC(Cc2ccccc2)NC1 Amb23454017 [1,0,0,1,0,0|1,0,0]=3 930 B14R2.19 OC1CC(Cc2ccccc2)OC1 Amb24495738 [1,0,0,1,0,0|2,0,0]=4 931 B14R2.19 O[C@@H]1CC(CC1)Nc2ccccc2 Amb24490948 [1,0,0,1,0,0|2,0,0]=4 932 B14R2.19 O[C@@H]1C[C@@H](CC1)Cc2ccccc2 Amb25271477 [1,0,0,1,0,0|1,0,0]=3 933 B14R2.19 O[C@@H]1C[C@@H](Cc2ccccc2)NC1 Amb24670445 [1,0,0,1,0,0|1,0,0]=3 934 B14R2.19 O[C@@H]1C[C@H](CC1)Oc2ccccc2 Amb24629199 [1,0,0,1,0,0|2,0,0]=4 935 B14R2.19 O[C@H]1C[C@H](CC1)Oc2ccccc2 Amb24580442 [1,0,0,1,0,0|2,0,0]=4 936 B14R2.19 S[C@@H]1CN(Cc2ccccc2)CC1 Amb24692506 [1,0,0,1,0,0|2,0,0]=4 937 B14R2.67 BrCCCC1Cc2ccccc2O1 Amb25191911 [1,0,0,1,0,0|1,1,0]=4 938 B14R2.67 BrCCCC1Cc2ccccc2S1 Amb25806851 [1,0,0,1,0,0|1,1,0]=4 939 B14R2.67 BrCCCN1Cc2ccccc2C1 Amb24451851 [1,0,0,1,0,0|1,1,0]=4 940 B14R2.67 CCCCC1Cc2ccccc2N1 Amb25221651 [1,0,0,1,0,0|2,0,0]=4 941 B14R2.67 CCCNC1Cc2c(C1)cccc2 Amb2182882 [1,0,0,1,0,0|0,0,0]=2 942 B14R2.67 CNCCC1Cc2ccccc2C1 Amb25097431 [1,0,0,1,0,0|2,0,0]=4 943 B14R2.67 COCSC1Cc2ccccc2C1 Amb24457701 [1,0,0,1,0,0|2,0,0]=4 944 B14R2.67 CSCSC1Cc2ccccc2C1 Amb25298158 [1,0,0,1,0,0|2,0,0]=4 945 B14R2.67 ClCCCC1Cc2ccccc2O1 Amb25363577 [1,0,0,1,0,0|1,0,0]=3 946 B14R2.67 ClCCCC1Cc2ccccc2S1 Amb24489802 [1,0,0,1,0,0|1,0,0]=3 947 B14R2.67 ClCCCN1Cc2ccccc2C1 Amb19081445 [1,0,0,1,0,0|1,0,0]=3 948 B14R2.67 FCCCN1Cc2ccccc2C1 Amb25283905 [1,0,0,1,0,0|1,1,0]=4 949 B14R2.67 FCCNC1Cc2ccccc2C1 Amb24727828 [1,0,0,1,0,0|0,1,0]=3 950 B14R2.67 FCCSC1Cc2ccccc2C1 Amb25279743 [1,0,0,1,0,0|1,1,0]=4 951 B14R2.67 ICCCN1Cc2ccccc2C1 Amb25722730 [1,0,0,1,0,0|1,1,0]=4 952 B14R2.67 NCCCC1Cc2ccccc2N1 Amb24697038 [1,0,0,1,0,0|2,0,0]=4 953 B14R2.67 NCCCC1Cc2ccccc2S1 Amb25732208 [1,0,0,1,0,0|2,0,0]=4 954 B14R2.67 NCCCN1Cc2c(C1)cccc2 Amb1130974 [1,0,0,1,0,0|2,0,0]=4 955 B14R2.67 NCCNC1Cc2ccccc2C1 Amb18289524 [1,0,0,1,0,0|1,0,0]=3 956 B14R2.67 OCCCC1Cc2ccccc2C1 Amb25761184 [1,0,0,1,0,0|1,0,0]=3 957 B14R2.67 OCCCC1Cc2ccccc2S1 Amb24638480 [1,0,0,1,0,0|2,0,0]=4 958 B14R2.67 OCCCN1Cc2c(C1)cccc2 Amb17233289 [1,0,0,1,0,0|2,0,0]=4 959 B14R2.84 CCC1NC(=O)C1c2ccccc2 Amb25348333 [1,0,0,1,0,0|1,0,1]=4 960 B14R2.84 OC1CC(CO)C1c2ccccc2 Amb24403758 [1,0,0,1,0,0|2,0,0]=4 961 B14R2.90 BrCC1CN(C1)Cc2ccccc2 Amb22499973 [1,0,0,1,0,0|1,1,0]=4 962 B14R2.90 ClCC1CN(C1)Cc2ccccc2 Amb24581108 [1,0,0,1,0,0|1,0,0]=3 963 B14R2.90 NCC1CC(Cc2ccccc2)C1 Amb25045598 [1,0,0,1,0,0|1,0,0]=3 964 B14R2.90 NCC1CN(C1)Cc2ccccc2 Amb20240968 [1,0,0,1,0,0|2,0,0]=4 965 B14R2.90 NCC1CN(C1)Cc2ccccc2 Amb22232903 [1,0,0,1,0,0|2,0,0]=4 966 B14R2.90 OCC1CC(Cc2ccccc2)C1 Amb23510263 [1,0,0,1,0,0|1,0,0]=3 967 B14R2.90 OCC1CN(C1)Cc2ccccc2 Amb2444593 [1,0,0,1,0,0|2,0,0]=4 968 B14R2.277 CC1CCC(O)C1c2ccccc2 Amb25069604 [1,0,0,1,0,0|1,0,0]=3 969 B14R2.277 CC1NCC(C)C1c2c[n]ccc2 Amb24548556 [1,0,0,1,0,0|1,0,0]=3 970 B14R2.277 CC1NCC(C)C1c2cc[n]c[n]2 Amb25267220 [1,0,0,1,0,0|2,0,0]=4 971 B14R2.277 CC1NCC(C)C1c2cccc[n]2 Amb25231051 [1,0,0,1,0,0|1,0,0]=3 972 B14R2.277 CC1NCC(C)C1c2ccccc2 Amb25260177 [1,0,0,1,0,0|0,0,0]=2 973 B14R2.277 CN1CCC(N)C1c2ccccc2 Amb18196511 [1,0,0,1,0,0|2,0,0]=4 974 B14R2.277 CN1CCC(O)C1c2ccccc2 Amb18824965 [1,0,0,1,0,0|2,0,0]=4 975 B14R2.277 C[C@@H]1CCC(=O)[C@@H]1c2ccccc2 Amb25205730 [1,0,0,1,0,0|1,0,1]=4 976 B14R2.277 C[C@H]1CCC(=O)[C@H]1c2ccccc2 Amb25373309 [1,0,0,1,0,0|1,0,1]=4 977 B14R2.277 NC1CCC(F)C1c2ccccc2 Amb25086143 [1,0,0,1,0,0|1,1,0]=4 978 B14R2.277 OC1CCC(O)C1c2ccccc2 Amb25180210 [1,0,0,1,0,0|2,0,0]=4 979 B14R2.287 CC1CCC(O)c2ccccc2N1 Amb24382644 [1,0,0,1,0,0|2,0,0]=4 980 B14R2.287 CC1Cc2ccccc2C(=O)CC1 Amb25735145 [1,0,0,1,0,0|1,0,1]=4 981 B14R2.287 CC1Cc2ccccc2C(=O)CN1 Amb24759218 [1,0,0,1,0,0|1,0,1]=4 982 B14R2.287 C[C@@H]1CC[C@H](O)Cc2ccccc21 Amb25369310 [1,0,0,1,0,0|2,0,0]=4 983 B14R2.287 C[C@@H]1Cc2ccccc2[C@@H](C)CN1 Amb24559813 [1,0,0,1,0,0|0,0,0]=2 984 B14R2.287 C[C@H]1Cc2ccccc2[C@H](C)CN1 Amb25276563 [1,0,0,1,0,0|0,0,0]=2 985 B14R2.343 CC1CC1C(Cl)Cc2ccccc2 Amb18317922 [1,0,0,1,0,0|2,0,0]=4 986 B14R2.343 CC1CC1C(N)Cc2ccccc2 Amb18795738 [1,0,0,1,0,0|2,0,0]=4 987 B14R2.343 CC1CC1C(O)Cc2ccccc2 Amb18178311 [1,0,0,1,0,0|2,0,0]=4 988 B14R2.391 NC1Cc2ccccc2CCCC1 Amb25200949 [1,0,0,1,0,0|2,0,0]=4 989 B14R2.391 OC1Cc2ccccc2CCCC1 Amb24718407 [1,0,0,1,0,0|2,0,0]=4 990 B14R2.411 CC1(CNCC1)Cc2ccccc2 Amb18966917 [1,0,0,1,0,0|2,0,0]=4 991 B14R2.411 CC1(Cc2c[n]ccc2)CCCN1 Amb24564933 [1,0,0,1,0,0|1,0,0]=3 992 B14R2.411 CC1(Cc2cc[n]c[n]2)CCCN1 Amb25343289 [1,0,0,1,0,0|2,0,0]=4 993 B14R2.411 CC1(Cc2cc[n]cc2)CCCN1 Amb24489904 [1,0,0,1,0,0|1,0,0]=3 994 B14R2.411 CC1(Cc2ccccc2)CCCN1 Amb24451316 [1,0,0,1,0,0|0,0,0]=2 995 B14R2.411 CC1(Cc2ccccc2)SCCS1 Amb25085320 [1,0,0,1,0,0|2,0,0]=4 996 B14R2.517 CC1Cc2ccccc2C1NCC Amb18956642 [1,0,0,1,0,0|2,0,0]=4 997 B14R2.517 CC1Cc2ccccc2N1CC#C Amb18185694 [1,0,0,1,0,0|0,0,2]=4 998 B14R2.517 CC1Cc2ccccc2N1CC=C Amb25220798 [1,0,0,1,0,0|0,0,2]=4 999 B14R2.517 CC1Cc2ccccc2N1CC=O Amb18185897 [1,0,0,1,0,0|1,0,1]=4 1000 B14R2.517 CC1Cc2ccccc2N1CCBr Amb25154763 [1,0,0,1,0,0|0,1,0]=3 1001 B14R2.517 CC1Cc2ccccc2N1CCF Amb25105656 [1,0,0,1,0,0|0,1,0]=3 1002 B14R2.517 CCCn1c(C)nc2c1cccc2 Amb10561987 [1,0,0,1,0,0|1,0,1]=4 1003 B14R2.517 CCCn1c(C)nc2c1cccc2 Amb2470236 [1,0,0,1,0,0|1,0,1]=4 1004 B14R2.517 CN1Cc2ccccc2C1CCN Amb18196566 [1,0,0,1,0,0|2,0,0]=4 1005 B14R2.517 Cc1cc2ccccc2[n]1CCC Amb20237163 [1,0,0,1,0,0|0,0,2]=4 1006 B14R2.517 ClCCN1C(C)Cc2c1cccc2 Amb17337050 [1,0,0,1,0,0|0,0,0]=2 1007 B14R2.727 CC1(Cc2ccccc2)CCC1=O Amb25053062 [1,0,0,1,0,0|1,0,1]=4 1008 B14R2.727 CC1CCC1(O)Cc2ccccc2 Amb24551125 [1,0,0,1,0,0|2,0,0]=4 1009 B14R2.1039 CC1(CC1CN)Cc2ccccc2 Amb19001802 [1,0,0,1,0,0|1,0,0]=3 1010 B14R2.1039 C[C@]1(Cc2ccccc2)O[C@@H]1CO Amb24515225 [1,0,0,1,0,0|2,0,0]=4 1011 B14R2.1146 CC1CC(CC)c2ccccc2N1 Amb25841821 [1,0,0,1,0,0|2,0,0]=4 1012 B14R2.1146 CC1Cc2[n]cccc2C(CC)N1 Amb24405856 [1,0,0,1,0,0|1,0,0]=3 1013 B14R2.1146 CC1Cc2ccccc2C(C1)NC Amb25130681 [1,0,0,1,0,0|2,0,0]=4 1014 B14R2.1146 CC1Cc2ccccc2C(CC)N1 Amb24725258 [1,0,0,1,0,0|0,0,0]=2 1015 B14R2.1146 CC1Cc2ccccc2C(CCl)=N1 Amb25711572 [1,0,0,1,0,0|0,0,2]=4 1016 B14R2.1146 CCC1NC(=O)Cc2ccccc21 Amb24341183 [1,0,0,1,0,0|1,0,1]=4 1017 B14R2.1146 CCN1CC(C)Cc2ccccc12 Amb25802751 [1,0,0,1,0,0|2,0,0]=4 1018 B14R2.1146 CN1Cc2ccccc2C(CO)C1 Amb25687911 [1,0,0,1,0,0|2,0,0]=4 1019 B14R2.1146 NCC1CN(C)Cc2c1cccc2 Amb17400579 [1,0,0,1,0,0|2,0,0]=4 1020 B14R2.9589 ClC(Cc1ccccc1)C2CCC2 Amb18317923 [1,0,0,1,0,0|2,0,0]=4 1021 B14R2.9589 NC(Cc1ccccc1)C2CCC2 Amb18971973 [1,0,0,1,0,0|2,0,0]=4 1022 B14R2.9589 O=C(Cc1ccccc1)N2CCC2 Amb24370957 [1,0,0,1,0,0|1,0,1]=4 1023 B14R2.9589 OC(Cc1ccccc1)C2CCC2 Amb18178312 [1,0,0,1,0,0|2,0,0]=4 1024 B14R2.9593 CN(C[C@H]1CO1)Cc2ccccc2 Amb24371663 [1,0,0,1,0,0|2,0,0]=4 1025 B14R2.9593 CN(Cc1ccccc1)CC2CC2 Amb17233128 [1,0,0,1,0,0|2,0,0]=4 1026 B14R2.9593 O=C(Cc1ccccc1)NC2CC2 Amb16191813 [1,0,0,1,0,0|1,0,1]=4 1027 B14R2.8 BrCC1CC(CC1)c2ccccc2 Amb25118230 [0,0,0,1,1,0|1,1,0]=4 1028 B14R2.8 BrC[C@H]1C[C@@H](CC1)c2ccccc2 Amb24547756 [0,0,0,1,1,0|1,1,0]=4 1029 B14R2.8 ClCC1CNC(O1)c2ccccc2 Amb22330510 [0,0,0,1,1,0|1,0,0]=3 1030 B14R2.8 ClCC1CSC(O1)c2ccccc2 Amb24490100 [0,0,0,1,1,0|2,0,0]=4 1031 B14R2.8 ClCC1CSC(S1)c2ccccc2 Amb24529522 [0,0,0,1,1,0|2,0,0]=4 1032 B14R2.8 ClC[C@@H]1CO[C@H](O1)c2ccccc2 Amb24753016 [0,0,0,1,1,0|2,0,0]=4 1033 B14R2.8 ClC[C@H]1CO[C@@H](O1)c2ccccc2 Amb24651092 [0,0,0,1,1,0|2,0,0]=4 1034 B14R2.8 ClC[C@H]1CO[C@H](O1)c2ccccc2 Amb24753017 [0,0,0,1,1,0|2,0,0]=4 1035 B14R2.8 N#CC1CNC(C1)c2ccccc2 Amb25178937 [0,0,0,1,1,0|1,0,1]=4 1036 B14R2.8 NCC1CC(CC1)c2ccccc2 Amb18065570 [0,0,0,1,1,0|2,0,0]=4 1037 B14R2.8 NCC1CC(OC1)c2ccccc2 Amb24652934 [0,0,0,1,1,0|2,0,0]=4 1038 B14R2.8 OCC1CC(NC1)c2ccccc2 Amb23590810 [0,0,0,1,1,0|1,0,0]=3 1039 B14R2.8 OCC1CNC(O1)c2ccccc2 Amb24520698 [0,0,0,1,1,0|2,0,0]=4 1040 B14R2.21 Br[C@@H]1C[C@H](OCC1)c2ccccc2 Amb22898808 [0,0,0,1,1,0|1,1,0]=4 1041 B14R2.21 CC1CC(NCC1)c2ccccc2 Amb24066154 [0,0,0,1,1,0|1,0,0]=3 1042 B14R2.21 CN1CC(NCC1)c2ccccc2 Amb24064755 [0,0,0,1,1,0|2,0,0]=4 1043 B14R2.21 CN1CCNC(C1)c2ccccc2 Amb1672626 [0,0,0,1,1,0|2,0,0]=4 1044 B14R2.21 CN1C[C@@H](NCC1)c2ccccc2 Amb22032546 [0,0,0,1,1,0|2,0,0]=4 1045 B14R2.21 C[C@H]1C[C@H](NCC1)c2ccccc2 Amb24436064 [0,0,0,1,1,0|1,0,0]=3 1046 B14R2.21 ClC1CC(NCC1)c2ccccc2 Amb24652601 [0,0,0,1,1,0|0,0,0]=2 1047 B14R2.21 ClC1CC(OCC1)c2cc[n]cc2 Amb24428269 [0,0,0,1,1,0|2,0,0]=4 1048 B14R2.21 ClC1CC(OCC1)c2cccc[n]2 Amb24442733 [0,0,0,1,1,0|2,0,0]=4 1049 B14R2.21 ClC1CC(OCC1)c2ccccc2 Amb25310870 [0,0,0,1,1,0|1,0,0]=3 1050 B14R2.21 NC1CC(CCC1)c2ccccc2 Amb18564035 [0,0,0,1,1,0|2,0,0]=4 1051 B14R2.21 NC1CC(CCC1)c2ccccc2 Amb24183813 [0,0,0,1,1,0|2,0,0]=4 1052 B14R2.21 NC1CC(NCC1)c2cc[n]cc2 Amb25282887 [0,0,0,1,1,0|2,0,0]=4 1053 B14R2.21 NC1CC(NCC1)c2ccccc2 Amb25160938 [0,0,0,1,1,0|1,0,0]=3 1054 B14R2.21 NC1C[C@H](CCC1)c2ccccc2 Amb25670231 [0,0,0,1,1,0|2,0,0]=4 1055 B14R2.21 N[C@@H]1C[C@@H](OCC1)c2ccccc2 Amb22747497 [0,0,0,1,1,0|2,0,0]=4 1056 B14R2.21 N[C@@H]1C[C@H](OCC1)c2ccccc2 Amb22746393 [0,0,0,1,1,0|2,0,0]=4 1057 B14R2.21 N[C@@H]1C[C@H](OCC1)c2ccccc2 Amb22747492 [0,0,0,1,1,0|2,0,0]=4 1058 B14R2.21 N[C@H]1C[C@H](CCC1)c2ccccc2 Amb24655984 [0,0,0,1,1,0|2,0,0]=4 1059 B14R2.21 O=C1CC(NCC1)c2ccccc2 Amb22274020 [0,0,0,1,1,0|1,0,1]=4 1060 B14R2.21 O=C1CCNC(C1)c2ccccc2 Amb17233086 [0,0,0,1,1,0|1,0,1]=4 1061 B14R2.21 O=S1CC(NCC1)c2ccccc2 Amb19374300 [0,0,0,1,1,0|2,0,0]=4 1062 B14R2.21 OC1CC(NCC1)c2ccccc2 Amb22035160 [0,0,0,1,1,0|1,0,0]=3 1063 B14R2.21 OC1CC(NOC1)c2ccccc2 Amb25056914 [0,0,0,1,1,0|2,0,0]=4 1064 B14R2.21 OC1CC(OCC1)c2ccccc2 Amb21962863 [0,0,0,1,1,0|2,0,0]=4 1065 B14R2.21 OC1CC(SCC1)c2ccccc2 Amb25152897 [0,0,0,1,1,0|2,0,0]=4 1066 B14R2.21 OC1CCNC(C1)c2ccccc2 Amb17233271 [0,0,0,1,1,0|1,0,0]=3 1067 B14R2.21 OC1CCNC(C1)c2cccnc2 Amb17233437 [0,0,0,1,1,0|2,0,0]=4 1068 B14R2.21 O[C@@H]1C[C@@H](CCC1)c2ccccc2 Amb25316009 [0,0,0,1,1,0|2,0,0]=4 1069 B14R2.21 O[C@@H]1C[C@@H](NOC1)c2ccccc2 Amb25176811 [0,0,0,1,1,0|2,0,0]=4 1070 B14R2.21 O[C@@H]1C[C@@H](OCC1)c2ccccc2 Amb22746392 [0,0,0,1,1,0|2,0,0]=4 1071 B14R2.21 O[C@@H]1C[C@@H](SCC1)c2ccccc2 Amb25346203 [0,0,0,1,1,0|2,0,0]=4 1072 B14R2.21 O[C@@H]1C[C@H](CCC1)c2ccccc2 Amb25256667 [0,0,0,1,1,0|2,0,0]=4 1073 B14R2.21 O[C@@H]1C[C@H](NCC1)c2ccccc2 Amb24564463 [0,0,0,1,1,0|1,0,0]=3 1074 B14R2.21 O[C@@H]1C[C@H](OCC1)c2ccccc2 Amb22746390 [0,0,0,1,1,0|2,0,0]=4 1075 B14R2.21 O[C@@H]1C[C@H](SCC1)c2ccccc2 Amb25236090 [0,0,0,1,1,0|2,0,0]=4 1076 B14R2.21 O[C@H]1C[C@@H](NCC1)c2ccccc2 Amb25351515 [0,0,0,1,1,0|1,0,0]=3 1077 B14R2.21 O[C@H]1C[C@@H](NOC1)c2ccccc2 Amb25176815 [0,0,0,1,1,0|2,0,0]=4 1078 B14R2.21 O[C@H]1C[C@@H](OCC1)c2ccccc2 Amb24722718 [0,0,0,1,1,0|2,0,0]=4 1079 B14R2.21 O[C@H]1C[C@H](NCC1)c2ccccc2 Amb25253500 [0,0,0,1,1,0|1,0,0]=3 1080 B14R2.21 O[C@H]1C[C@H](OCC1)c2ccccc2 Amb25685558 [0,0,0,1,1,0|2,0,0]=4 1081 B14R2.114 CC(C1CCCN1)c2ccccc2 Amb23536676 [0,0,0,1,1,0|2,0,0]=4 1082 B14R2.114 CC(c1c[n]ccc1)N2CCCC2 Amb24732696 [0,0,0,1,1,0|2,0,0]=4 1083 B14R2.114 CC(c1cc[n]cc1)N2CCCC2 Amb25130198 [0,0,0,1,1,0|2,0,0]=4 1084 B14R2.114 CC(c1cccc[n]1)N2CCCC2 Amb25167532 [0,0,0,1,1,0|2,0,0]=4 1085 B14R2.114 CC(c1ccccc1)N2CCCC2 Amb25362841 [0,0,0,1,1,0|1,0,0]=3 1086 B14R2.114 OC(c1ccccc1)N2CCCC2 Amb25680669 [0,0,0,1,1,0|2,0,0]=4 1087 B14R2.317 CC1(CCCC1O)c2ccccc2 Amb25333580 [0,0,0,1,1,0|2,0,0]=4 1088 B14R2.317 CC1(NCCC1F)c2ccccc2 Amb24450258 [0,0,0,1,1,0|0,1,0]=3 1089 B14R2.317 CC1(NCCC1O)c2ccccc2 Amb24472549 [0,0,0,1,1,0|1,0,0]=3 1090 B14R2.317 CC1(OCCC1Cl)c2ccccc2 Amb24711242 [0,0,0,1,1,0|1,0,0]=3 1091 B14R2.317 CC1CCCC1(C)c2ccccc2 Amb24694087 [0,0,0,1,1,0|2,0,0]=4 1092 B14R2.317 C[C@H]1CCC[C@@]1(C)c2ccccc2 Amb24589220 [0,0,0,1,1,0|2,0,0]=4 1093 B14R2.317 C[C@]1(OCC[C@@H]1Cl)c2ccccc2 Amb25258381 [0,0,0,1,1,0|1,0,0]=3 1094 B14R2.352 CC(NC1CC1C)c2c[n]ccc2 Amb18184109 [0,0,0,1,1,0|2,0,0]=4 1095 B14R2.352 CC(NC1CC1C)c2cc[n]cc2 Amb18184108 [0,0,0,1,1,0|2,0,0]=4 1096 B14R2.352 CC(NC1CC1C)c2cccc[n]2 Amb18184107 [0,0,0,1,1,0|2,0,0]=4 1097 B14R2.352 CC(NC1CC1C)c2ccccc2 Amb18183998 [0,0,0,1,1,0|1,0,0]=3 1098 B14R2.352 CC(NC1CC1F)c2ccccc2 Amb24653708 [0,0,0,1,1,0|0,1,0]=3 1099 B14R2.510 CC1CN(CCCl)c2ccccc21 Amb25367781 [0,0,0,1,1,0|2,0,0]=4 1100 B14R2.510 NCCC1CC(c2c1cccc2)C Amb17233152 [0,0,0,1,1,0|2,0,0]=4 1101 B14R2.510 OCCC1CC(c2c1cccc2)C Amb17233226 [0,0,0,1,1,0|2,0,0]=4 1102 B14R2.792 CC(c1ccccc1)NCC2CC2 Amb1790736 [0,0,0,1,1,0|1,0,0]=3 1103 B14R2.794 CC(CC1CCN1)c2ccccc2 Amb25356580 [0,0,0,1,1,0|2,0,0]=4 1104 B14R2.794 CC(NC1CCC1)c2c[n]ccc2 Amb18296796 [0,0,0,1,1,0|2,0,0]=4 1105 B14R2.794 CC(NC1CCC1)c2cc[n]cc2 Amb18296794 [0,0,0,1,1,0|2,0,0]=4 1106 B14R2.794 CC(NC1CCC1)c2cccc[n]2 Amb18989349 [0,0,0,1,1,0|2,0,0]=4 1107 B14R2.794 CC(NC1CCC1)c2ccccc2 Amb18296782 [0,0,0,1,1,0|1,0,0]=3 1108 B14R2.794 C[C@@H](NC1CCC1)c2cc[n]cc2 Amb24709643 [0,0,0,1,1,0|2,0,0]=4 1109 B14R2.794 C[C@@H](NC1CSC1)c2ccccc2 Amb24582298 [0,0,0,1,1,0|2,0,0]=4 1110 B14R2.794 C[C@H](NC1CCC1)c2cccc[n]2 Amb24434250 [0,0,0,1,1,0|2,0,0]=4 1111 B14R2.1131 CC1NCC(CC)c2ccccc21 Amb24417145 [0,0,0,1,1,0|1,0,0]=3 1112 B14R2.1131 C[C@H]1CC[C@@H](CO)c2ccccc21 Amb24735124 [0,0,0,1,1,0|2,0,0]=4 1113 B14R2.1161 C[C@@H]([C@@H]1C[C@@H]1CO)c2ccccc2 Amb25261809 [0,0,0,1,1,0|2,0,0]=4 1114 B14R2.1161 C[C@@H]([C@@H]1C[C@H]1CO)c2ccccc2 Amb24719611 [0,0,0,1,1,0|2,0,0]=4 1115 B14R2.1161 C[C@@H](c1ccccc1)N2C[C@@H]2CO Amb24288694 [0,0,0,1,1,0|1,0,0]=3 1116 B14R2.1161 C[C@@H](c1ccccc1)N2C[C@H]2CO Amb24273601 [0,0,0,1,1,0|1,0,0]=3 1117 B14R2.4510 CC1CCCC(O)c2ccccc21 Amb25346078 [0,0,0,1,1,0|2,0,0]=4 1118 B14R2.4510 CC1NCCN(C)c2ccccc21 Amb25787158 [0,0,0,1,1,0|2,0,0]=4 1119 B14R2.4510 CC1SCCC(O)c2ccccc21 Amb25846317 [0,0,0,1,1,0|2,0,0]=4 1120 B14R2.5540 CC1(CCCCN1)c2cc[n]cc2 Amb25722046 [0,0,0,1,1,0|2,0,0]=4 1121 B14R2.5540 CC1(CCCCN1)c2cccc[n]2 Amb25157009 [0,0,0,1,1,0|2,0,0]=4 1122 B14R2.5540 CC1(CCCCN1)c2ccccc2 Amb18063210 [0,0,0,1,1,0|1,0,0]=3 1123 B14R2.5540 CC1(CNCCN1)c2ccccc2 Amb24065744 [0,0,0,1,1,0|2,0,0]=4 1124 B14R2.5540 CC1(OCCCO1)c2ccccc2 Amb1806265 [0,0,0,1,1,0|2,0,0]=4 1125 B14R2.5540 CC1(SCCCS1)c2ccccc2 Amb25229277 [0,0,0,1,1,0|2,0,0]=4 1126 B14R2.5540 C[C@]1(CCCCN1)c2ccccc2 Amb24440188 [0,0,0,1,1,0|1,0,0]=3 1127 B14R2.48 CC1NCCCOC1c2ccc[s]2 Amb18278902 [0,0,0,1,1,0|2,0,0]=4 1128 B14R2.48 CC1NCCCOC1c2ccco2 Amb18280266 [0,0,0,1,1,0|2,0,0]=4 1129 B14R2.716 CC1CC(Cc2cc[s]c2)NCC1 Amb25328635 [0,0,0,1,1,0|2,0,0]=4 1130 B14R2.716 ClC1CC(Cc2cc[s]c2)CCC1 Amb25066674 [0,0,0,1,1,0|2,0,0]=4 1131 B14R2.793 CC(Cc1c[s]cc1)N2CCCC2 Amb24404267 [0,0,0,1,1,0|2,0,0]=4 1132 B14R2.2840 C(C1CCCCCN1)c2ccc[s]2 Amb19374423 [0,0,0,1,1,0|2,0,0]=4 1133 B14R2.3104 CC1Cc2[nH]ccc2C(CCC)N1 Amb23019278 [0,0,0,1,1,0|2,0,0]=4 1134 B14R2.5543 CC1(C[n]2cccc2)CCCCN1 Amb25830841 [0,0,0,1,1,0|2,0,0]=4 1135 B16R2.252 CN1CC(CCc2ccccc2)NCC1 Amb18865095 [0,0,0,1,0,1|2,0,0]=4 1136 B16R2.252 C[C@@H]1C[C@H](CCC1)NCc2ccccc2 Amb25290216 [0,0,0,1,0,1|2,0,0]=4 1137 B16R2.252 C[C@H]1C[C@H](CCC1)NCc2ccccc2 Amb25324597 [0,0,0,1,0,1|2,0,0]=4 1138 B16R2.252 ClC1CC(CCC1)CCc2ccccc2 Amb24665509 [0,0,0,1,0,1|1,0,0]=3 1139 B16R2.252 ClC1CC(CCC1)CNc2cccc[n]2 Amb24416832 [0,0,0,1,0,1|2,0,0]=4 1140 B16R2.252 NC1CC(CCC1)OCc2ccccc2 Amb18655134 [0,0,0,1,0,1|2,0,0]=4 1141 B16R2.252 N[C@H]1C[C@H](CCC1)NCc2ccccc2 Amb25803684 [0,0,0,1,0,1|2,0,0]=4 1142 B16R2.252 O=C1CC(CCc2ccccc2)NCC1 Amb18785348 [0,0,0,1,0,1|1,0,1]=4 1143 B16R2.252 OC1CC(CCC1)OCc2ccccc2 Amb25030389 [0,0,0,1,0,1|2,0,0]=4 1144 B16R2.252 O[C@@H]1C[C@@H](CCC1)NCc2ccccc2 Amb24631112 [0,0,0,1,0,1|2,0,0]=4 1145 B16R2.252 O[C@@H]1C[C@H](CCC1)NCc2ccccc2 Amb24548267 [0,0,0,1,0,1|2,0,0]=4 1146 B16R2.252 O[C@H]1C[C@@H](CCC1)NCc2ccccc2 Amb25168968 [0,0,0,1,0,1|2,0,0]=4 1147 B16R2.252 O[C@H]1C[C@H](CCC1)NCc2ccccc2 Amb25168943 [0,0,0,1,0,1|2,0,0]=4 1148 B16R2.2238 CC(NCc1ccccc1)C2CCCN2 Amb25194492 [0,0,0,1,0,1|2,0,0]=4 1149 B16R2.2319 CCCCC1CC1NCc2ccccc2 Amb25835137 [0,0,0,1,0,1|2,0,0]=4 1150 B16R2.2334 CCC1CC(CC1)NCc2ccccc2 Amb25072890 [0,0,0,1,0,1|2,0,0]=4 1151 B16R2.2441 ClCCCCN1CCc2c(C1)cccc2 Amb17342937 [0,0,0,1,0,1|2,0,0]=4 1152 B16R2.2446 CC1CCC(CN)N1Cc2ccccc2 Amb18654794 [0,0,0,1,0,1|2,0,0]=4 1153 B16R2.3193 CC1CC1NC(C)CCc2ccccc2 Amb24772875 [0,0,0,1,0,1|1,0,0]=3 1154 B16R2.3627 BrCCC1CC(C1)OCc2ccccc2 Amb25823178 [0,0,0,1,0,1|1,1,0]=4 1155 B16R2.3627 BrCC[C@@H]1C[C@H](C1)OCc2ccccc2 Amb24575648 [0,0,0,1,0,1|1,1,0]=4 1156 B16R2.3627 NCC[C@@H]1C[C@@H](C1)OCc2ccccc2 Amb24698744 [0,0,0,1,0,1|2,0,0]=4 1157 B16R2.5334 C1CCCCC(C=Cc2ccccc2)N1 Amb20667768 [0,0,0,1,0,1|1,0,1]=4 1158 B16R2.30013 CC1CCc2ccccc2N1CCC=O Amb25222521 [0,0,0,1,0,1|1,0,1]=4 1159 B16R2.30013 CC1CCc2ccccc2N1CCCBr Amb25822553 [0,0,0,1,0,1|0,1,0]=3 1160 B16R2.30013 CC1COc2ccccc2N1CCCN Amb18061716 [0,0,0,1,0,1|1,0,0]=3 1161 B16R2.30013 CC1COc2ccccc2N1CCCO Amb22160891 [0,0,0,1,0,1|1,0,0]=3 1162 B16R2.30013 ClCCCN1C(=O)CCc2c1cccc2 Amb1125499 [0,0,0,1,0,1|1,0,1]=4 1163 B16R2.44148 CC(CCc1ccccc1)NC2CCC2 Amb24771872 [0,0,0,1,0,1|1,0,0]=3 1164 B16R2.44153 CC(CCC1CC1)NCc2ccccc2 Amb25333313 [0,0,0,1,0,1|2,0,0]=4 1165 B16R2.23 ClCC1CCCN(C1)Cc2ccccc2 Amb15701623 [0,1,0,1,0,0|2,0,0]=4 1166 B16R2.23 ClCC1CN(Cc2ccccc2)CCC1 Amb21959747 [0,1,0,1,0,0|2,0,0]=4 1167 B16R2.23 ClCC1CN(Cc2ccccc2)CCO1 Amb22387711 [0,1,0,1,0,0|2,0,0]=4 1168 B16R2.23 ClCC1OCCN(C1)Cc2ccccc2 Amb1107615 [0,1,0,1,0,0|2,0,0]=4 1169 B16R2.23 ClC[C@@H]1CN(Cc2ccccc2)CCO1 Amb22232518 [0,1,0,1,0,0|2,0,0]=4 1170 B16R2.23 ClC[C@H]1CN(Cc2ccccc2)CCO1 Amb22232514 [0,1,0,1,0,0|2,0,0]=4 1171 B16R2.23 ClC[C@H]1CN(Cc2ccccc2)CCO1 Amb22388202 [0,1,0,1,0,0|2,0,0]=4 1172 B16R2.88 CC(N1CCNCC1)Cc2ccccc2 Amb17089402 [0,1,0,1,0,0|1,0,0]=3 1173 B16R2.88 CC(N1CCNCC1)Cc2ccccn2 Amb17089399 [0,1,0,1,0,0|2,0,0]=4 1174 B16R2.88 CC(N1CCNCC1)Cc2cccnc2 Amb17089400 [0,1,0,1,0,0|2,0,0]=4 1175 B16R2.88 CC(N1CCNCC1)Cc2ccncc2 Amb17089401 [0,1,0,1,0,0|2,0,0]=4 1176 B16R2.88 CC(N1CCOCC1)Sc2ccccc2 Amb10553272 [0,1,0,1,0,0|2,0,0]=4 1177 B16R2.92 ClCCC1CN(Cc2ccccc2)CC1 Amb22299851 [0,1,0,1,0,0|2,0,0]=4 1178 B16R2.92 ClCC[C@@H]1CN(Cc2ccccc2)CC1 Amb22299790 [0,1,0,1,0,0|2,0,0]=4 1179 B16R2.92 ClCC[C@H]1CN(Cc2ccccc2)CC1 Amb22299787 [0,1,0,1,0,0|2,0,0]=4 1180 B16R2.2938 CC1CN(CCC#N)C1c2ccccc2 Amb22152766 [0,1,0,1,0,0|1,0,1]=4 1181 B16R2.2960 O=C1CCCCC1(C)Cc2ccccc2 Amb10571312 [0,1,0,1,0,0|2,0,0]=4 1182 B16R2.3253 BrC1CC(Cc2ccccc2)CCCC1 Amb24426998 [0,1,0,1,0,0|1,1,0]=4 1183 B16R2.3253 ClC1CC(Cc2cc[n]cc2)CCCC1 Amb24423163 [0,1,0,1,0,0|2,0,0]=4 1184 B16R2.3253 ClC1CC(Cc2cccc[n]2)CCCC1 Amb25029771 [0,1,0,1,0,0|2,0,0]=4 1185 B16R2.3253 O=C1CC(Cc2ccccc2)CCCC1 Amb25303349 [0,1,0,1,0,0|2,0,0]=4 1186 B16R2.3253 O=C1CCCCC(Cc2ccccc2)N1 Amb22473461 [0,1,0,1,0,0|1,0,1]=4 1187 B16R2.6335 CC1Cc2ccccc2N1C\C=C\CCl Amb25218276 [0,1,0,1,0,0|0,0,1]=3 1188 B16R2.6335 ClCCCCN1C(C)Cc2c1cccc2 Amb17342938 [0,1,0,1,0,0|0,0,0]=2 1189 B16R2.12202 CC1Cc2ccccc2N(CCCBr)C1 Amb25171023 [0,1,0,1,0,0|0,1,0]=3 1190 B16R2.12202 NCCCN1CC(C)Oc2c1cccc2 Amb17307974 [0,1,0,1,0,0|2,0,0]=4 1191 B16R2.13402 CC1(CNCCOC1)Cc2ccccc2 Amb18567351 [0,1,0,1,0,0|2,0,0]=4 1192 B16R2.13402 CC1(Cc2ccccc2)CNCCNC1 Amb18865093 [0,1,0,1,0,0|2,0,0]=4 1193 B16R2.236 CC1CC(CCC1)C(Cl)c2ccccc2 Amb25359643 [0,1,0,1,0,0|2,0,0]=4 1194 B16R2.2209 O=C(C1CCCCCN1)c2ccccc2 Amb18785341 [0,1,0,1,0,0|1,0,1]=4 1195 B16R2.2209 OC(C1CCCCCN1)c2ccccc2 Amb18782213 [0,1,0,1,0,0|1,0,0]=3 1196 B16R2.2272 C[n]1c(NCCCCl)[n]c2ccccc12 Amb24749118 [0,1,0,1,0,0|1,0,1]=4 1197 B16R2.6780 C[C@@H]([C@H](O)c1ccccc1)N2CCCC2 Amb22366946 [0,1,0,1,0,0|1,0,0]=3 1198 B16R2.6780 O[C@H]([C@H](N1CCCC1)C)c2ccccc2 Amb16232549 [0,1,0,1,0,0|1,0,0]=3 1199 B16R2.30799 Cc1c(Br)c2ccccc2[n]1CCCCl Amb25854486 [0,1,0,1,0,0|0,0,2]=4 1200 B16R2.250651 CC1(CCCCC1)C(Br)c2ccccc2 Amb25210609 [0,1,0,1,0,0|2,0,0]=4 1201 B16R2.250651 CC1(CCCCN1)C(=O)c2ccccc2 Amb24377016 [0,1,0,1,0,0|1,0,1]=4 1202 B16R2.20 Cc1ccc(CN2CCC(C2)CCl)cc1 Amb25285048 [0,1,0,1,0,0|2,0,0]=4 1203 B16R2.20 ClCC1CN(Cc2ccc(Br)cc2)CC1 Amb24751598 [0,1,0,1,0,0|2,0,0]=4 1204 B16R2.131 BrC1CC(CCC1)Cc2ccc(I)cc2 Amb24664960 [0,1,0,1,0,0|1,1,0]=4 1205 B16R2.131 CN1CCNC(Cc2ccc(Br)cc2)C1 Amb18593456 [0,1,0,1,0,0|2,0,0]=4 1206 B16R2.131 CN1CCNC(Cc2ccc(Cl)cc2)C1 Amb18571188 [0,1,0,1,0,0|2,0,0]=4 1207 B16R2.131 CN1CCNC(Cc2ccc(F)cc2)C1 Amb18568478 [0,1,0,1,0,0|2,0,0]=4 1208 B16R2.131 Cc1ccc(CC2CC(=O)CCN2)cc1 Amb18785346 [0,1,0,1,0,0|1,0,1]=4 1209 B16R2.131 Cc1ccc(CC2CCCC(Br)C2)cc1 Amb25374992 [0,1,0,1,0,0|1,1,0]=4 1210 B16R2.131 Cc1ccc(CC2CCCC(Cl)C2)cc1 Amb25115290 [0,1,0,1,0,0|1,0,0]=3 1211 B16R2.131 Cc1ccc(CC2CN(C)CCN2)cc1 Amb18567113 [0,1,0,1,0,0|2,0,0]=4 1212 B16R2.131 ClC1CC(CCC1)Cc2ccc(Br)c[n]2 Amb25677189 [0,1,0,1,0,0|2,0,0]=4 1213 B16R2.131 ClC1CC(CCC1)Cc2ccc(I)cc2 Amb25732621 [0,1,0,1,0,0|1,0,0]=3 1214 B16R2.131 ClC1CN(Cc2ccc(Br)cc2)CCC1 Amb25789057 [0,1,0,1,0,0|2,0,0]=4 1215 B16R2.131 ClC1CN(Cc2ccc(I)cc2)CCC1 Amb25083759 [0,1,0,1,0,0|2,0,0]=4 1216 B16R2.131 Fc1ccc(CC2CCCC(Br)C2)cc1 Amb24412524 [0,1,0,1,0,0|1,1,0]=4 1217 B16R2.131 Fc1ccc(CN2CCCC(Cl)C2)cc1 Amb25823326 [0,1,0,1,0,0|2,0,0]=4 1218 B16R2.131 O=C1CC(Cc2ccc(Cl)cc2)NCC1 Amb18761582 [0,1,0,1,0,0|1,0,1]=4 1219 B16R2.131 O=C1CC(Cc2ccc(F)cc2)NCC1 Amb18779242 [0,1,0,1,0,0|1,0,1]=4 1220 B16R2.131 O[C@@H]1C[C@H](Cc2ccc(Cl)cc2)NCC1 Amb22747048 [0,1,0,1,0,0|1,0,0]=3 1221 B16R2.131 Oc1ccc(CC2CCCC(Cl)C2)cc1 Amb24672803 [0,1,0,1,0,0|1,0,0]=3 1222 B16R2.133 CC(Cc1ccc(N)cc1)N2CCCC2 Amb18050242 [0,1,0,1,0,0|1,0,0]=3 1223 B16R2.33330 Brc1ccc(CC2CCCCCN2)cc1 Amb22054567 [0,1,0,1,0,0|1,0,0]=3 1224 B16R2.33330 Cc1ccc(CC2CCCCCN2)cc1 Amb17659224 [0,1,0,1,0,0|1,0,0]=3 1225 B16R2.33330 Cc1ccc(cc1)CC2CCCCCN2 Amb2235767 [0,1,0,1,0,0|1,0,0]=3 1226 B16R2.33345 CC(Cc1ccc(O)cc1)NCC2CC2 Amb25389540 [0,1,0,1,0,0|1,0,0]=3 1227 B16R2.33353 CC(Cc1ccc(Br)cc1)NC2CCC2 Amb24771874 [0,1,0,1,0,0|1,0,0]=3 1228 B16R2.251 Brc1cccc(CC2CC(Br)CCC2)c1 Amb24634457 [0,1,0,1,0,0|1,1,0]=4 1229 B16R2.251 CN1CCNC(Cc2cccc(Br)c2)C1 Amb18074901 [0,1,0,1,0,0|2,0,0]=4 1230 B16R2.251 CN1CCNC(Cc2cccc(Cl)c2)C1 Amb18571184 [0,1,0,1,0,0|2,0,0]=4 1231 B16R2.251 CN1CCNC(Cc2cccc(F)c2)C1 Amb18568482 [0,1,0,1,0,0|2,0,0]=4 1232 B16R2.251 Cc1cccc(CC2CN(C)CCN2)c1 Amb18567109 [0,1,0,1,0,0|2,0,0]=4 1233 B16R2.251 ClC1CC(CCC1)Cc2c[n]cc(Br)c2 Amb25121621 [0,1,0,1,0,0|2,0,0]=4 1234 B16R2.251 ClC1CC(CCC1)Cc2cccc(Br)c2 Amb25234877 [0,1,0,1,0,0|1,0,0]=3 1235 B16R2.251 Clc1cccc(CC2CC(Cl)CCC2)c1 Amb25171236 [0,1,0,1,0,0|1,0,0]=3 1236 B16R2.251 Fc1cc(CC2CC(Br)CCC2)ccc1 Amb24462836 [0,1,0,1,0,0|1,1,0]=4 1237 B16R2.251 Fc1cc(CC2CC(Cl)CCC2)ccc1 Amb25759987 [0,1,0,1,0,0|1,0,0]=3 1238 B16R2.251 Fc1cc(CN2CCCC(Cl)C2)ccc1 Amb25107151 [0,1,0,1,0,0|2,0,0]=4 1239 B16R2.251 Oc1cc(CC2CC(Br)CCC2)ccc1 Amb25777998 [0,1,0,1,0,0|1,1,0]=4 1240 B16R2.251 Oc1cc(CC2CC(Cl)CCC2)ccc1 Amb25204397 [0,1,0,1,0,0|1,0,0]=3 1241 B16R2.251 Oc1cc(CN2CCCC(Cl)C2)ccc1 Amb24352600 [0,1,0,1,0,0|2,0,0]=4 1242 B16R2.2333 Clc1cccc(CN2CC(CC2)CCl)c1 Amb25332921 [0,1,0,1,0,0|2,0,0]=4 1243 B16R2.317 CC1CC(Cc2ccccc2)C(=O)CC1 Amb24415227 [0,1,0,1,0,0|2,0,0]=4 1244 B16R2.317 CC1CC(Cc2ccccc2)C(Cl)CC1 Amb25671383 [0,1,0,1,0,0|2,0,0]=4 1245 B16R2.2128 CN(C\C=C\Cl)C1Cc2ccccc2C1 Amb20640825 [0,1,0,1,0,0|0,0,2]=4 1246 B16R2.2128 O=C(NCCCl)C1Cc2ccccc2C1 Amb25679411 [0,1,0,1,0,0|2,0,0]=4 1247 B16R2.2843 CC(Cc1ccccc1)N2CCC(=O)C2 Amb25245795 [0,1,0,1,0,0|1,0,1]=4 1248 B16R2.2843 CC(Cc1ccccc1)N2CCC(=O)N2 Amb22485564 [0,1,0,1,0,0|1,0,1]=4 1249 B16R2.2843 O=C(Cc1ccccc1)N2CCC(Cl)C2 Amb24451863 [0,1,0,1,0,0|1,0,1]=4 1250 B16R2.734 O=C(CCBr)NC1Cc2ccccc2C1 Amb25840567 [0,1,0,1,0,0|0,1,1]=4 1251 B16R2.789 ClCCC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb16202739 [0,1,0,1,0,0|0,0,1]=3 1252 B16R2.789 NCCC(=O)NC1CC1c2ccccc2 Amb24772015 [0,1,0,1,0,0|1,0,1]=4 1253 B16R2.2822 CC1CN(C)C[C@@H](Cc2ccccc2)N1 Amb18783735 [0,1,0,1,0,0|2,0,0]=4 1254 B16R2.2822 C[C@@H]1CN(C)CC(Cc2ccccc2)N1 Amb18783736 [0,1,0,1,0,0|2,0,0]=4 1255 B16R2.29842 BrCCC(=O)N1C(C)Cc2c1cccc2 Amb17333566 [0,1,0,1,0,0|0,1,1]=4 1256 B16R2.29842 CC1Cc2ccccc2N1C(=O)CCN Amb25388135 [0,1,0,1,0,0|1,0,1]=4 1257 B16R2.29842 ClCCC(=O)N1C(C)Cc2c1cccc2 Amb1083111 [0,1,0,1,0,0|0,0,1]=3 1258 B16R2.2 ClCC1CCN(CC1)Cc2ccccc2 Amb15701460 [0,1,0,1,0,0|2,0,0]=4 1259 B16R2.2 ClCC1CCN(Cc2ccccc2)CC1 Amb21959735 [0,1,0,1,0,0|2,0,0]=4 1260 B16R2.2 NCC1CCC(Cc2ccccc2)NC1 Amb18783818 [0,1,0,1,0,0|1,0,0]=3 1261 B16R2.2 OCC1NCC(NC1)Cc2ccccc2 Amb17579160 [0,1,0,1,0,0|1,0,0]=3 1262 B16R2.124 CC1CCN(CC1Cl)Cc2ccccc2 Amb25039808 [0,1,0,1,0,0|2,0,0]=4 1263 B16R2.124 C[C@@H]1CN[C@H](Cc2ccccc2)CN1C Amb18783748 [0,1,0,1,0,0|2,0,0]=4 1264 B16R2.8241 CC1(CCl)CN(Cc2ccccc2)CC1 Amb25372999 [0,1,0,1,0,0|2,0,0]=4 1265 B16R2.11149 CC1(Cc2ccccc2)OC(CCl)CO1 Amb25040235 [0,1,0,1,0,0|1,0,0]=3 1266 B16R2.33562 CC1Cc2ccccc2N1CC(C)CBr Amb25182346 [0,1,0,1,0,0|0,1,0]=3 1267 B16R2.33562 CC1Cc2ccccc2N1CC(C)CCl Amb25120233 [0,1,0,1,0,0|0,0,0]=2 1268 B16R2.33562 CCC(=O)CN1C(C)Cc2ccccc12 Amb24685342 [0,1,0,1,0,0|1,0,1]=4 1269 B16R2.33562 Cc1[n]c2ccccc2[n]1CC(C)CCl Amb24375178 [0,1,0,1,0,0|1,0,1]=4 1270 B16R2.33562 Cc1[n]c2ccccc2[n]1CC(O)CCl Amb24360139 [0,1,0,1,0,0|1,0,1]=4 1271 B16R2.101 NCC(N1CCCC1)Cc2ccccc2 Amb1129117 [0,1,0,1,0,0|1,0,0]=3 1272 B16R2.101 NCC(N1CCCC1)Cc2cccnc2 Amb17238605 [0,1,0,1,0,0|2,0,0]=4 1273 B16R2.112 CCc1[n]c2ccccc2[n]1CCCCl Amb20573230 [0,1,0,1,0,0|1,0,1]=4 1274 B16R2.7942 BrCC1(Cc2ccccc2)CCCCC1 Amb25688265 [0,1,0,1,0,0|2,0,0]=4 1275 B16R2.7942 CNC1(CCCCC1)Cc2ccccc2 Amb17402781 [0,1,0,1,0,0|2,0,0]=4 1276 B16R2.7942 ClCC1(Cc2ccccc2)CCCCO1 Amb24443358 [0,1,0,1,0,0|2,0,0]=4 1277 B16R2.4003 CC(=O)CCN1C(C)Cc2c1cccc2 Amb17402744 [0,1,0,1,0,0|1,0,1]=4 1278 B16R2.4003 ClC(=O)CCN1C(C)Cc2c1cccc2 Amb17143975 [0,1,0,1,0,0|0,0,1]=3 1279 B16R2.4003 NC(=O)CCN1C(C)Cc2c1cccc2 Amb17143315 [0,1,0,1,0,0|1,0,1]=4 1280 B16R2.14817 CC1(Cl)CN(Cc2ccccc2)CCC1 Amb22268298 [0,1,0,1,0,0|2,0,0]=4 1281 B16R2.14817 O=S1(=O)CC(Cc2ccccc2)NCC1 Amb18571307 [0,1,0,1,0,0|2,0,0]=4 1282 B16R2.2363 Cc1ccccc1CN2CCC(C2)CCl Amb25272150 [0,1,0,1,0,0|2,0,0]=4 1283 B16R2.2363 Clc1ccccc1CN2CC(CC2)CCl Amb25706254 [0,1,0,1,0,0|2,0,0]=4 1284 B16R2.2363 Fc1ccccc1CN2CCC(C2)CCl Amb25170966 [0,1,0,1,0,0|2,0,0]=4 1285 B16R2.2923 Brc1ccccc1CC2CC(Br)CCC2 Amb25171341 [0,1,0,1,0,0|1,1,0]=4 1286 B16R2.2923 CN1CCNC(Cc2ccccc2Br)C1 Amb18593460 [0,1,0,1,0,0|2,0,0]=4 1287 B16R2.2923 CN1CCNC(Cc2ccccc2Cl)C1 Amb18571180 [0,1,0,1,0,0|2,0,0]=4 1288 B16R2.2923 CN1CCNC(Cc2ccccc2F)C1 Amb18568474 [0,1,0,1,0,0|2,0,0]=4 1289 B16R2.2923 Cc1ccccc1CC2CC(=O)CCN2 Amb18785347 [0,1,0,1,0,0|1,0,1]=4 1290 B16R2.2923 Cc1ccccc1CC2CCCC(Cl)C2 Amb25719259 [0,1,0,1,0,0|1,0,0]=3 1291 B16R2.2923 Cc1ccccc1CC2CN(C)CCN2 Amb18567105 [0,1,0,1,0,0|2,0,0]=4 1292 B16R2.2923 ClC1CN(Cc2ccccc2Br)CCC1 Amb25832932 [0,1,0,1,0,0|2,0,0]=4 1293 B16R2.2923 Clc1ccccc1CC2CC(Cl)CCC2 Amb25846603 [0,1,0,1,0,0|1,0,0]=3 1294 B16R2.2923 Clc1ccccc1CC2CCCC(Br)C2 Amb24749071 [0,1,0,1,0,0|1,1,0]=4 1295 B16R2.2923 Fc1ccccc1CC2CCCC(Br)C2 Amb25788453 [0,1,0,1,0,0|1,1,0]=4 1296 B16R2.2923 Nc1[n]cccc1CC2CCCC(Cl)C2 Amb24379337 [0,1,0,1,0,0|2,0,0]=4 1297 B16R2.2923 O=C1CC(Cc2ccccc2Cl)NCC1 Amb18761580 [0,1,0,1,0,0|1,0,1]=4 1298 B16R2.2923 O=C1CC(Cc2ccccc2F)NCC1 Amb18779243 [0,1,0,1,0,0|1,0,1]=4 1299 B16R2.24848 Cc1ccccc1CC2CCCCCN2 Amb2235764 [0,1,0,1,0,0|1,0,0]=3 1300 B16R2.24848 Cc1cnccc1CC2CCCCCN2 Amb2235548 [0,1,0,1,0,0|2,0,0]=4 1301 B16R2.24848 Fc1ccccc1CC2CNCCCC2 Amb22055315 [0,1,0,1,0,0|2,0,0]=4 1302 B16R3.1272 OC[C@H]1C[C@@H]2Cc3ccccc3N2N1 Amb24675284 [0,0,0,2,0,0|2,0,0]=4 1303 B16R3.1739 ClC1C(C2CC1CC2)c3ccccc3 Amb25309614 [0,0,0,2,0,0|1,0,0]=3 1304 B16R3.1739 NC1C(C2CC1CC2)c3ccccc3 Amb22731668 [0,0,0,2,0,0|2,0,0]=4 1305 B16R3.1739 OC1C(C2CC1CC2)c3ccccc3 Amb24430075 [0,0,0,2,0,0|2,0,0]=4 1306 B16R3.1739 O[C@@H]1[C@@H]([C@@H]2C[C@@H]1CC2)c3ccccc3 Amb25309503 [0,0,0,2,0,0|2,0,0]=4 1307 B16R3.1739 O[C@@H]1[C@H]([C@@H]2C[C@H]1CC2)c3ccccc3 Amb25280136 [0,0,0,2,0,0|2,0,0]=4 1308 B16R3.1739 O[C@H]1[C@@H]([C@@H]2C[C@@H]1CC2)c3ccccc3 Amb25296407 [0,0,0,2,0,0|2,0,0]=4 1309 B16R3.1739 O[C@H]1[C@H]([C@@H]2C[C@@H]1CC2)c3ccccc3 Amb25176654 [0,0,0,2,0,0|2,0,0]=4 1310 B16R3.1739 O[C@H]1[C@H]([C@@H]2C[C@H]1CC2)c3ccccc3 Amb24698668 [0,0,0,2,0,0|2,0,0]=4 1311 B16R3.2694 NC1C2CC(Cc3ccccc3)CC21 Amb24373983 [0,0,0,2,0,0|2,0,0]=4 1312 B16R3.2637 CN1CCN2C(Cc3ccccc23)C1 Amb25063226 [0,0,0,2,0,0|2,0,0]=4 1313 B16R3.3555 ClC1CC2CCC1C2c3ccccc3 Amb25103292 [0,0,0,2,0,0|1,0,0]=3 1314 B16R3.3555 Cl[C@H]1C[C@H]2CC[C@H]1C2c3ccccc3 Amb25237592 [0,0,0,2,0,0|1,0,0]=3 1315 B16R3.3555 OC1CC2CCC1C2c3ccccc3 Amb25296185 [0,0,0,2,0,0|2,0,0]=4 1316 B16R3.3555 OC1C[C@@H]2CC[C@H]1[C@@H]2c3ccccc3 Amb24584063 [0,0,0,2,0,0|2,0,0]=4 1317 B16R3.27838 CC1CCNC2Cc3ccccc3C21 Amb24348061 [0,0,0,2,0,0|1,0,0]=3 1318 B16R3.27838 CC1NCCN2Cc3ccccc3C21 Amb18650018 [0,0,0,2,0,0|2,0,0]=4 1319 B16R3.27838 CN1CCNC2Cc3ccccc3C12 Amb24628293 [0,0,0,2,0,0|2,0,0]=4 1320 B16R3.27838 C[C@@H]1NCCN2Cc3ccccc3[C@H]21 Amb24100254 [0,0,0,2,0,0|2,0,0]=4 1321 B16R3.27838 C[C@H]1NCCN2Cc3ccccc3[C@H]21 Amb24100215 [0,0,0,2,0,0|2,0,0]=4 1322 B16R3.27838 NC1CCCC2Cc3ccccc3C21 Amb25828977 [0,0,0,2,0,0|2,0,0]=4 1323 B16R3.1722 C1C2CNCCCN2c3ccccc31 Amb25689634 [0,0,0,2,0,0|1,0,0]=3 1324 B16R3.1722 C1C2NCCCOC2c3ccccc31 Amb20668498 [0,0,0,2,0,0|1,0,0]=3 1325 B16R3.1722 C1C2OCCCNC2c3ccccc31 Amb25104995 [0,0,0,2,0,0|2,0,0]=4 1326 B16R3.3330 O[C@@H]1CCC[C@H]2C[C@]21c3ccccc3 Amb25261778 [0,0,0,2,0,0|2,0,0]=4 1327 B16R3.3330 O[C@H]1CCC[C@H]2C[C@]21c3ccccc3 Amb25271500 [0,0,0,2,0,0|2,0,0]=4 1328 B16R3.1782 C1C(C2CCCN2)C1c3ccccc3 Amb25285977 [0,0,0,2,0,0|2,0,0]=4 1329 B16R3.5925 C1C(Cc2ccccc21)N3CCCC3 Amb22522026 [0,0,0,2,0,0|1,0,0]=3 1330 B16R3.62906 C(c1ccccc1)C23CCCCC2O3 Amb24064575 [0,0,0,2,0,0|2,0,0]=4 1331 B16R3.15144 CC12CCNC1(C)Nc3c2cccc3 Amb2496635 [0,0,0,2,0,0|2,0,0]=4 1332 B16R3.15144 CC12Nc3ccccc3C1(Cl)CCO2 Amb25770067 [0,0,0,2,0,0|2,0,0]=4 1333 B16R3.62908 C1NCC2(Cc3ccccc3)CCC21 Amb24742663 [0,0,0,2,0,0|2,0,0]=4 1334 B16R3.14531 CC1CC1NC2Cc3ccccc3C2 Amb19071046 [0,0,0,2,0,0|1,0,0]=3 1335 B16R3.30024 NC1CC2CC(Cl)C1c3ccccc32 Amb24424871 [0,0,0,2,0,0|2,0,0]=4 1336 B16R3.1726 C1C2CNCCC(C2)c3ccccc31 Amb24470063 [0,0,0,2,0,0|2,0,0]=4 1337 B16R3.1726 C1[C@H]2CNCC[C@H](O2)c3ccccc31 Amb24563823 [0,0,0,2,0,0|2,0,0]=4 1338 B16R3.3509 CC1Cc2[n]cccc2C(N1)C3CC3 Amb24555193 [0,0,0,2,0,0|2,0,0]=4 1339 B16R3.3509 CC1Cc2ccccc2C(N1)C3CC3 Amb24645217 [0,0,0,2,0,0|1,0,0]=3 1340 B16R3.990 OC[C@@H]1C[C@@H]1[C@H]2C[C@@H]2c3ccccc3 Amb25236464 [0,0,0,2,0,0|2,0,0]=4 1341 B16R3.990 OC[C@@H]1C[C@@H]1[C@H]2C[C@H]2c3ccccc3 Amb25236128 [0,0,0,2,0,0|2,0,0]=4 1342 B16R3.990 OC[C@@H]1C[C@H]1[C@@H]2C[C@H]2c3ccccc3 Amb25176974 [0,0,0,2,0,0|2,0,0]=4 1343 B16R3.990 OC[C@@H]1C[C@H]1[C@H]2C[C@@H]2c3ccccc3 Amb25381457 [0,0,0,2,0,0|2,0,0]=4 1344 B16R3.990 OC[C@@H]1C[C@H]1[C@H]2C[C@H]2c3ccccc3 Amb25306576 [0,0,0,2,0,0|2,0,0]=4 1345 B16R3.990 OC[C@H]1C[C@@H]1[C@H]2C[C@@H]2c3ccccc3 Amb24519684 [0,0,0,2,0,0|2,0,0]=4 1346 B16R3.990 OC[C@H]1C[C@@H]1[C@H]2C[C@H]2c3ccccc3 Amb24675486 [0,0,0,2,0,0|2,0,0]=4 1347 B16R3.990 OC[C@H]1C[C@H]1[C@H]2C[C@H]2c3ccccc3 Amb25226423 [0,0,0,2,0,0|2,0,0]=4 1348 B16R3.6002 C1C(C1NC2CCC2)c3ccccc3 Amb19076745 [0,0,0,2,0,0|1,0,0]=3 1349 B16R3.6002 C1NCC1NC2CC2c3ccccc3 Amb25078514 [0,0,0,2,0,0|2,0,0]=4 1350 B16R3.6002 C1OCC1NC2CC2c3ccccc3 Amb25729668 [0,0,0,2,0,0|2,0,0]=4 1351 B16R3.3490 CC1Cc2ccccc2N1C3CNC3 Amb24709705 [0,0,0,2,0,0|2,0,0]=4 1352 B16R3.63995 C1C(Cc2ccccc21)NC3CCC3 Amb19071044 [0,0,0,2,0,0|1,0,0]=3 1353 B16R3.65859 C1c2ccccc2CC13NCCCS3 Amb25337870 [0,0,0,2,0,0|1,0,0]=3 1354 B16R3.27088 CC1Cc2cccc3CCCC(N1)c32 Amb24596313 [0,0,0,2,0,0|1,0,0]=3 1355 B12R1.37 NCCCNCCc1ccc[s]1 Amb18608752 [1,0,0,0,1,0|2,0,0]=4 1356 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [1,0,0,0,1,0|1,0,1]=4 1357 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [1,0,0,0,1,0|1,0,0]=3 1358 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [1,0,0,0,1,0|2,0,0]=4 1359 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [1,0,0,0,1,0|0,0,2]=4 1360 B12R1.30 CC(\N=C\CCl)c1ccccc1 Amb24558631 [1,0,0,0,1,0|0,0,2]=4 1361 B12R1.30 CCC/N=C(\C)c1ccccc1 Amb17779516 [1,0,0,0,1,0|0,0,2]=4 1362 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [1,0,0,0,1,0|1,0,1]=4 1363 B12R1.30 CCCNC(=S)c1ccccc1 Amb25827093 [1,0,0,0,1,0|1,0,1]=4 1364 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [1,0,0,0,1,0|0,0,0]=2 1365 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [1,0,0,0,1,0|2,0,0]=4 1366 B12R1.30 CC\C=N\C(C)c1ccccc1 Amb24436889 [1,0,0,0,1,0|0,0,2]=4 1367 B12R1.30 C[C@@H](\N=C\CCl)c1ccccc1 Amb25187511 [1,0,0,0,1,0|0,0,2]=4 1368 B12R1.30 C[C@H]([NH2+]CCCl)c1ccccc1 Amb17773001 [1,0,0,0,1,0|0,0,1]=3 1369 B12R1.30 C\C(=C\CCCl)\c1ccccc1 Amb24394711 [1,0,0,0,1,0|0,0,2]=4 1370 B12R1.30 C\C=C/NC(C)c1ccccc1 Amb25158747 [1,0,0,0,1,0|0,0,2]=4 1371 B12R1.30 ClCCCC(=O)c1ccccc1 Amb1229841 [1,0,0,0,1,0|1,0,1]=4 1372 B12R1.30 ClCCCC(c1ccccc1)O Amb17194564 [1,0,0,0,1,0|1,0,0]=3 1373 B12R1.30 ClCCCN(c1ccccc1)C Amb17335669 [1,0,0,0,1,0|1,0,0]=3 1374 B12R1.30 ClCCNC(=O)c1ccccc1 Amb2414312 [1,0,0,0,1,0|1,0,1]=4 1375 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [1,0,0,0,1,0|0,0,0]=2 1376 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [1,0,0,0,1,0|0,0,0]=2 1377 B12R1.30 ClCC\C=C(\c1ccccc1)/C Amb17233775 [1,0,0,0,1,0|0,0,2]=4 1378 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [1,0,0,0,1,0|2,0,0]=4 1379 B12R1.30 NCCCC(c1ccccc1)O Amb17079154 [1,0,0,0,1,0|2,0,0]=4 1380 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [1,0,0,0,1,0|1,0,0]=3 1381 B12R1.30 NCCSC(c1ccccc1)C Amb17500453 [1,0,0,0,1,0|2,0,0]=4 1382 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [1,0,0,0,1,0|2,0,0]=4 1383 B12R1.30 OCCCC(c1ccccc1)O Amb17334675 [1,0,0,0,1,0|2,0,0]=4 1384 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [1,0,0,0,1,0|1,0,0]=3 1385 B12R1.35 CC(NCCCO)c1c[s]cc1 Amb19075400 [0,0,0,0,2,0|2,0,0]=4 1386 B12R1.35 CCCCNC(C)c1c[nH]cc1 Amb21971535 [0,0,0,0,2,0|2,0,0]=4 1387 B12R1.35 CCCCNC(C)c1c[s]cc1 Amb19074601 [0,0,0,0,2,0|2,0,0]=4 1388 B16R1.1694 CC(COCc1ccccc1)NCCC#C Amb25186880 [0,0,0,0,0,2|1,0,1]=4 1389 B16R1.1694 CC(COCc1ccccc1)NCCC=C Amb25186883 [0,0,0,0,0,2|1,0,1]=4 1390 B16R1.1694 CC(COCc1ccccc1)NCCCO Amb25186884 [0,0,0,0,0,2|1,0,0]=3 1391 B16R1.1694 CC(COCc1ccccc1)NC\C=C\Cl Amb25186888 [0,0,0,0,0,2|0,0,2]=4 1392 B16R1.1694 CNCCNC(C)COCc1ccccc1 Amb25264477 [0,0,0,0,0,2|2,0,0]=4