0 B14R1.158 CCCCNC(=O)Nc1ccccc1 Amb6565930 [0,0,0,0,0,0|3,0,1]=4 1 B14R1.158 CCCCNC(=S)Nc1ccccc1 Amb1804766 [0,0,0,0,0,0|3,0,1]=4 2 B14R1.158 CCCCNC(C)Cc1ccccc1 Amb19041462 [0,0,0,0,0,0|1,0,0]=1 3 B14R1.158 CCCCOC(=O)Cc1ccccc1 Amb9787240 [0,0,0,0,0,0|3,0,1]=4 4 B14R1.158 CN(CCCC#N)Cc1ccccc1 Amb6279696 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.158 CN(CCCCCl)Cc1ccccc1 Amb17339782 [0,0,0,0,0,0|2,0,0]=2 6 B14R1.158 CN(CCCCO)Cc1ccccc1 Amb9370065 [0,0,0,0,0,0|3,0,0]=3 7 B14R1.158 CN(CCCCS)Cc1ccccc1 Amb27197835 [0,0,0,0,0,0|3,0,0]=3 8 B14R1.158 CN(CCCON)Cc1ccccc1 Amb17104882 [0,0,0,0,0,0|4,0,0]=4 9 B14R1.158 CNCCCN(C)Cc1ccccc1 Amb6710801 [0,0,0,0,0,0|4,0,0]=4 10 B14R1.158 COCCCC(N)Cc1ccccc1 Amb19062060 [0,0,0,0,0,0|4,0,0]=4 11 B14R1.158 N#CCCNC(=O)Cc1ccccc1 Amb17401185 [0,0,0,0,0,0|2,0,2]=4 12 B14R1.158 NCCCNC(=O)Cc1ccccc1 Amb6280127 [0,0,0,0,0,0|2,0,1]=3 13 B14R1.158 NCCCNC(=O)Nc1ccccc1 Amb10808642 [0,0,0,0,0,0|3,0,1]=4 14 B14R1.158 NCCCNC(=O)Nc1ccccc1 Amb18330404 [0,0,0,0,0,0|3,0,1]=4 15 B14R1.158 OCCCN\C(S)=N\c1ccccc1 Amb22330467 [0,0,0,0,0,0|3,0,1]=4 16 B13R1.28 BrCCCCCCc1ccccc1 Amb2685411 [1,0,0,0,0,0|1,1,0]=3 17 B13R1.28 BrCCCCCOc1ccccc1 Amb22730694 [1,0,0,0,0,0|2,1,0]=4 18 B13R1.28 BrCCCCOCc1ccccc1 Amb4006164 [1,0,0,0,0,0|2,1,0]=4 19 B13R1.28 C=CCCNCCc1ccccc1 Amb19737352 [1,0,0,0,0,0|1,0,1]=3 20 B13R1.28 C=CCCNOCc1ccccc1 Amb26335912 [1,0,0,0,0,0|2,0,1]=4 21 B13R1.28 CCCCCCCc1ccccc1 Amb8513456 [1,0,0,0,0,0|2,0,0]=3 22 B13R1.28 CCCCCCCc1ccccn1 Amb22235249 [1,0,0,0,0,0|3,0,0]=4 23 B13R1.28 CCCCCCCc1cccnc1 Amb22235253 [1,0,0,0,0,0|3,0,0]=4 24 B13R1.28 CCCCCCCc1ccncc1 Amb22235258 [1,0,0,0,0,0|3,0,0]=4 25 B13R1.28 CCCCCCNc1ccccc1 Amb597405 [1,0,0,0,0,0|3,0,0]=4 26 B13R1.28 CCCCCNCc1ccccc1 Amb838091 [1,0,0,0,0,0|3,0,0]=4 27 B13R1.28 CCCCNCCc1ccccc1 Amb2172322 [1,0,0,0,0,0|1,0,0]=2 28 B13R1.28 CCCCNCCc1ccccc1 Amb875620 [1,0,0,0,0,0|1,0,0]=2 29 B13R1.28 CCCCNOCc1ccccc1 Amb27433781 [1,0,0,0,0,0|2,0,0]=3 30 B13R1.28 CCCCOCCc1ccccc1 Amb24065444 [1,0,0,0,0,0|2,0,0]=3 31 B13R1.28 CCCNCCCc1ccccc1 Amb20673529 [1,0,0,0,0,0|3,0,0]=4 32 B13R1.28 CCCNCCCc1ccccc1 Amb6714447 [1,0,0,0,0,0|3,0,0]=4 33 B13R1.28 CCCOCCCc1ccccc1 Amb24063573 [1,0,0,0,0,0|3,0,0]=4 34 B13R1.28 CCNCCCCc1ccccc1 Amb8853688 [1,0,0,0,0,0|3,0,0]=4 35 B13R1.28 COCCNCCc1ccccc1 Amb6685596 [1,0,0,0,0,0|2,0,0]=3 36 B13R1.28 COCCNCCc1ccncc1 Amb16191750 [1,0,0,0,0,0|3,0,0]=4 37 B13R1.28 ClCCCCCCc1cncnc1 Amb24070772 [1,0,0,0,0,0|3,0,0]=4 38 B13R1.28 ClCCCCOCc1ccccc1 Amb19084569 [1,0,0,0,0,0|2,0,0]=3 39 B13R1.28 ClCCCNCCc1ccccc1 Amb29565621 [1,0,0,0,0,0|0,0,0]=1 40 B13R1.28 ClCCCOCCc1ccccc1 Amb9208564 [1,0,0,0,0,0|1,0,0]=2 41 B13R1.28 ClCOCCOCc1ccccc1 Amb27205014 [1,0,0,0,0,0|3,0,0]=4 42 B13R1.28 FCCCCNCc1ccccc1 Amb27863240 [1,0,0,0,0,0|2,1,0]=4 43 B13R1.28 ICCCCOCc1ccccc1 Amb26863429 [1,0,0,0,0,0|2,1,0]=4 44 B13R1.28 N#CCCNCCc1ccccc1 Amb2693162 [1,0,0,0,0,0|1,0,1]=3 45 B13R1.28 N#CCCNOCc1ccccc1 Amb27165442 [1,0,0,0,0,0|2,0,1]=4 46 B13R1.28 N#CCCOCCc1ccccc1 Amb9208575 [1,0,0,0,0,0|2,0,1]=4 47 B13R1.28 NCCCCCCc1ccccc1 Amb17233312 [1,0,0,0,0,0|2,0,0]=3 48 B13R1.28 NCCCCCCc1ccccn1 Amb18564087 [1,0,0,0,0,0|3,0,0]=4 49 B13R1.28 NCCCCCOc1ccccc1 Amb17233606 [1,0,0,0,0,0|3,0,0]=4 50 B13R1.28 NCCCCCSc1ccccc1 Amb18321384 [1,0,0,0,0,0|3,0,0]=4 51 B13R1.28 NCCCCCSc1ccccc1 Amb32662100 [1,0,0,0,0,0|3,0,0]=4 52 B13R1.28 NCCCCOCc1ccccc1 Amb6246928 [1,0,0,0,0,0|3,0,0]=4 53 B13R1.28 NCCCCSCc1ccccc1 Amb9391663 [1,0,0,0,0,0|3,0,0]=4 54 B13R1.28 NCCCNCCc1ccccc1 Amb17315277 [1,0,0,0,0,0|1,0,0]=2 55 B13R1.28 NCCCOCCc1ccccc1 Amb7764729 [1,0,0,0,0,0|2,0,0]=3 56 B13R1.28 NCCNCCCc1ccccc1 Amb17091041 [1,0,0,0,0,0|3,0,0]=4 57 B13R1.28 OCCCCCCc1ccccc1 Amb8515378 [1,0,0,0,0,0|2,0,0]=3 58 B13R1.28 OCCCCCCc1ccccn1 Amb32430377 [1,0,0,0,0,0|3,0,0]=4 59 B13R1.28 OCCCCCCc1cccnc1 Amb9805461 [1,0,0,0,0,0|3,0,0]=4 60 B13R1.28 OCCCCNCc1ccccc1 Amb6334835 [1,0,0,0,0,0|3,0,0]=4 61 B13R1.28 OCCCCOCc1ccccc1 Amb3939246 [1,0,0,0,0,0|3,0,0]=4 62 B13R1.28 OCCCNCCc1ccccc1 Amb6733591 [1,0,0,0,0,0|1,0,0]=2 63 B13R1.28 OCCCOCCc1ccccc1 Amb10609118 [1,0,0,0,0,0|2,0,0]=3 64 B13R1.28 OCCNCCCc1ccccc1 Amb7757048 [1,0,0,0,0,0|3,0,0]=4 65 B13R1.28 OCCSCCCc1ccccc1 Amb9362854 [1,0,0,0,0,0|3,0,0]=4 66 B13R1.44 C#CCNC(C)Cc1ccccc1 Amb17618673 [1,0,0,0,0,0|0,0,2]=3 67 B13R1.44 C#CCNC(C)Cc1ccccc1 Amb33549982 [1,0,0,0,0,0|0,0,2]=3 68 B13R1.44 C=CCCC(C)Nc1ccccc1 Amb33363053 [1,0,0,0,0,0|2,0,1]=4 69 B13R1.44 C=CCCN(C)Cc1ccccc1 Amb27651523 [1,0,0,0,0,0|2,0,1]=4 70 B13R1.44 CC(CCC#N)Nc1ccccc1 Amb35661403 [1,0,0,0,0,0|2,0,1]=4 71 B13R1.44 CC(CCCO)Nc1ccccc1 Amb21984572 [1,0,0,0,0,0|2,0,0]=3 72 B13R1.44 CCCCC(=O)Cc1ccccc1 Amb3940684 [1,0,0,0,0,0|2,0,1]=4 73 B13R1.44 CCCCC(O)Cc1ccccc1 Amb4034774 [1,0,0,0,0,0|2,0,0]=3 74 B13R1.44 CCCCC(O)Cc1ccccn1 Amb10573728 [1,0,0,0,0,0|3,0,0]=4 75 B13R1.44 CCCCN(C)Cc1ccccc1 Amb1828371 [1,0,0,0,0,0|2,0,0]=3 76 B13R1.44 CCCNC(=N)Nc1ccccc1 Amb18184209 [1,0,0,0,0,0|2,0,1]=4 77 B13R1.44 CCCNC(=O)Nc1ccccc1 Amb1233730 [1,0,0,0,0,0|2,0,1]=4 78 B13R1.44 CCCNC(C)Cc1ccccc1 Amb18180702 [1,0,0,0,0,0|0,0,0]=1 79 B13R1.44 CCCOC(=O)Cc1ccccc1 Amb9242897 [1,0,0,0,0,0|2,0,1]=4 80 B13R1.44 CN(CCC#N)Cc1ccccc1 Amb577252 [1,0,0,0,0,0|2,0,1]=4 81 B13R1.44 CN(CCCBr)Cc1ccccc1 Amb27235848 [1,0,0,0,0,0|1,1,0]=3 82 B13R1.44 CN(CCCCl)Cc1ccccc1 Amb17337263 [1,0,0,0,0,0|1,0,0]=2 83 B13R1.44 CN(CCCCl)Cc1ccncc1 Amb17337375 [1,0,0,0,0,0|2,0,0]=3 84 B13R1.44 CN(CCCN)Cc1ccccc1 Amb22001972 [1,0,0,0,0,0|2,0,0]=3 85 B13R1.44 CN(CCCN)Cc1ccccc1 Amb2371220 [1,0,0,0,0,0|2,0,0]=3 86 B13R1.44 CN(CCCN)Cc1ccccn1 Amb6670573 [1,0,0,0,0,0|3,0,0]=4 87 B13R1.44 CN(CCCN)Cc1cccnc1 Amb6670574 [1,0,0,0,0,0|3,0,0]=4 88 B13R1.44 CN(CCCN)Cc1ccncc1 Amb6670559 [1,0,0,0,0,0|3,0,0]=4 89 B13R1.44 CN(CCCO)Cc1ccccc1 Amb9246592 [1,0,0,0,0,0|2,0,0]=3 90 B13R1.44 CN(CCON)Cc1ccccc1 Amb17104856 [1,0,0,0,0,0|3,0,0]=4 91 B13R1.44 CN(C\C=C/Cl)Cc1ccccc1 Amb28458298 [1,0,0,0,0,0|1,0,2]=4 92 B13R1.44 CNCCN(C)Cc1ccccc1 Amb6715270 [1,0,0,0,0,0|3,0,0]=4 93 B13R1.44 C\C(=C/c1ccccc1)CCCBr Amb33381474 [1,0,0,0,0,0|0,1,2]=4 94 B13R1.44 C\C(=C/c1ccccc1)CCCN Amb32951765 [1,0,0,0,0,0|1,0,2]=4 95 B13R1.44 C\C(=C/c1ccccc1)CCCO Amb33081745 [1,0,0,0,0,0|1,0,2]=4 96 B13R1.44 C\C(=C/c1ccccc1)CCCS Amb33381252 [1,0,0,0,0,0|1,0,2]=4 97 B13R1.44 NC(CCCO)Cc1ccccc1 Amb9782428 [1,0,0,0,0,0|2,0,0]=3 98 B13R1.44 NCCNC(=O)Cc1ccccc1 Amb33527053 [1,0,0,0,0,0|2,0,1]=4 99 B13R1.44 NCCNC(=O)Cc1ccccc1 Amb6245780 [1,0,0,0,0,0|2,0,1]=4 100 B13R1.44 O=C(CCCCl)Nc1ccccc1 Amb1125144 [1,0,0,0,0,0|2,0,1]=4 101 B13R1.44 O=C(Cc1ccccc1)NCCCl Amb2429404 [1,0,0,0,0,0|1,0,1]=3 102 B13R1.44 O=C(Cc1ccccc1)NCCO Amb2437031 [1,0,0,0,0,0|2,0,1]=4 103 B13R1.44 O=C(Cc1ccccc1)OCCCl Amb24065572 [1,0,0,0,0,0|2,0,1]=4 104 B13R1.44 O=C(NCCCl)Nc1ccccc1 Amb4022682 [1,0,0,0,0,0|2,0,1]=4 105 B15R1.83 CCCCCCN(C)Cc1ccccc1 Amb27767045 [0,1,0,0,0,0|3,0,0]=4 106 B15R1.83 CCCCNC\C(C)=C\c1ccccc1 Amb20673564 [0,1,0,0,0,0|1,0,2]=4 107 B15R1.83 CCCCNC\C(C)=C\c1ccccc1 Amb20673566 [0,1,0,0,0,0|1,0,2]=4 108 B15R1.83 CN(CCCCC#N)Cc1ccccc1 Amb22340408 [0,1,0,0,0,0|3,0,0]=4 109 B15R1.83 CN(CCCCCCl)Cc1ccccc1 Amb27877427 [0,1,0,0,0,0|2,0,0]=3 110 B15R1.83 CN(CCCCCO)Cc1ccccc1 Amb17338912 [0,1,0,0,0,0|3,0,0]=4 111 B15R1.83 CN(CCOCCCl)Cc1ccccc1 Amb27632103 [0,1,0,0,0,0|2,0,0]=3 112 B15R1.83 CN(CCSCCN)Cc1ccccc1 Amb17108978 [0,1,0,0,0,0|3,0,0]=4 113 B15R1.93 CC(NCCCO)C(O)c1ccccc1 Amb18604506 [0,1,0,0,0,0|1,0,0]=2 114 B15R1.93 CC(SCCCN)C(=O)c1ccccc1 Amb17500709 [0,1,0,0,0,0|2,0,1]=4 115 B15R1.93 CC(SCCCO)C(=O)c1ccccc1 Amb17502853 [0,1,0,0,0,0|2,0,1]=4 116 B15R1.93 CCCCNC(=O)C(Cl)c1ccccc1 Amb8824964 [0,1,0,0,0,0|2,0,1]=4 117 B15R1.93 CCCCNC(C)C(O)c1ccccc1 Amb18604512 [0,1,0,0,0,0|1,0,0]=2 118 B15R1.93 CCCCSC(C)C(=O)c1ccccc1 Amb9667949 [0,1,0,0,0,0|2,0,1]=4 119 B15R1.93 COCCNC(C)C(O)c1ccccc1 Amb18604524 [0,1,0,0,0,0|2,0,0]=3 120 B15R1.93 O=C(NCCCO)C(Cl)c1ccccc1 Amb17324272 [0,1,0,0,0,0|2,0,1]=4 121 B15R1.128 CC(Cc1ccc(N)cc1)NCCCO Amb18550312 [0,1,0,0,0,0|1,0,0]=2 122 B15R1.128 CCCCNC(=O)Cc1ccc(N)cc1 Amb6247768 [0,1,0,0,0,0|2,0,1]=4 123 B15R1.128 CCCCNC(C)Cc1ccc(Br)cc1 Amb9561644 [0,1,0,0,0,0|1,0,0]=2 124 B15R1.128 CCCCNC(C)Cc1ccc(C)cc1 Amb18053926 [0,1,0,0,0,0|1,0,0]=2 125 B15R1.128 CCCCNC(C)Cc1ccc(N)cc1 Amb18050262 [0,1,0,0,0,0|1,0,0]=2 126 B15R1.128 CN(CCCCBr)Cc1ccc(F)cc1 Amb20669057 [0,1,0,0,0,0|2,1,0]=4 127 B15R1.128 COCCNC(C)Cc1ccc(Br)cc1 Amb18553086 [0,1,0,0,0,0|2,0,0]=3 128 B15R1.128 COCCNC(C)Cc1ccc(C)cc1 Amb18553082 [0,1,0,0,0,0|2,0,0]=3 129 B15R1.128 COCCNC(C)Cc1ccc(Cl)cc1 Amb18553087 [0,1,0,0,0,0|2,0,0]=3 130 B15R1.128 COCCNC(C)Cc1ccc(N)cc1 Amb18050738 [0,1,0,0,0,0|2,0,0]=3 131 B15R1.129 CCCCNC(=O)Cc1cccc(N)c1 Amb8426832 [0,1,0,0,0,0|2,0,1]=4 132 B15R1.129 CCCCNC(C)Cc1cccc(Br)c1 Amb18053952 [0,1,0,0,0,0|1,0,0]=2 133 B15R1.129 COCCNC(C)Cc1cccc(Br)c1 Amb18054021 [0,1,0,0,0,0|2,0,0]=3 134 B15R1.551 CN(Cc1ccccc1)C(=O)CCCO Amb17239267 [0,1,0,0,0,0|3,0,0]=4 135 B15R1.551 CN(Cc1ccccc1)C(=O)CCCS Amb27853634 [0,1,0,0,0,0|3,0,0]=4 136 B15R1.551 CN(Cc1ccccn1)C(=O)CCCCl Amb17330220 [0,1,0,0,0,0|3,0,0]=4 137 B15R1.809 CC(CCN)CN(C)Cc1ccccc1 Amb17338609 [0,1,0,0,0,0|3,0,0]=4 138 B15R1.809 CC(Cc1ccccc1)NC(=O)CCBr Amb17327276 [0,1,0,0,0,0|0,1,1]=3 139 B15R1.809 CC(Cc1ccccn1)NC(=O)CCBr Amb17324947 [0,1,0,0,0,0|1,1,1]=4 140 B15R1.809 CC(Cc1cccnc1)NC(=O)CCCl Amb17331763 [0,1,0,0,0,0|1,0,1]=3 141 B15R1.809 CC(Cc1ccncc1)NC(=O)CCBr Amb17323262 [0,1,0,0,0,0|1,1,1]=4 142 B15R1.809 CCCC(N)CN(C)Cc1ccccc1 Amb9515236 [0,1,0,0,0,0|3,0,0]=4 143 B15R1.809 CN(Cc1ccccc1)CC(O)CCN Amb18568574 [0,1,0,0,0,0|3,0,0]=4 144 B15R1.964 CC(CN)CCN(C)Cc1ccccc1 Amb17338596 [0,1,0,0,0,0|3,0,0]=4 145 B15R1.964 CCC(N)CCN(C)Cc1ccccc1 Amb27793972 [0,1,0,0,0,0|3,0,0]=4 146 B15R1.1035 CCC(Cc1ccccc1)NCCCO Amb33363068 [0,1,0,0,0,0|1,0,0]=2 147 B15R1.1035 CCC(Cc1ccccc1)NCCOC Amb33363066 [0,1,0,0,0,0|2,0,0]=3 148 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO Amb9243645 [0,1,0,0,0,0|2,0,1]=4 149 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCCl Amb6385625 [0,1,0,0,0,0|2,0,0]=3 150 B15R2.15 CCC1CCC(Nc2ccccc2)C1 Amb27444014 [0,0,0,1,0,0|3,0,0]=4 151 B15R2.15 CNC1COC(Cc2ccccc2)C1 Amb35726791 [0,0,0,1,0,0|3,0,0]=4 152 B15R2.15 ClCC1CC(Cc2ccccc2)=NO1 Amb23453846 [0,0,0,1,0,0|1,0,2]=4 153 B15R2.15 ClCC1CCN(Cc2ccccc2)C1 Amb15701503 [0,0,0,1,0,0|2,0,0]=3 154 B15R2.15 ClCC1CCN(Cc2ccccc2)C1 Amb21959762 [0,0,0,1,0,0|2,0,0]=3 155 B15R2.15 NCC1CCC(Cc2ccccc2)O1 Amb17595001 [0,0,0,1,0,0|3,0,0]=4 156 B15R2.15 NCC1CCN(Cc2ccccc2)C1 Amb33378985 [0,0,0,1,0,0|3,0,0]=4 157 B15R2.15 NCC1CCN(Cc2ccccc2)C1 Amb9719123 [0,0,0,1,0,0|3,0,0]=4 158 B15R2.15 NC[C@@H]1CCN(Cc2ccccc2)C1 Amb8396674 [0,0,0,1,0,0|3,0,0]=4 159 B15R2.15 NC[C@@H]1CC[C@H](Cc2ccccc2)O1 Amb32675071 [0,0,0,1,0,0|3,0,0]=4 160 B15R2.15 NC[C@H]1CCN(Cc2ccccc2)C1 Amb8396675 [0,0,0,1,0,0|3,0,0]=4 161 B15R2.15 OCC1CCC(Cc2ccccc2)O1 Amb28400887 [0,0,0,1,0,0|3,0,0]=4 162 B15R2.15 OCC1CCN(Cc2ccccc2)C1 Amb2695591 [0,0,0,1,0,0|3,0,0]=4 163 B15R2.15 OCC1CNC(Cc2ccccc2)C1 Amb28051536 [0,0,0,1,0,0|1,0,0]=2 164 B15R2.15 OCC1COC(Cc2ccccc2)O1 Amb28043307 [0,0,0,1,0,0|3,0,0]=4 165 B15R2.15 OC[C@@H]1CCN(Cc2ccccc2)C1 Amb10067142 [0,0,0,1,0,0|3,0,0]=4 166 B15R2.15 OC[C@@H]1C[C@@H](Cc2ccccc2)CN1 Amb28131377 [0,0,0,1,0,0|3,0,0]=4 167 B15R2.15 OC[C@H]1CCN(Cc2ccccc2)C1 Amb8630481 [0,0,0,1,0,0|3,0,0]=4 168 B15R2.31 BrC1CCCN(Cc2ccccc2)C1 Amb22227863 [0,0,0,1,0,0|2,1,0]=4 169 B15R2.31 BrC1CCOC(Cc2ccccc2)C1 Amb28343665 [0,0,0,1,0,0|1,1,0]=3 170 B15R2.31 Br[C@H]1CCCN(Cc2ccccc2)C1 Amb22225473 [0,0,0,1,0,0|2,1,0]=4 171 B15R2.31 C=C1CCNC(Cc2ccccc2)C1 Amb18649678 [0,0,0,1,0,0|1,0,1]=3 172 B15R2.31 CC1CC(Cc2ccccc2)CCN1 Amb26494457 [0,0,0,1,0,0|3,0,0]=4 173 B15R2.31 CC1CC(Cc2ccccc2)CCN1 Amb33552550 [0,0,0,1,0,0|3,0,0]=4 174 B15R2.31 CC1CCCC(Cc2ccccc2)N1 Amb28146808 [0,0,0,1,0,0|3,0,0]=4 175 B15R2.31 CC1CCCC(Nc2ccccc2)C1 Amb33527379 [0,0,0,1,0,0|3,0,0]=4 176 B15R2.31 CC1CCCC(Oc2ccccc2)C1 Amb28197984 [0,0,0,1,0,0|3,0,0]=4 177 B15R2.31 CC1CCNC(Cc2ccncc2)C1 Amb27229703 [0,0,0,1,0,0|2,0,0]=3 178 B15R2.31 CC1CCSC(Cc2ccccc2)N1 Amb27754663 [0,0,0,1,0,0|3,0,0]=4 179 B15R2.31 CN1CCNC(Cc2ccccc2)C1 Amb18564794 [0,0,0,1,0,0|2,0,0]=3 180 B15R2.31 CN1CCNC(Cc2ccccn2)C1 Amb18565005 [0,0,0,1,0,0|3,0,0]=4 181 B15R2.31 CN1CCNC(Cc2cccnc2)C1 Amb18565009 [0,0,0,1,0,0|3,0,0]=4 182 B15R2.31 CN1CCNC(Cc2ccncc2)C1 Amb18565013 [0,0,0,1,0,0|3,0,0]=4 183 B15R2.31 CN1CCN[C@@H](Cc2ccccc2)C1 Amb27791815 [0,0,0,1,0,0|2,0,0]=3 184 B15R2.31 CN1CCN[C@H](Cc2ccccc2)C1 Amb25381177 [0,0,0,1,0,0|2,0,0]=3 185 B15R2.31 C[C@H]1CCCN(Cc2ccccc2)C1 Amb32412706 [0,0,0,1,0,0|3,0,0]=4 186 B15R2.31 ClC1CCCC(Nc2ccccn2)C1 Amb30026860 [0,0,0,1,0,0|3,0,0]=4 187 B15R2.31 ClC1CCCC(Nc2ccncc2)C1 Amb29874868 [0,0,0,1,0,0|3,0,0]=4 188 B15R2.31 Cl[C@@H]1CCCN(Cc2ccccc2)C1 Amb22225144 [0,0,0,1,0,0|2,0,0]=3 189 B15R2.31 Cl[C@H]1CCCN(Cc2ccccc2)C1 Amb22225475 [0,0,0,1,0,0|2,0,0]=3 190 B15R2.31 FC1CCCN(Cc2ccccc2)C1 Amb13888991 [0,0,0,1,0,0|2,1,0]=4 191 B15R2.31 F[C@@H]1CCCN(Cc2ccccc2)C1 Amb25841751 [0,0,0,1,0,0|2,1,0]=4 192 B15R2.31 I[C@@H]1CCCN(Cc2ccccc2)C1 Amb22225148 [0,0,0,1,0,0|2,1,0]=4 193 B15R2.31 I[C@H]1CCCN(Cc2ccccc2)C1 Amb22225478 [0,0,0,1,0,0|2,1,0]=4 194 B15R2.31 NC1CCCC(Cc2ccccn2)C1 Amb28411574 [0,0,0,1,0,0|3,0,0]=4 195 B15R2.31 NC1CCCC(Cc2ccncc2)C1 Amb27488149 [0,0,0,1,0,0|3,0,0]=4 196 B15R2.31 NC1CCCC(Oc2ccccc2)C1 Amb27240481 [0,0,0,1,0,0|3,0,0]=4 197 B15R2.31 NC1CCCN(Cc2ccccc2)C1 Amb19375505 [0,0,0,1,0,0|3,0,0]=4 198 B15R2.31 NC1CCCN(Cc2ccccc2)C1 Amb2695446 [0,0,0,1,0,0|3,0,0]=4 199 B15R2.31 NC1CCCN(Cc2ccccc2)C1 Amb6760461 [0,0,0,1,0,0|3,0,0]=4 200 B15R2.31 NC1CNCC(Cc2ccccc2)C1 Amb28121851 [0,0,0,1,0,0|3,0,0]=4 201 B15R2.31 N[C@@H]1CCCN(Cc2ccccc2)C1 Amb10068361 [0,0,0,1,0,0|3,0,0]=4 202 B15R2.31 N[C@@H]1CNCC(Cc2ccccc2)C1 Amb28410765 [0,0,0,1,0,0|3,0,0]=4 203 B15R2.31 N[C@H]1CCCN(Cc2ccccc2)C1 Amb5718676 [0,0,0,1,0,0|3,0,0]=4 204 B15R2.31 N[C@H]1CCCN(Cc2ccccc2)C1 Amb8627951 [0,0,0,1,0,0|3,0,0]=4 205 B15R2.31 O=C1CCNC(Cc2ccccc2)C1 Amb28457239 [0,0,0,1,0,0|1,0,1]=3 206 B15R2.31 O=C1CCOC(Cc2ccccc2)C1 Amb27746791 [0,0,0,1,0,0|2,0,1]=4 207 B15R2.31 OC1CC(Cc2ccccc2)CCO1 Amb28350051 [0,0,0,1,0,0|3,0,0]=4 208 B15R2.31 OC1CCCN(Cc2ccccc2)C1 Amb6571994 [0,0,0,1,0,0|3,0,0]=4 209 B15R2.31 OC1CCCN(Cc2ccccc2)C1 Amb663402 [0,0,0,1,0,0|3,0,0]=4 210 B15R2.31 OC1CCNC(Cc2ccccc2)C1 Amb27958553 [0,0,0,1,0,0|1,0,0]=2 211 B15R2.31 O[C@@H]1CCCN(Cc2ccccc2)C1 Amb8387000 [0,0,0,1,0,0|3,0,0]=4 212 B15R2.31 O[C@@H]1CCO[C@H](Cc2ccccc2)C1 Amb27854204 [0,0,0,1,0,0|2,0,0]=3 213 B15R2.31 O[C@H]1CCCN(Cc2ccccc2)C1 Amb8628463 [0,0,0,1,0,0|3,0,0]=4 214 B15R2.31 O[C@H]1CCO[C@@H](Cc2ccccc2)C1 Amb28053794 [0,0,0,1,0,0|2,0,0]=3 215 B15R2.31 SC1CCCN(Cc2ccccc2)C1 Amb32663588 [0,0,0,1,0,0|3,0,0]=4 216 B15R2.31 SC1CCCN(Cc2ccccc2)C1 Amb8838973 [0,0,0,1,0,0|3,0,0]=4 217 B15R2.50 NCCC1CN(Cc2ccccc2)C1 Amb22297156 [0,0,0,1,0,0|3,0,0]=4 218 B15R2.50 SCCC1CN(Cc2ccccc2)C1 Amb22298489 [0,0,0,1,0,0|3,0,0]=4 219 B15R2.54 BrC1CCCCCC1c2ccccc2 Amb28456389 [0,0,0,1,0,0|3,0,0]=4 220 B15R2.54 CC1CCCCNC1c2ccccc2 Amb27398689 [0,0,0,1,0,0|2,0,0]=3 221 B15R2.54 CC1COCCNC1c2ccccc2 Amb28461554 [0,0,0,1,0,0|3,0,0]=4 222 B15R2.54 ClC1CCCCCC1c2ccccc2 Amb27951894 [0,0,0,1,0,0|3,0,0]=4 223 B15R2.54 Cl[C@@H]1CCCCC[C@@H]1c2ccccc2 Amb28287300 [0,0,0,1,0,0|3,0,0]=4 224 B15R2.54 NC1CCCCCC1c2ccccc2 Amb19072716 [0,0,0,1,0,0|3,0,0]=4 225 B15R2.54 N[C@@H]1CCCCC[C@@H]1c2ccccc2 Amb28320701 [0,0,0,1,0,0|3,0,0]=4 226 B15R2.54 N[C@@H]1CCCCC[C@H]1c2ccccc2 Amb28250169 [0,0,0,1,0,0|3,0,0]=4 227 B15R2.54 O=C1NCCCCC1c2ccccc2 Amb24056374 [0,0,0,1,0,0|2,0,1]=4 228 B15R2.54 O=C1NCCCNC1c2ccccc2 Amb24498231 [0,0,0,1,0,0|2,0,1]=4 229 B15R2.54 O=C1NCCCN[C@@H]1c2ccccc2 Amb32719910 [0,0,0,1,0,0|2,0,1]=4 230 B15R2.54 O=C1NCCCN[C@H]1c2ccccc2 Amb32719934 [0,0,0,1,0,0|2,0,1]=4 231 B15R2.54 OC1CCCCCC1c2ccccc2 Amb4035334 [0,0,0,1,0,0|3,0,0]=4 232 B15R2.54 O[C@@H]1CCCCC[C@H]1c2ccccc2 Amb25284409 [0,0,0,1,0,0|3,0,0]=4 233 B15R2.54 O[C@H]1CCCCC[C@@H]1c2ccccc2 Amb27851492 [0,0,0,1,0,0|3,0,0]=4 234 B15R2.64 CC(Cc1ccccc1)C2CCCN2 Amb27660900 [0,0,0,1,0,0|2,0,0]=3 235 B15R2.64 CC(Cc1ccccc1)C2CCNC2 Amb28293184 [0,0,0,1,0,0|3,0,0]=4 236 B15R2.64 CC(Nc1ccccc1)C2CCCC2 Amb19072722 [0,0,0,1,0,0|3,0,0]=4 237 B15R2.64 CC(Nc1ccccc1)C2CCCN2 Amb27587994 [0,0,0,1,0,0|3,0,0]=4 238 B15R2.64 CC(Oc1ccccc1)C2CCCN2 Amb4135007 [0,0,0,1,0,0|3,0,0]=4 239 B15R2.64 CC(Sc1ccccc1)C2CCCN2 Amb35606464 [0,0,0,1,0,0|3,0,0]=4 240 B15R2.64 C[C@@H](Nc1ccccc1)[C@@H]2CCCN2 Amb27209542 [0,0,0,1,0,0|3,0,0]=4 241 B15R2.64 FC(Cc1ccccc1)C2CCCN2 Amb28289679 [0,0,0,1,0,0|3,0,0]=4 242 B15R2.64 N=C(Cc1ccccc1)N2CCCC2 Amb23447112 [0,0,0,1,0,0|2,0,1]=4 243 B15R2.64 NC(Cc1ccccc1)C2CCCC2 Amb17139238 [0,0,0,1,0,0|3,0,0]=4 244 B15R2.64 NC(Cc1ccccc1)C2CCCC2 Amb19373445 [0,0,0,1,0,0|3,0,0]=4 245 B15R2.64 O=C(Cc1ccccc1)N2CCCN2 Amb27879894 [0,0,0,1,0,0|2,0,1]=4 246 B15R2.64 OC(Cc1ccccc1)C2CCCC2 Amb17139284 [0,0,0,1,0,0|3,0,0]=4 247 B15R2.64 OC(Cc1ccccc1)C2CCCO2 Amb27209486 [0,0,0,1,0,0|3,0,0]=4 248 B15R2.64 OC(Cc1ccccc1)[C@@H]2CCCN2 Amb35664074 [0,0,0,1,0,0|3,0,0]=4 249 B15R2.64 OC(Cc1ccccc1)[C@H]2CCCN2 Amb29891706 [0,0,0,1,0,0|3,0,0]=4 250 B15R2.405 CC1(Cc2ccccc2)NCCC1=O Amb27196734 [0,0,0,1,0,0|1,0,1]=3 251 B15R2.405 CC1(Nc2ccccc2)CCCC1O Amb27268573 [0,0,0,1,0,0|3,0,0]=4 252 B15R2.405 CC1CNCC1(C)Cc2ccccc2 Amb28056425 [0,0,0,1,0,0|3,0,0]=4 253 B15R2.405 OC1CCCC1(O)Cc2ccccc2 Amb27977963 [0,0,0,1,0,0|3,0,0]=4 254 B15R2.491 NC1CC1NC(=O)Cc2ccccc2 Amb9457342 [0,0,0,1,0,0|2,0,1]=4 255 B15R2.541 CC1NCCN(C)C1c2ccccc2 Amb27183482 [0,0,0,1,0,0|2,0,0]=3 256 B15R2.541 CN1CCCC(N)C1c2ccccc2 Amb27239686 [0,0,0,1,0,0|3,0,0]=4 257 B15R2.541 CN1CCCC(O)C1c2ccccc2 Amb28294250 [0,0,0,1,0,0|3,0,0]=4 258 B15R2.541 CN1CCC[C@H](N)[C@H]1c2ccccc2 Amb27427715 [0,0,0,1,0,0|3,0,0]=4 259 B15R2.541 NC1CCCC(O)C1c2ccccc2 Amb27645221 [0,0,0,1,0,0|3,0,0]=4 260 B15R2.541 OC1CCCC(O)C1c2ccccc2 Amb27598453 [0,0,0,1,0,0|3,0,0]=4 261 B15R2.851 C#CCN1NC1(C)Cc2ccccc2 Amb27603348 [0,0,0,1,0,0|2,0,1]=4 262 B15R2.1122 CN(Cc1ccccc1)C2CCC2O Amb33041090 [0,0,0,1,0,0|3,0,0]=4 263 B15R2.1262 CCCNCC1CC1c2ccccc2 Amb19072724 [0,0,0,1,0,0|3,0,0]=4 264 B15R2.1262 OCCNCC1CC1c2ccccc2 Amb32423361 [0,0,0,1,0,0|3,0,0]=4 265 B15R2.1435 CC1Cc2ccccc2C1NCCF Amb27810175 [0,0,0,1,0,0|2,1,0]=4 266 B15R2.1435 CC1Cc2ccccc2C1NCCO Amb28205745 [0,0,0,1,0,0|3,0,0]=4 267 B15R2.1435 CC1Cc2ccccc2N1CCCCl Amb17339429 [0,0,0,1,0,0|0,0,0]=1 268 B15R2.1435 CC1Cc2ccccc2N1CCCN Amb9712209 [0,0,0,1,0,0|1,0,0]=2 269 B15R2.1435 CCCCN1C(=O)Cc2ccccc21 Amb2720641 [0,0,0,1,0,0|2,0,1]=4 270 B15R2.1435 CCCCn1c(C)cc2ccccc21 Amb8390326 [0,0,0,1,0,0|1,0,2]=4 271 B15R2.1435 CNCCN1c2ccccc2CC1C Amb6715358 [0,0,0,1,0,0|2,0,0]=3 272 B15R2.1435 Cc1cc2ccccc2n1CCCN Amb6356693 [0,0,0,1,0,0|1,0,2]=4 273 B15R2.1435 Cc1cc2ccccc2n1CCCO Amb7089017 [0,0,0,1,0,0|1,0,2]=4 274 B15R2.1435 Cc1nc2ccccc2n1CCCCl Amb6252184 [0,0,0,1,0,0|1,0,1]=3 275 B15R2.1435 Cc1nc2ccccc2n1CCCF Amb28280329 [0,0,0,1,0,0|1,1,1]=4 276 B15R2.1435 Cc1nc2ccccc2n1CCCN Amb6660012 [0,0,0,1,0,0|2,0,1]=4 277 B15R2.1435 Cc1nc2ccccc2n1CCCO Amb8041914 [0,0,0,1,0,0|2,0,1]=4 278 B15R2.1435 Cc1sc2ccccc2c1CCCCl Amb27438660 [0,0,0,1,0,0|2,0,1]=4 279 B15R2.1435 FC1Cc2ccccc2C1OCCCl Amb27257268 [0,0,0,1,0,0|3,0,0]=4 280 B15R2.1435 F[C@@H]1Cc2ccccc2[C@@H]1OCCCl Amb27195604 [0,0,0,1,0,0|3,0,0]=4 281 B15R2.1435 F[C@H]1Cc2ccccc2[C@@H]1OCCCl Amb27186910 [0,0,0,1,0,0|3,0,0]=4 282 B15R2.1435 O=C1Cc2ccccc2N1CCCBr Amb9209709 [0,0,0,1,0,0|1,1,1]=4 283 B15R2.1435 O=C1Nc2ccccc2N1CCCCl Amb19389422 [0,0,0,1,0,0|2,0,1]=4 284 B15R2.1435 O=C1Oc2ccccc2N1CCCCl Amb19514627 [0,0,0,1,0,0|2,0,1]=4 285 B15R2.1435 OCCC[C@H]1c2ccccc2C[C@H]1O Amb27206518 [0,0,0,1,0,0|3,0,0]=4 286 B15R2.2167 c1cc(CC2CCCCNC2)ccn1 Amb27197856 [0,0,0,1,0,0|3,0,0]=4 287 B15R2.2167 c1ccc(CC2CCCCCN2)nc1 Amb2237254 [0,0,0,1,0,0|2,0,0]=3 288 B15R2.2167 c1ccc(CC2CCCCNC2)cc1 Amb25167909 [0,0,0,1,0,0|2,0,0]=3 289 B15R2.2167 c1ccc(CC2CCCNCC2)cc1 Amb27629922 [0,0,0,1,0,0|3,0,0]=4 290 B15R2.2167 c1ccc(CC2COCCOC2)cc1 Amb26559424 [0,0,0,1,0,0|3,0,0]=4 291 B15R2.2167 c1ccc(CN2CCCCCC2)cc1 Amb1925686 [0,0,0,1,0,0|3,0,0]=4 292 B15R2.2167 c1ccc(NC2CCCCCC2)cc1 Amb6685075 [0,0,0,1,0,0|3,0,0]=4 293 B15R2.2167 c1ccc(NC2CCCCNC2)cc1 Amb25869964 [0,0,0,1,0,0|3,0,0]=4 294 B15R2.2167 c1ccc(OC2CCCCCC2)cc1 Amb27754766 [0,0,0,1,0,0|3,0,0]=4 295 B15R2.2167 c1ccc(OC2CCCCNC2)cc1 Amb17040624 [0,0,0,1,0,0|3,0,0]=4 296 B15R2.2167 c1ccc(SC2CCCCNC2)cc1 Amb17040638 [0,0,0,1,0,0|3,0,0]=4 297 B15R2.2167 c1ccc(\N=C2/CCCCCN2)cc1 Amb3993791 [0,0,0,1,0,0|2,0,1]=4 298 B15R2.2203 C#CCONC1Cc2ccccc2C1 Amb27662747 [0,0,0,1,0,0|2,0,1]=4 299 B15R2.2203 CCCCNC1Cc2ccccc2C1 Amb9373599 [0,0,0,1,0,0|1,0,0]=2 300 B15R2.2203 COCCNC1Cc2ccccc2C1 Amb9373553 [0,0,0,1,0,0|2,0,0]=3 301 B15R2.2203 ClCCCNc1nc2ccccc2o1 Amb28184249 [0,0,0,1,0,0|2,0,1]=4 302 B15R2.2203 NCCCCC1Cc2ccccc2C1 Amb32953585 [0,0,0,1,0,0|2,0,0]=3 303 B15R2.2203 NCCCCN1Cc2ccccc2C1 Amb17480609 [0,0,0,1,0,0|3,0,0]=4 304 B15R2.2203 NCCCOC1Cc2ccccc2C1 Amb33342309 [0,0,0,1,0,0|2,0,0]=3 305 B15R2.2203 O=CCCCC1Cc2ccccc2C1 Amb33342528 [0,0,0,1,0,0|2,0,1]=4 306 B15R2.2203 OCCCNC1Cc2ccccc2C1 Amb9373778 [0,0,0,1,0,0|1,0,0]=2 307 B15R2.2216 OCCC1CC(O)C1c2ccccc2 Amb27486377 [0,0,0,1,0,0|3,0,0]=4 308 B15R2.2280 CC1COC(CO)C1c2ccccc2 Amb28294130 [0,0,0,1,0,0|3,0,0]=4 309 B15R2.2280 CC1OCC(CO)C1c2ccccc2 Amb28400970 [0,0,0,1,0,0|2,0,0]=3 310 B15R2.2280 CN1CCC(CN)C1c2ccccc2 Amb19515136 [0,0,0,1,0,0|3,0,0]=4 311 B15R2.2280 CN1CCC(CN)C1c2ccccc2 Amb22713517 [0,0,0,1,0,0|3,0,0]=4 312 B15R2.2280 CN1CCC(CO)C1c2ccccc2 Amb22713502 [0,0,0,1,0,0|3,0,0]=4 313 B15R2.2280 CN1CC[C@@H](CO)[C@@H]1c2ccccc2 Amb27636886 [0,0,0,1,0,0|3,0,0]=4 314 B15R2.4392 CC1CC(CCN)c2ccccc2O1 Amb18818229 [0,0,0,1,0,0|3,0,0]=4 315 B15R2.4392 CC1Cc2ccccc2N(CCBr)C1 Amb27456783 [0,0,0,1,0,0|2,1,0]=4 316 B15R2.4392 CC1Cc2ccccc2N(CCN)C1 Amb25678304 [0,0,0,1,0,0|3,0,0]=4 317 B15R2.4392 CC1Cc2ccccc2N(CCO)C1 Amb27632136 [0,0,0,1,0,0|3,0,0]=4 318 B15R2.4392 C[C@H]1Cc2ncccc2[C@@H](CCO)C1 Amb27432281 [0,0,0,1,0,0|3,0,0]=4 319 B15R2.4392 C\C=C\C1NC(C)Cc2ccccc21 Amb27259519 [0,0,0,1,0,0|1,0,2]=4 320 B15R2.4815 CC1CCC(CN)c2ccccc2O1 Amb18818228 [0,0,0,1,0,0|3,0,0]=4 321 B15R2.4815 CCC1CNC(=O)Cc2ccccc21 Amb27983539 [0,0,0,1,0,0|2,0,1]=4 322 B15R2.4815 CCC1NCC(C)Cc2ccccc21 Amb27828447 [0,0,0,1,0,0|3,0,0]=4 323 B15R2.4815 CC[C@@H]1CN[C@@H](C)Cc2ccccc21 Amb27965431 [0,0,0,1,0,0|1,0,0]=2 324 B15R2.4815 CC[C@H]1CN[C@H](C)Cc2ccccc21 Amb28071179 [0,0,0,1,0,0|1,0,0]=2 325 B15R2.7956 CC1(Cc2ccccc2)CCCNC1 Amb27748302 [0,0,0,1,0,0|3,0,0]=4 326 B15R2.7956 CC1(Cc2ccccc2)CNCCO1 Amb26644633 [0,0,0,1,0,0|3,0,0]=4 327 B15R2.7956 CC1(Cc2ccccc2)NCCCS1 Amb28190693 [0,0,0,1,0,0|1,0,0]=2 328 B15R2.7956 C[C@@]1(Cc2ccccc2)CNCCN1 Amb27444134 [0,0,0,1,0,0|2,0,0]=3 329 B15R2.7956 C[N+]1(Cc2ccccc2)CCCCC1 Amb15690857 [0,0,0,1,0,0|3,0,0]=4 330 B15R2.7956 FC1(Cc2ccccc2)CCCCC1 Amb27816644 [0,0,0,1,0,0|3,0,0]=4 331 B15R2.7956 NC1(Cc2ccccc2)CCCCC1 Amb33038214 [0,0,0,1,0,0|3,0,0]=4 332 B15R2.7956 NC1(Cc2ccccc2)CCCCC1 Amb5737650 [0,0,0,1,0,0|3,0,0]=4 333 B15R2.7956 OC1(Cc2ccccc2)CCCCC1 Amb6358864 [0,0,0,1,0,0|3,0,0]=4 334 B15R2.7956 OC1(Cc2ccccc2)CCCCN1 Amb27232707 [0,0,0,1,0,0|2,0,0]=3 335 B13R1.24 C=CCCN[C@H](C)c1ccccc1 Amb33624938 [0,0,0,0,1,0|1,0,1]=3 336 B13R1.24 CC#CCN[C@H](C)c1ccccc1 Amb28119750 [0,0,0,0,1,0|1,0,2]=4 337 B13R1.24 CC(CNCCO)c1ccccc1 Amb1851160 [0,0,0,0,1,0|3,0,0]=4 338 B13R1.24 CC(NCCC#N)c1ccccc1 Amb6736425 [0,0,0,0,1,0|1,0,1]=3 339 B13R1.24 CC(NCCCN)c1ccccc1 Amb17315288 [0,0,0,0,1,0|1,0,0]=2 340 B13R1.24 CC(NCCCO)c1ccccc1 Amb4422879 [0,0,0,0,1,0|1,0,0]=2 341 B13R1.24 CC(NCCCO)c1ccccn1 Amb1071370 [0,0,0,0,1,0|2,0,0]=3 342 B13R1.24 CC(NCCCO)c1cccnc1 Amb1070102 [0,0,0,0,1,0|2,0,0]=3 343 B13R1.24 CC(NCCCO)c1ccncc1 Amb6356073 [0,0,0,0,1,0|2,0,0]=3 344 B13R1.24 CC(OCCC#N)c1ccccc1 Amb6259524 [0,0,0,0,1,0|2,0,1]=4 345 B13R1.24 CC(OCCCN)c1ccccc1 Amb9729503 [0,0,0,0,1,0|2,0,0]=3 346 B13R1.24 CC(SCCCN)c1ccccc1 Amb17500696 [0,0,0,0,1,0|2,0,0]=3 347 B13R1.24 CC([NH2+]CCCO)c1cccnc1 Amb4262407 [0,0,0,0,1,0|2,0,1]=4 348 B13R1.24 CCCCCC(N)c1ccccc1 Amb7764725 [0,0,0,0,1,0|3,0,0]=4 349 B13R1.24 CCCCCC(O)c1ccccc1 Amb9619574 [0,0,0,0,1,0|3,0,0]=4 350 B13R1.24 CCCCCC(S)c1ccccc1 Amb32788166 [0,0,0,0,1,0|3,0,0]=4 351 B13R1.24 CCCCNC(C)c1ccccc1 Amb33548283 [0,0,0,0,1,0|1,0,0]=2 352 B13R1.24 CCCCNC(C)c1ccccc1 Amb4313706 [0,0,0,0,1,0|1,0,0]=2 353 B13R1.24 CCCCNC(C)c1ccccn1 Amb6691018 [0,0,0,0,1,0|2,0,0]=3 354 B13R1.24 CCCCNC(C)c1cccnc1 Amb6691020 [0,0,0,0,1,0|2,0,0]=3 355 B13R1.24 CCCCNC(C)c1ccncc1 Amb6691019 [0,0,0,0,1,0|2,0,0]=3 356 B13R1.24 CCCNCC(C)c1ccccc1 Amb2119487 [0,0,0,0,1,0|3,0,0]=4 357 B13R1.24 CCCNCC(C)c1ccccc1 Amb6719090 [0,0,0,0,1,0|3,0,0]=4 358 B13R1.24 CN(CCCCN)c1ccccc1 Amb5782374 [0,0,0,0,1,0|3,0,0]=4 359 B13R1.24 CN(CCCCO)c1ccccc1 Amb9370155 [0,0,0,0,1,0|3,0,0]=4 360 B13R1.24 COCCNC(C)c1ccccc1 Amb6685616 [0,0,0,0,1,0|2,0,0]=3 361 B13R1.24 COCCNC(C)c1ccccn1 Amb6685634 [0,0,0,0,1,0|3,0,0]=4 362 B13R1.24 COCCNC(C)c1cccnc1 Amb6685636 [0,0,0,0,1,0|3,0,0]=4 363 B13R1.24 C\C(=C/CCCN)c1ccccc1 Amb18065585 [0,0,0,0,1,0|2,0,1]=4 364 B13R1.24 NCCCNC(=O)c1ccccc1 Amb33506255 [0,0,0,0,1,0|2,0,1]=4 365 B13R1.24 NCCCNC(=O)c1ccccc1 Amb6281166 [0,0,0,0,1,0|2,0,1]=4 366 B13R1.24 O=C(CCCCCl)c1ccccc1 Amb6301784 [0,0,0,0,1,0|2,0,1]=4 367 B13R1.24 O=C(NCCCCl)c1ccccc1 Amb3887000 [0,0,0,0,1,0|1,0,1]=3 368 B13R1.24 O=C(NCCCCl)c1cccnc1 Amb2125791 [0,0,0,0,1,0|2,0,1]=4 369 B13R1.24 O=C(NCCCO)c1ccccc1 Amb9243498 [0,0,0,0,1,0|2,0,1]=4 370 B13R1.24 O=C(OCCCCl)c1ccccc1 Amb24099970 [0,0,0,0,1,0|2,0,1]=4 371 B13R1.156 COCCNC(C)Cc1cccs1 Amb18054012 [0,0,0,0,1,0|3,0,0]=4 372 B15R1.78 C=CCCCC(C)NCc1ccccc1 Amb27767197 [0,0,0,0,0,1|2,0,1]=4 373 B15R1.78 CC(CCCCCl)NCc1ccccc1 Amb28346093 [0,0,0,0,0,1|1,0,0]=2 374 B15R1.78 CC(CCCCN)NCc1ccccc1 Amb28254223 [0,0,0,0,0,1|2,0,0]=3 375 B15R1.78 CC(CCc1ccccc1)NCCC#N Amb1805915 [0,0,0,0,0,1|1,0,1]=3 376 B15R1.78 CC(CCc1ccccc1)NCCCO Amb6733614 [0,0,0,0,0,1|1,0,0]=2 377 B15R1.78 CCCCCC(C)NCc1ccccn1 Amb6721508 [0,0,0,0,0,1|3,0,0]=4 378 B15R1.78 CCCCC[C@@H](C)NCc1ccccc1 Amb27774019 [0,0,0,0,0,1|2,0,0]=3 379 B15R1.78 CCCCNC(=O)CNc1ccccc1 Amb17140118 [0,0,0,0,0,1|2,0,1]=4 380 B15R1.78 CCCCNC(=O)OCc1ccccc1 Amb3988246 [0,0,0,0,0,1|2,0,1]=4 381 B15R1.78 CCCCNC(=S)NCc1ccccc1 Amb4292907 [0,0,0,0,0,1|2,0,1]=4 382 B15R1.78 CCCCNC(C)COc1ccccc1 Amb4022456 [0,0,0,0,0,1|1,0,0]=2 383 B15R1.78 CCCNCC(C)OCc1ccccc1 Amb27268156 [0,0,0,0,0,1|3,0,0]=4 384 B15R1.78 CCSCCC(C)NCc1ccccc1 Amb27484291 [0,0,0,0,0,1|3,0,0]=4 385 B15R1.78 COCCNC(C)CCc1ccccc1 Amb6685614 [0,0,0,0,0,1|2,0,0]=3 386 B15R1.78 COCCOC(C)OCc1ccccc1 Amb27446668 [0,0,0,0,0,1|3,0,0]=4 387 B15R1.78 N=C(NCCCO)NCc1ccccc1 Amb27767402 [0,0,0,0,0,1|2,0,1]=4 388 B15R1.78 NCCCNC(=O)OCc1ccccc1 Amb10844746 [0,0,0,0,0,1|2,0,1]=4 389 B15R1.78 NCCCNC(=O)OCc1ccccc1 Amb2719986 [0,0,0,0,0,1|2,0,1]=4 390 B15R1.78 O=C(NCCCBr)OCc1ccccc1 Amb10608829 [0,0,0,0,0,1|1,1,1]=4 391 B15R1.78 O=C(NCCCCl)OCc1ccccc1 Amb28343008 [0,0,0,0,0,1|1,0,1]=3 392 B15R1.78 O=C(NCCCF)OCc1ccccc1 Amb28197434 [0,0,0,0,0,1|1,1,1]=4 393 B15R1.78 O=C(NCCCI)OCc1ccccc1 Amb26471798 [0,0,0,0,0,1|1,1,1]=4 394 B15R1.78 O=C(NCCCO)OCc1ccccc1 Amb9273969 [0,0,0,0,0,1|2,0,1]=4 395 B15R1.78 OCCCNC(=S)NCc1ccccc1 Amb8698014 [0,0,0,0,0,1|2,0,1]=4 396 B15R1.78 [NH3+]CCCNC(=O)OCc1ccccc1 Amb22452694 [0,0,0,0,0,1|2,0,1]=4 397 B12R1.8 BrCCCCCc1ccccc1 Amb2685449 [2,0,0,0,0,0|0,1,0]=3 398 B12R1.8 BrCCCCOc1ccccc1 Amb2795770 [2,0,0,0,0,0|1,1,0]=4 399 B12R1.8 BrCCCCSc1ccccc1 Amb8855496 [2,0,0,0,0,0|1,1,0]=4 400 B12R1.8 BrCCCOCc1ccccc1 Amb2722973 [2,0,0,0,0,0|1,1,0]=4 401 B12R1.8 BrCCCSCc1ccccc1 Amb9305027 [2,0,0,0,0,0|1,1,0]=4 402 B12R1.8 BrCCOCCc1ccccc1 Amb9208563 [2,0,0,0,0,0|1,1,0]=4 403 B12R1.8 C#CCCCCc1ccccc1 Amb18116407 [2,0,0,0,0,0|1,0,1]=4 404 B12R1.8 C#CCCNCc1ccccc1 Amb26644765 [2,0,0,0,0,0|1,0,1]=4 405 B12R1.8 C#CCNCCc1ccccc1 Amb5262796 [2,0,0,0,0,0|0,0,2]=4 406 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [2,0,0,0,0,0|1,0,1]=4 407 B12R1.8 C=CCCNCc1ccccc1 Amb6384625 [2,0,0,0,0,0|1,0,1]=4 408 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [2,0,0,0,0,0|0,0,2]=4 409 B12R1.8 C=CCNCCc1ccccc1 Amb6683808 [2,0,0,0,0,0|0,0,2]=4 410 B12R1.8 CCCCCCc1ccccc1 Amb6613187 [2,0,0,0,0,0|1,0,0]=3 411 B12R1.8 CCCCCCc1ccccn1 Amb6357996 [2,0,0,0,0,0|2,0,0]=4 412 B12R1.8 CCCCCCc1cccnc1 Amb10807465 [2,0,0,0,0,0|2,0,0]=4 413 B12R1.8 CCCCCCc1ccncc1 Amb22235257 [2,0,0,0,0,0|2,0,0]=4 414 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [2,0,0,0,0,0|2,0,0]=4 415 B12R1.8 CCCCNCc1ccccc1 Amb2684625 [2,0,0,0,0,0|1,0,0]=3 416 B12R1.8 CCCCNCc1ccccn1 Amb20673556 [2,0,0,0,0,0|2,0,0]=4 417 B12R1.8 CCCCNCc1ccccn1 Amb2592505 [2,0,0,0,0,0|2,0,0]=4 418 B12R1.8 CCCCNCc1ccccn1 Amb6865336 [2,0,0,0,0,0|2,0,0]=4 419 B12R1.8 CCCCNCc1cccnc1 Amb20673559 [2,0,0,0,0,0|2,0,0]=4 420 B12R1.8 CCCCNCc1cccnc1 Amb6690982 [2,0,0,0,0,0|2,0,0]=4 421 B12R1.8 CCCCNCc1cccnc1 Amb6864497 [2,0,0,0,0,0|2,0,0]=4 422 B12R1.8 CCCCNCc1ccncc1 Amb20673560 [2,0,0,0,0,0|2,0,0]=4 423 B12R1.8 CCCCNCc1ccncc1 Amb6690985 [2,0,0,0,0,0|2,0,0]=4 424 B12R1.8 CCCCNCc1ccncc1 Amb6864523 [2,0,0,0,0,0|2,0,0]=4 425 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [2,0,0,0,0,0|0,0,0]=2 426 B12R1.8 CCCNCCc1ccccc1 Amb4358610 [2,0,0,0,0,0|0,0,0]=2 427 B12R1.8 CCCNCCc1ccccn1 Amb6357625 [2,0,0,0,0,0|1,0,0]=3 428 B12R1.8 CCCNCCc1ccncc1 Amb2592521 [2,0,0,0,0,0|1,0,0]=3 429 B12R1.8 CCCNCCc1ncccn1 Amb18798464 [2,0,0,0,0,0|2,0,0]=4 430 B12R1.8 CCCNOCc1ccccc1 Amb26553937 [2,0,0,0,0,0|1,0,0]=3 431 B12R1.8 CCCOCCc1ccccn1 Amb2694532 [2,0,0,0,0,0|2,0,0]=4 432 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [2,0,0,0,0,0|1,0,1]=4 433 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [2,0,0,0,0,0|2,0,0]=4 434 B12R1.8 CCNCCCc1ccccc1 Amb6247947 [2,0,0,0,0,0|2,0,0]=4 435 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [2,0,0,0,0,0|2,0,0]=4 436 B12R1.8 CNCCCCc1ccccc1 Amb8841760 [2,0,0,0,0,0|2,0,0]=4 437 B12R1.8 CNCCNCc1ccccc1 Amb9200691 [2,0,0,0,0,0|2,0,0]=4 438 B12R1.8 COCCNCc1ccccc1 Amb33387674 [2,0,0,0,0,0|2,0,0]=4 439 B12R1.8 COCCNCc1ccccc1 Amb6410960 [2,0,0,0,0,0|2,0,0]=4 440 B12R1.8 ClCC#CCCc1ccccc1 Amb27758730 [2,0,0,0,0,0|0,0,2]=4 441 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [2,0,0,0,0,0|0,0,0]=2 442 B12R1.8 ClCCCCOc1ccccc1 Amb3940274 [2,0,0,0,0,0|1,0,0]=3 443 B12R1.8 ClCCCCSc1ccccc1 Amb18331364 [2,0,0,0,0,0|1,0,0]=3 444 B12R1.8 ClCCCNCc1ccccc1 Amb10766327 [2,0,0,0,0,0|0,0,0]=2 445 B12R1.8 ClCCCNCc1ccccc1 Amb27857637 [2,0,0,0,0,0|0,0,0]=2 446 B12R1.8 ClCCCNCc1ccccn1 Amb20573480 [2,0,0,0,0,0|1,0,0]=3 447 B12R1.8 ClCCCNCc1cccnc1 Amb20573314 [2,0,0,0,0,0|1,0,0]=3 448 B12R1.8 ClCCCNCc1ccncc1 Amb20573340 [2,0,0,0,0,0|1,0,0]=3 449 B12R1.8 ClCCCNCc1ccncc1 Amb20623668 [2,0,0,0,0,0|1,0,0]=3 450 B12R1.8 ClCCCOCc1ccccc1 Amb6255314 [2,0,0,0,0,0|1,0,0]=3 451 B12R1.8 ClCCNOCc1ccccc1 Amb27659332 [2,0,0,0,0,0|1,0,0]=3 452 B12R1.8 ClCOCOCc1ccccc1 Amb27444693 [2,0,0,0,0,0|2,0,0]=4 453 B12R1.8 FCCCNCc1ccccc1 Amb27172983 [2,0,0,0,0,0|0,1,0]=3 454 B12R1.8 ICCCCCc1ccccc1 Amb32411025 [2,0,0,0,0,0|0,1,0]=3 455 B12R1.8 ICCCOCc1ccccc1 Amb26539397 [2,0,0,0,0,0|1,1,0]=4 456 B12R1.8 N#CCCCCc1ccccc1 Amb8392139 [2,0,0,0,0,0|1,0,1]=4 457 B12R1.8 N#CCCNCc1ccccc1 Amb4244013 [2,0,0,0,0,0|1,0,1]=4 458 B12R1.8 N#CCCNCc1ccccc1 Amb575385 [2,0,0,0,0,0|1,0,1]=4 459 B12R1.8 N#CCNCCc1ccccc1 Amb6711714 [2,0,0,0,0,0|1,0,1]=4 460 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [2,0,0,0,0,0|1,0,0]=3 461 B12R1.8 NCCCCCc1ccccn1 Amb18563643 [2,0,0,0,0,0|2,0,0]=4 462 B12R1.8 NCCCCOc1ccccc1 Amb482499 [2,0,0,0,0,0|2,0,0]=4 463 B12R1.8 NCCCCOc1ccccc1 Amb9677454 [2,0,0,0,0,0|2,0,0]=4 464 B12R1.8 NCCCCSc1ccccc1 Amb32662392 [2,0,0,0,0,0|2,0,0]=4 465 B12R1.8 NCCCCSc1ccccc1 Amb9391586 [2,0,0,0,0,0|2,0,0]=4 466 B12R1.8 NCCCNCc1ccccc1 Amb17720405 [2,0,0,0,0,0|1,0,0]=3 467 B12R1.8 NCCCNCc1ccccc1 Amb6774034 [2,0,0,0,0,0|1,0,0]=3 468 B12R1.8 NCCCNCc1ccccn1 Amb17315287 [2,0,0,0,0,0|2,0,0]=4 469 B12R1.8 NCCCNCc1cccnc1 Amb17315286 [2,0,0,0,0,0|2,0,0]=4 470 B12R1.8 NCCCNCc1ccncc1 Amb17315285 [2,0,0,0,0,0|2,0,0]=4 471 B12R1.8 NCCCOCc1ccccc1 Amb1217769 [2,0,0,0,0,0|2,0,0]=4 472 B12R1.8 NCCCSCc1ccccc1 Amb6265633 [2,0,0,0,0,0|2,0,0]=4 473 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [2,0,0,0,0,0|1,0,0]=3 474 B12R1.8 NCCNOCc1ccccc1 Amb26336084 [2,0,0,0,0,0|2,0,0]=4 475 B12R1.8 NCCNOCc1ccccc1 Amb32645664 [2,0,0,0,0,0|2,0,0]=4 476 B12R1.8 NCCOCCc1ccccc1 Amb33547794 [2,0,0,0,0,0|2,0,0]=4 477 B12R1.8 NCCOCCc1ccccc1 Amb7790966 [2,0,0,0,0,0|2,0,0]=4 478 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [2,0,0,0,0,0|1,0,1]=4 479 B12R1.8 OCCCCOc1ccccc1 Amb9370678 [2,0,0,0,0,0|2,0,0]=4 480 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [2,0,0,0,0,0|1,0,0]=3 481 B12R1.8 OCCCNCc1ccccc1 Amb4017628 [2,0,0,0,0,0|1,0,0]=3 482 B12R1.8 OCCCNCc1ccccn1 Amb33527209 [2,0,0,0,0,0|2,0,0]=4 483 B12R1.8 OCCCNCc1cccnc1 Amb2114454 [2,0,0,0,0,0|2,0,0]=4 484 B12R1.8 OCCCNCc1cccnc1 Amb33527208 [2,0,0,0,0,0|2,0,0]=4 485 B12R1.8 OCCCNCc1ccncc1 Amb22588118 [2,0,0,0,0,0|2,0,0]=4 486 B12R1.8 OCCCNCc1ccncc1 Amb6356097 [2,0,0,0,0,0|2,0,0]=4 487 B12R1.8 OCCCOCc1ccccc1 Amb4035606 [2,0,0,0,0,0|2,0,0]=4 488 B12R1.8 OCCCSCc1ccccc1 Amb6359471 [2,0,0,0,0,0|2,0,0]=4 489 B12R1.8 OCCNCCc1ccccc1 Amb6711760 [2,0,0,0,0,0|1,0,0]=3 490 B12R1.8 OCCNCCc1ccncc1 Amb1028249 [2,0,0,0,0,0|2,0,0]=4 491 B12R1.8 OCCNOCc1ccccc1 Amb27658441 [2,0,0,0,0,0|2,0,0]=4 492 B12R1.8 OCCOCCc1ccccc1 Amb18801040 [2,0,0,0,0,0|2,0,0]=4 493 B12R1.8 ONCCCCc1ccccc1 Amb32679349 [2,0,0,0,0,0|2,0,0]=4 494 B12R1.8 ONCCCCc1ccccc1 Amb32679459 [2,0,0,0,0,0|2,0,0]=4 495 B12R1.8 [C-]#[N+]CCCCc1ccccc1 Amb2690273 [2,0,0,0,0,0|2,0,0]=4 496 B12R1.32 CC(CCCl)Nc1ccccn1 Amb27254697 [2,0,0,0,0,0|2,0,0]=4 497 B12R1.32 CC(CCN)Cc1ccccc1 Amb17232439 [2,0,0,0,0,0|1,0,0]=3 498 B12R1.32 CC(CCN)Oc1ccccc1 Amb17232556 [2,0,0,0,0,0|2,0,0]=4 499 B12R1.32 CC(CCO)Cc1ccccc1 Amb17232486 [2,0,0,0,0,0|1,0,0]=3 500 B12R1.32 CC(CCO)Oc1ccccc1 Amb17232598 [2,0,0,0,0,0|2,0,0]=4 501 B12R1.32 CC(CON)Cc1ccccc1 Amb32953166 [2,0,0,0,0,0|2,0,0]=4 502 B12R1.32 CC(Cc1ccccc1)NC=O Amb8503525 [2,0,0,0,0,0|1,0,1]=4 503 B12R1.32 CCCC(=O)Cc1ccccc1 Amb3940679 [2,0,0,0,0,0|1,0,1]=4 504 B12R1.32 CCCC(C)Nc1ccccc1 Amb6685188 [2,0,0,0,0,0|1,0,0]=3 505 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [2,0,0,0,0,0|1,0,0]=3 506 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [2,0,0,0,0,0|0,0,0]=2 507 B12R1.32 CCNC(C)Cc1ccccn1 Amb1995151 [2,0,0,0,0,0|1,0,0]=3 508 B12R1.32 CCNC(C)Cc1cnccn1 Amb1995172 [2,0,0,0,0,0|2,0,0]=4 509 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [2,0,0,0,0,0|1,1,0]=4 510 B12R1.32 CN(CCBr)Cc1ccccc1 Amb32882453 [2,0,0,0,0,0|1,1,0]=4 511 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [2,0,0,0,0,0|1,0,0]=3 512 B12R1.32 CN(CCCl)Cc1ccccc1 Amb3940690 [2,0,0,0,0,0|1,0,0]=3 513 B12R1.32 CN(CCCl)Cc1ccccn1 Amb17335728 [2,0,0,0,0,0|2,0,0]=4 514 B12R1.32 CN(CCCl)Cc1cccnc1 Amb17335729 [2,0,0,0,0,0|2,0,0]=4 515 B12R1.32 CN(CCCl)Cc1ccncc1 Amb17335730 [2,0,0,0,0,0|2,0,0]=4 516 B12R1.32 CN(CCN)Cc1ccccc1 Amb5357836 [2,0,0,0,0,0|2,0,0]=4 517 B12R1.32 CN(CCO)Cc1ccccc1 Amb3938987 [2,0,0,0,0,0|2,0,0]=4 518 B12R1.32 CN(CCS)Cc1ccccc1 Amb13881720 [2,0,0,0,0,0|2,0,0]=4 519 B12R1.32 CNCC(C)Cc1ccccc1 Amb19023878 [2,0,0,0,0,0|1,0,0]=3 520 B12R1.32 CNCC(C)Nc1ccccc1 Amb27955315 [2,0,0,0,0,0|2,0,0]=4 521 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [2,0,0,0,0,0|2,0,0]=4 522 B12R1.32 CNCC(O)Cc1ccccc1 Amb17193901 [2,0,0,0,0,0|2,0,0]=4 523 B12R1.32 CNCC(O)Cc1ccccc1 Amb32661172 [2,0,0,0,0,0|2,0,0]=4 524 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [2,0,0,0,0,0|2,0,0]=4 525 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [2,0,0,0,0,0|2,0,0]=4 526 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb3940159 [2,0,0,0,0,0|2,0,0]=4 527 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb4037107 [2,0,0,0,0,0|2,0,0]=4 528 B12R1.32 COC[C@H](N)Cc1ccccc1 Amb33871543 [2,0,0,0,0,0|2,0,0]=4 529 B12R1.32 CONC(C)Cc1ccccc1 Amb28984063 [2,0,0,0,0,0|1,0,0]=3 530 B12R1.32 C[C@H](Cc1ccccc1)NC=S Amb27209575 [2,0,0,0,0,0|1,0,1]=4 531 B12R1.32 NC(CCO)Cc1ccccc1 Amb28872403 [2,0,0,0,0,0|2,0,0]=4 532 B12R1.32 NC(CCO)Cc1ccccc1 Amb8392175 [2,0,0,0,0,0|2,0,0]=4 533 B12R1.32 NCCC(F)Cc1ccccc1 Amb32954290 [2,0,0,0,0,0|2,0,0]=4 534 B12R1.32 NCCC(N)Cc1ccccc1 Amb33039576 [2,0,0,0,0,0|2,0,0]=4 535 B12R1.32 NCCC(O)Cc1ccccc1 Amb17232552 [2,0,0,0,0,0|2,0,0]=4 536 B12R1.32 NCC[C@@H](O)Cc1ccccc1 Amb32953160 [2,0,0,0,0,0|2,0,0]=4 537 B12R1.32 NCC[C@H](O)Cc1ccccc1 Amb32953161 [2,0,0,0,0,0|2,0,0]=4 538 B14R1.14 CCCCCCCc1ccc(Br)cc1 Amb2722819 [1,1,0,0,0,0|2,0,0]=4 539 B14R1.14 CCCCCCCc1ccc(N)cc1 Amb2721128 [1,1,0,0,0,0|2,0,0]=4 540 B14R1.14 CCCCCCCc1ccc(O)cc1 Amb2779885 [1,1,0,0,0,0|2,0,0]=4 541 B14R1.14 CCCCNCCc1ccc(Br)cc1 Amb18053697 [1,1,0,0,0,0|1,0,0]=3 542 B14R1.14 COCCNCCc1ccc(Br)cc1 Amb18053716 [1,1,0,0,0,0|2,0,0]=4 543 B14R1.14 Cc1ccc(CCNCCCN)cc1 Amb31094290 [1,1,0,0,0,0|1,0,0]=3 544 B14R1.14 N#CCCNCCc1ccc(F)cc1 Amb9202478 [1,1,0,0,0,0|1,0,1]=4 545 B14R1.14 NCCCCCCc1ccc(F)cc1 Amb17236256 [1,1,0,0,0,0|2,0,0]=4 546 B14R1.14 NCCCNCCc1ccc(Cl)cc1 Amb31094296 [1,1,0,0,0,0|1,0,0]=3 547 B14R1.14 NCCCNCCc1ccc(F)cc1 Amb17315308 [1,1,0,0,0,0|1,0,0]=3 548 B14R1.14 NCCCOCCc1ccc(F)cc1 Amb33171520 [1,1,0,0,0,0|2,0,0]=4 549 B14R1.14 Nc1ccc(CCNCCCO)cc1 Amb18050943 [1,1,0,0,0,0|1,0,0]=3 550 B14R1.14 OCCCNCCc1ccc(F)cc1 Amb17317888 [1,1,0,0,0,0|1,0,0]=3 551 B14R1.26 CCCCNCCc1cccc(Br)c1 Amb18053729 [1,1,0,0,0,0|1,0,0]=3 552 B14R1.26 CCCCNCCc1cccc(N)c1 Amb18550381 [1,1,0,0,0,0|1,0,0]=3 553 B14R1.26 COCCNCCc1cccc(Br)c1 Amb18053754 [1,1,0,0,0,0|2,0,0]=4 554 B14R1.26 COCCNCCc1cccc(N)c1 Amb18050453 [1,1,0,0,0,0|2,0,0]=4 555 B14R1.26 Cc1cccc(CCNCCCN)c1 Amb31094289 [1,1,0,0,0,0|1,0,0]=3 556 B14R1.26 NCCCNCCc1cccc(Cl)c1 Amb31094295 [1,1,0,0,0,0|1,0,0]=3 557 B14R1.26 NCCCNCCc1cccc(F)c1 Amb31094292 [1,1,0,0,0,0|1,0,0]=3 558 B14R1.26 Nc1cccc(CCNCCCO)c1 Amb18550371 [1,1,0,0,0,0|1,0,0]=3 559 B14R1.38 CCCCNCC(C)c1ccccc1 Amb2119259 [1,1,0,0,0,0|1,0,0]=3 560 B14R1.38 CCCCNCC(C)c1ccccc1 Amb6729197 [1,1,0,0,0,0|1,0,0]=3 561 B14R1.38 CCCCNCC(O)c1ccccc1 Amb9242095 [1,1,0,0,0,0|1,0,0]=3 562 B14R1.38 O=C(CCCCCCl)c1ccccc1 Amb6301785 [1,1,0,0,0,0|1,0,1]=4 563 B14R1.38 O[C@@H](C#CCCCCl)c1ccccc1 Amb27985022 [1,1,0,0,0,0|1,0,1]=4 564 B14R1.123 BrCCCCCCCc1ccccc1 Amb2685410 [1,1,0,0,0,0|1,1,0]=4 565 B14R1.123 BrCCCCCOCc1ccccc1 Amb24089339 [1,1,0,0,0,0|1,1,0]=4 566 B14R1.123 CCCCCCCCc1ccccc1 Amb6619511 [1,1,0,0,0,0|2,0,0]=4 567 B14R1.123 CCCCCCNCc1ccccc1 Amb838135 [1,1,0,0,0,0|2,0,0]=4 568 B14R1.123 CCCCCNCCc1ccccc1 Amb6688086 [1,1,0,0,0,0|1,0,0]=3 569 B14R1.123 CCCCCNOCc1ccccc1 Amb25943392 [1,1,0,0,0,0|2,0,0]=4 570 B14R1.123 CCCCNCC#Cc1ccccc1 Amb1923321 [1,1,0,0,0,0|1,0,1]=4 571 B14R1.123 CCCCNCC#Cc1ccccc1 Amb6864870 [1,1,0,0,0,0|1,0,1]=4 572 B14R1.123 CCCCNCCCc1ccccc1 Amb10559435 [1,1,0,0,0,0|1,0,0]=3 573 B14R1.123 CCCCNCCCc1ccccc1 Amb6709575 [1,1,0,0,0,0|1,0,0]=3 574 B14R1.123 CCCCNCCOc1ccccc1 Amb17235713 [1,1,0,0,0,0|1,0,0]=3 575 B14R1.123 CCCCNCCOc1ccccn1 Amb22534925 [1,1,0,0,0,0|2,0,0]=4 576 B14R1.123 CCCCNC\C=C\c1ccccc1 Amb6864531 [1,1,0,0,0,0|1,0,1]=4 577 B14R1.123 CCCCNC\C=C\c1ccccc1 Amb8450614 [1,1,0,0,0,0|1,0,1]=4 578 B14R1.123 CCOCCNCCc1ccccc1 Amb9241005 [1,1,0,0,0,0|1,0,0]=3 579 B14R1.123 CNCCCNCCc1ccccc1 Amb6888027 [1,1,0,0,0,0|1,0,0]=3 580 B14R1.123 COCCCNCCc1ccccc1 Amb876019 [1,1,0,0,0,0|1,0,0]=3 581 B14R1.123 COCCNCCCc1ccccc1 Amb6707136 [1,1,0,0,0,0|2,0,0]=4 582 B14R1.123 COCCNCCOc1ccccc1 Amb10608623 [1,1,0,0,0,0|2,0,0]=4 583 B14R1.123 COCCNCCOc1ccccc1 Amb22587632 [1,1,0,0,0,0|2,0,0]=4 584 B14R1.123 ClCCCCCOCc1ccccc1 Amb9001647 [1,1,0,0,0,0|1,0,0]=3 585 B14R1.123 ClCCCOC\C=C\c1ccccc1 Amb24113677 [1,1,0,0,0,0|1,0,1]=4 586 B14R1.123 ClCCNCCOCc1ccccc1 Amb9870425 [1,1,0,0,0,0|2,0,0]=4 587 B14R1.123 ClCCOCCOCc1ccccc1 Amb2583262 [1,1,0,0,0,0|2,0,0]=4 588 B14R1.123 ClCCSCCOCc1ccccc1 Amb27975500 [1,1,0,0,0,0|2,0,0]=4 589 B14R1.123 FCCCCCNCc1ccccc1 Amb27234459 [1,1,0,0,0,0|1,1,0]=4 590 B14R1.123 FCCCCNOCc1ccccc1 Amb27765238 [1,1,0,0,0,0|1,1,0]=4 591 B14R1.123 ICCCCCNCc1ccccc1 Amb27468861 [1,1,0,0,0,0|1,1,0]=4 592 B14R1.123 ICCCCCOCc1ccccc1 Amb25126877 [1,1,0,0,0,0|1,1,0]=4 593 B14R1.123 N#CCCCOCCc1ccccc1 Amb9208580 [1,1,0,0,0,0|2,0,0]=4 594 B14R1.123 NCCCCCNCc1ccccc1 Amb27837258 [1,1,0,0,0,0|2,0,0]=4 595 B14R1.123 NCCCCNOCc1ccccc1 Amb24707828 [1,1,0,0,0,0|2,0,0]=4 596 B14R1.123 NCCCCNOCc1ccccc1 Amb32663258 [1,1,0,0,0,0|2,0,0]=4 597 B14R1.123 NCCCCNOCc1ccccc1 Amb32663272 [1,1,0,0,0,0|2,0,0]=4 598 B14R1.123 NCCCCOCCc1ccccc1 Amb7790965 [1,1,0,0,0,0|2,0,0]=4 599 B14R1.123 NCCCNCCCc1ccccc1 Amb19050820 [1,1,0,0,0,0|1,0,0]=3 600 B14R1.123 NCCCNCCOc1ccccc1 Amb19080348 [1,1,0,0,0,0|1,0,0]=3 601 B14R1.123 NCCCSCCCc1ccccc1 Amb17500700 [1,1,0,0,0,0|2,0,0]=4 602 B14R1.123 OCCCCCCCc1ccccc1 Amb10807513 [1,1,0,0,0,0|2,0,0]=4 603 B14R1.123 OCCCCCNCc1ccccc1 Amb875693 [1,1,0,0,0,0|2,0,0]=4 604 B14R1.123 OCCCCCOCc1ccccc1 Amb3939226 [1,1,0,0,0,0|2,0,0]=4 605 B14R1.123 OCCCNCCCc1ccccc1 Amb6733767 [1,1,0,0,0,0|1,0,0]=3 606 B14R1.123 OCCCNC\C=C\c1ccccc1 Amb1926882 [1,1,0,0,0,0|1,0,1]=4 607 B14R1.123 OCCCNC\C=C\c1ccccc1 Amb2114455 [1,1,0,0,0,0|1,0,1]=4 608 B14R1.123 SCCCCCOCc1ccccc1 Amb27182376 [1,1,0,0,0,0|2,0,0]=4 609 B14R1.156 CC(CCCCl)OCc1ccccc1 Amb27387887 [1,1,0,0,0,0|2,0,0]=4 610 B14R1.156 CN(CCCN)CCc1ccccc1 Amb6670566 [1,1,0,0,0,0|1,0,0]=3 611 B14R1.156 CN(CCCN)CCc1ccncc1 Amb5357856 [1,1,0,0,0,0|2,0,0]=4 612 B14R1.156 CN(CCCO)CCc1ccccc1 Amb17336737 [1,1,0,0,0,0|1,0,0]=3 613 B14R1.422 CC(C)CCNOCc1ccccc1 Amb27749349 [1,1,0,0,0,0|2,0,0]=4 614 B14R1.422 CC(C)CCOCCc1ccccc1 Amb22732326 [1,1,0,0,0,0|2,0,0]=4 615 B14R1.422 CC(O)CCNCCc1ccccc1 Amb33455982 [1,1,0,0,0,0|1,0,0]=3 616 B14R1.422 CN(C)CCNCCc1ccccc1 Amb1136705 [1,1,0,0,0,0|2,0,0]=4 617 B14R1.422 NC(=O)CCNCCc1ccccc1 Amb22587630 [1,1,0,0,0,0|1,0,1]=4 618 B14R1.422 NC(=O)CCNCCc1ccccc1 Amb8511712 [1,1,0,0,0,0|1,0,1]=4 619 B14R1.422 O=C(O)CCNCCc1ccccc1 Amb1111405 [1,1,0,0,0,0|1,0,1]=4 620 B14R1.422 O=C(O)CCNCCc1ccccc1 Amb13952728 [1,1,0,0,0,0|1,0,1]=4 621 B14R1.520 CCCC(C)NCCc1ccccn1 Amb6694519 [1,1,0,0,0,0|2,0,0]=4 622 B14R1.520 CCCC(C)NOCc1ccccc1 Amb27832202 [1,1,0,0,0,0|2,0,0]=4 623 B14R1.520 COCC(C)NCCc1ccccc1 Amb6689549 [1,1,0,0,0,0|2,0,0]=4 624 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb1131212 [1,1,0,0,0,0|1,0,1]=4 625 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb15741009 [1,1,0,0,0,0|1,0,1]=4 626 B14R1.520 O=C(CCBr)NCCc1ccccc1 Amb17324032 [1,1,0,0,0,0|0,1,1]=4 627 B14R1.520 O=C(CCCl)NCCc1ccccc1 Amb33543242 [1,1,0,0,0,0|0,0,1]=3 628 B14R1.520 O=C(CCCl)NCCc1ccccn1 Amb6264023 [1,1,0,0,0,0|1,0,1]=4 629 B14R1.520 O=C(CCCl)NCCc1ccncc1 Amb17329185 [1,1,0,0,0,0|1,0,1]=4 630 B14R1.520 O=C(CCCl)NOCc1ccccc1 Amb27471657 [1,1,0,0,0,0|1,0,1]=4 631 B14R1.716 CC(CCl)CCOCc1ccccc1 Amb27975499 [1,1,0,0,0,0|2,0,0]=4 632 B14R1.716 CCC(C)CNCCc1ccccn1 Amb6720744 [1,1,0,0,0,0|2,0,0]=4 633 B14R1.716 CCC(C)COCCc1ccccc1 Amb24100310 [1,1,0,0,0,0|2,0,0]=4 634 B14R1.716 CC[C@@H](O)CNOCc1ccccc1 Amb27425649 [1,1,0,0,0,0|2,0,0]=4 635 B14R1.882 Cc1ccccc1CCNCCCN Amb31094287 [1,1,0,0,0,0|1,0,0]=3 636 B14R1.882 NCCCNCCc1ccccc1Cl Amb31094294 [1,1,0,0,0,0|1,0,0]=3 637 B14R1.882 NCCCNCCc1ccccc1F Amb31094291 [1,1,0,0,0,0|1,0,0]=3 638 B14R1.33 C=CCNC(C)Cc1ccc(N)cc1 Amb18550321 [1,1,0,0,0,0|0,0,2]=4 639 B14R1.33 CC#CNC(C)Cc1ccc(F)cc1 Amb27793485 [1,1,0,0,0,0|0,0,2]=4 640 B14R1.33 CC(CCCO)Nc1ccc(Cl)cc1 Amb21984580 [1,1,0,0,0,0|2,0,0]=4 641 B14R1.33 CC(CCCO)Nc1ccc(F)cc1 Amb21984573 [1,1,0,0,0,0|2,0,0]=4 642 B14R1.33 CC(Cc1ccc(N)cc1)NCCO Amb18550311 [1,1,0,0,0,0|1,0,0]=3 643 B14R1.33 CCCCC(N)Cc1ccc(Br)cc1 Amb18049675 [1,1,0,0,0,0|2,0,0]=4 644 B14R1.33 CCCCN(C)Cc1ccc(N)cc1 Amb6249324 [1,1,0,0,0,0|2,0,0]=4 645 B14R1.33 CCCCN(C)Cc1ccc(O)cc1 Amb10815491 [1,1,0,0,0,0|2,0,0]=4 646 B14R1.33 CCCNC(=O)Cc1ccc(N)cc1 Amb1116639 [1,1,0,0,0,0|1,0,1]=4 647 B14R1.33 CCCNC(C)Cc1ccc(N)cc1 Amb18050881 [1,1,0,0,0,0|0,0,0]=2 648 B14R1.33 CN(CCCN)Cc1ccc(Br)cc1 Amb31172766 [1,1,0,0,0,0|2,0,0]=4 649 B14R1.33 CN(CCCN)Cc1ccc(Cl)cc1 Amb17339916 [1,1,0,0,0,0|2,0,0]=4 650 B14R1.33 CN(CCCN)Cc1ccc(F)cc1 Amb6670570 [1,1,0,0,0,0|2,0,0]=4 651 B14R1.33 Cc1ccc(CN(C)CCCN)cc1 Amb6670568 [1,1,0,0,0,0|2,0,0]=4 652 B14R1.33 Cc1ccc(NC(C)CCCO)cc1 Amb21984576 [1,1,0,0,0,0|2,0,0]=4 653 B14R1.33 O=C(Cc1ccc(Cl)cc1)NCCCl Amb17103222 [1,1,0,0,0,0|1,0,1]=4 654 B14R1.33 O=C(Cc1ccc(F)cc1)NCCCl Amb17103221 [1,1,0,0,0,0|1,0,1]=4 655 B14R1.34 C#CCNC(C)Cc1cccc(F)c1 Amb33329896 [1,1,0,0,0,0|0,0,2]=4 656 B14R1.34 CC(CCCO)Nc1cccc(F)c1 Amb21984574 [1,1,0,0,0,0|2,0,0]=4 657 B14R1.34 CCCCC(N)Cc1cccc(Br)c1 Amb18049696 [1,1,0,0,0,0|2,0,0]=4 658 B14R1.34 CCCCN(C)Cc1cccc(Br)c1 Amb9173855 [1,1,0,0,0,0|2,0,0]=4 659 B14R1.34 CCCCN(C)Cc1cccc(N)c1 Amb6251944 [1,1,0,0,0,0|2,0,0]=4 660 B14R1.34 CCCNC(=O)Cc1cccc(N)c1 Amb8426829 [1,1,0,0,0,0|1,0,1]=4 661 B14R1.34 CCCNC(C)Cc1cccc(Br)c1 Amb18053864 [1,1,0,0,0,0|0,0,0]=2 662 B14R1.34 CN(CCCN)Cc1cccc(Br)c1 Amb31172765 [1,1,0,0,0,0|2,0,0]=4 663 B14R1.34 CN(CCCN)Cc1cccc(Cl)c1 Amb31172762 [1,1,0,0,0,0|2,0,0]=4 664 B14R1.34 CN(CCCN)Cc1cccc(F)c1 Amb6670560 [1,1,0,0,0,0|2,0,0]=4 665 B14R1.34 Cc1cccc(CN(C)CCCN)c1 Amb6670571 [1,1,0,0,0,0|2,0,0]=4 666 B14R1.34 Cc1cccc(NC(C)CCCO)c1 Amb21984577 [1,1,0,0,0,0|2,0,0]=4 667 B14R1.60 C#CCN(C)C(C)Cc1ccccc1 Amb22730039 [1,1,0,0,0,0|0,0,2]=4 668 B14R1.60 C#CCN(C)C(C)Cc1ccccc1 Amb7086092 [1,1,0,0,0,0|0,0,2]=4 669 B14R1.60 C#CCN(C)[C@@H](C)Cc1ccccc1 Amb22337571 [1,1,0,0,0,0|0,0,2]=4 670 B14R1.60 C#CCN(C)[C@H](C)Cc1ccccc1 Amb6296186 [1,1,0,0,0,0|0,0,2]=4 671 B14R1.60 CC(CCN)N(C)Cc1ccccc1 Amb17101137 [1,1,0,0,0,0|2,0,0]=4 672 B14R1.60 CN(Cc1ccccc1)C(=O)CCCl Amb4310576 [1,1,0,0,0,0|1,0,1]=4 673 B14R1.166 C=CCNC(C)C(O)c1ccccc1 Amb18092962 [1,1,0,0,0,0|0,0,2]=4 674 B14R1.166 CCCNC(=O)C(N)c1ccccc1 Amb6265860 [1,1,0,0,0,0|1,0,1]=4 675 B14R1.166 CCCNC(=O)C(O)c1ccccc1 Amb17401749 [1,1,0,0,0,0|1,0,1]=4 676 B14R1.166 CCCNC(=O)[C@@H](N)c1ccccc1 Amb5784568 [1,1,0,0,0,0|1,0,1]=4 677 B14R1.166 CCCNC(C)C(O)c1ccccc1 Amb18604509 [1,1,0,0,0,0|0,0,0]=2 678 B14R1.166 CCCSC(C)C(=O)c1ccccc1 Amb9668666 [1,1,0,0,0,0|1,0,1]=4 679 B14R1.423 CC(C)CCC(C)Nc1ccccc1 Amb6685183 [1,1,0,0,0,0|2,0,0]=4 680 B14R1.423 CC(CCC(=O)O)Cc1ccccc1 Amb5718197 [1,1,0,0,0,0|1,0,1]=4 681 B14R1.423 CC(Cc1ccccc1)NCC(=O)O Amb19042074 [1,1,0,0,0,0|1,0,1]=4 682 B14R1.423 CC(Cc1ccccc1)NCC(=O)O Amb4453185 [1,1,0,0,0,0|1,0,1]=4 683 B14R1.423 CC(O)CCN(C)Cc1ccccc1 Amb19079596 [1,1,0,0,0,0|2,0,0]=4 684 B14R1.423 CC(O)CNC(=O)Cc1ccccc1 Amb9244614 [1,1,0,0,0,0|1,0,1]=4 685 B14R1.467 CCC(Cc1ccccc1)NCCO Amb33363069 [1,1,0,0,0,0|1,0,0]=3 686 B14R1.467 CCN(CCCBr)Cc1ccccc1 Amb28128815 [1,1,0,0,0,0|1,1,0]=4 687 B14R1.467 CCN(CCCCl)Cc1ccccc1 Amb17339783 [1,1,0,0,0,0|1,0,0]=3 688 B14R1.467 CCN(CCCN)Cc1ccccc1 Amb2721998 [1,1,0,0,0,0|2,0,0]=4 689 B14R1.467 CCN(CCCO)Cc1ccccc1 Amb9246686 [1,1,0,0,0,0|2,0,0]=4 690 B14R1.743 CC(CO)CN(C)Cc1ccccc1 Amb27454513 [1,1,0,0,0,0|2,0,0]=4 691 B14R1.743 CC(Cc1ccccc1)NC(=O)CBr Amb17333679 [1,1,0,0,0,0|0,1,1]=4 692 B14R1.743 CCC(N)CN(C)Cc1ccccc1 Amb9763903 [1,1,0,0,0,0|2,0,0]=4 693 B14R1.743 CN(Cc1ccccc1)CC(N)CO Amb27228386 [1,1,0,0,0,0|2,0,0]=4 694 B14R1.743 CN(Cc1ccccc1)CC(O)CCl Amb27872169 [1,1,0,0,0,0|1,0,0]=3 695 B14R1.743 CN(Cc1ccccc1)CC(O)CN Amb6244730 [1,1,0,0,0,0|2,0,0]=4 696 B14R1.743 CNC(=N)NC(C)Cc1ccccc1 Amb19041369 [1,1,0,0,0,0|1,0,1]=4 697 B14R1.743 COC(=O)NC(C)Cc1ccccc1 Amb33552136 [1,1,0,0,0,0|1,0,1]=4 698 B14R1.946 CC(CCCO)Nc1ccccc1Cl Amb21984581 [1,1,0,0,0,0|2,0,0]=4 699 B14R1.946 CC(CCCO)Nc1ccccc1F Amb21984575 [1,1,0,0,0,0|2,0,0]=4 700 B14R1.946 CCCCN(C)Cc1ccccc1Br Amb9173854 [1,1,0,0,0,0|2,0,0]=4 701 B14R1.946 CCCCN(C)Cc1ccccc1N Amb6248814 [1,1,0,0,0,0|2,0,0]=4 702 B14R1.946 CCCCN(C)Cc1ccccc1O Amb17511169 [1,1,0,0,0,0|2,0,0]=4 703 B14R1.946 CCCNC(=O)Cc1ccccc1N Amb1119442 [1,1,0,0,0,0|1,0,1]=4 704 B14R1.946 CN(CCCN)Cc1ccccc1Br Amb31172764 [1,1,0,0,0,0|2,0,0]=4 705 B14R1.946 CN(CCCN)Cc1ccccc1Cl Amb17339915 [1,1,0,0,0,0|2,0,0]=4 706 B14R1.946 CN(CCCN)Cc1ccccc1F Amb9438734 [1,1,0,0,0,0|2,0,0]=4 707 B14R1.946 Cc1ccccc1CN(C)CCCN Amb6670575 [1,1,0,0,0,0|2,0,0]=4 708 B14R1.946 Cc1ccccc1NC(C)CCCO Amb21984578 [1,1,0,0,0,0|2,0,0]=4 709 B14R1.19 CC(CCCCN)c1ccc(F)cc1 Amb18565782 [0,1,0,0,1,0|2,0,0]=4 710 B14R1.19 CC(NCCCO)c1ccc(Br)cc1 Amb6733615 [0,1,0,0,1,0|1,0,0]=3 711 B14R1.19 CC(NCCCO)c1ccc(Cl)cc1 Amb6733622 [0,1,0,0,1,0|1,0,0]=3 712 B14R1.19 CC(NCCCO)c1ccc(I)cc1 Amb9636774 [0,1,0,0,1,0|1,0,0]=3 713 B14R1.19 CC(OCCCN)c1ccc(F)cc1 Amb33423594 [0,1,0,0,1,0|2,0,0]=4 714 B14R1.19 CCCCNC(C)c1ccc(Br)cc1 Amb6691002 [0,1,0,0,1,0|1,0,0]=3 715 B14R1.19 CCCCNC(C)c1ccc(Cl)cc1 Amb6691008 [0,1,0,0,1,0|1,0,0]=3 716 B14R1.19 CCCCNC(C)c1ccc(F)cc1 Amb6691026 [0,1,0,0,1,0|1,0,0]=3 717 B14R1.19 COCCNC(C)c1ccc(Br)cc1 Amb6685615 [0,1,0,0,1,0|2,0,0]=4 718 B14R1.19 COCCNC(C)c1ccc(C)cc1 Amb6685618 [0,1,0,0,1,0|2,0,0]=4 719 B14R1.19 COCCNC(C)c1ccc(Cl)cc1 Amb6685623 [0,1,0,0,1,0|2,0,0]=4 720 B14R1.19 COCCNC(C)c1ccc(I)cc1 Amb9622368 [0,1,0,0,1,0|2,0,0]=4 721 B14R1.19 Cc1ccc(C(=O)NCCCCl)cc1 Amb3887181 [0,1,0,0,1,0|1,0,1]=4 722 B14R1.19 Cc1ccc(C(C)NCCCO)cc1 Amb6733617 [0,1,0,0,1,0|1,0,0]=3 723 B14R1.19 O=C(NCCCCl)c1ccc(Br)cc1 Amb3888584 [0,1,0,0,1,0|1,0,1]=4 724 B14R1.19 O=C(NCCCCl)c1ccc(Cl)cc1 Amb6403655 [0,1,0,0,1,0|1,0,1]=4 725 B14R1.19 O=C(NCCCCl)c1ccc(F)cc1 Amb6418318 [0,1,0,0,1,0|1,0,1]=4 726 B14R1.20 CC(NCCCO)c1cccc(Br)c1 Amb6733616 [0,1,0,0,1,0|1,0,0]=3 727 B14R1.20 CC(NCCCO)c1cccc(Cl)c1 Amb6733720 [0,1,0,0,1,0|1,0,0]=3 728 B14R1.20 CC(NCCCO)c1cccc(F)c1 Amb6733728 [0,1,0,0,1,0|1,0,0]=3 729 B14R1.20 CCCCNC(C)c1cccc(Br)c1 Amb6691003 [0,1,0,0,1,0|1,0,0]=3 730 B14R1.20 CCCCNC(C)c1cccc(Cl)c1 Amb6691091 [0,1,0,0,1,0|1,0,0]=3 731 B14R1.20 COCCNC(C)c1cccc(Br)c1 Amb6685617 [0,1,0,0,1,0|2,0,0]=4 732 B14R1.20 COCCNC(C)c1cccc(F)c1 Amb6685729 [0,1,0,0,1,0|2,0,0]=4 733 B14R1.20 Cc1cccc(C(=O)NCCCCl)c1 Amb6845384 [0,1,0,0,1,0|1,0,1]=4 734 B14R1.20 O=C(NCCCCl)c1cccc(Br)c1 Amb3888585 [0,1,0,0,1,0|1,0,1]=4 735 B14R1.20 O=C(NCCCCl)c1cccc(Cl)c1 Amb6391043 [0,1,0,0,1,0|1,0,1]=4 736 B14R1.20 O=C(NCCCCl)c1cccc(F)c1 Amb2124700 [0,1,0,0,1,0|1,0,1]=4 737 B14R1.29 CC(NC(=O)CCBr)c1ccccc1 Amb17330864 [0,1,0,0,1,0|0,1,1]=4 738 B14R1.29 CC(NC(=O)CCCl)c1ccccc1 Amb1106284 [0,1,0,0,1,0|0,0,1]=3 739 B14R1.29 CC(NC(=O)CCO)c1ccccc1 Amb17336606 [0,1,0,0,1,0|1,0,1]=4 740 B14R1.29 COCC(C)NC(C)c1ccccc1 Amb6689581 [0,1,0,0,1,0|2,0,0]=4 741 B14R1.29 C[C@@H](NC(=O)CCN)c1ccccc1 Amb32700400 [0,1,0,0,1,0|1,0,1]=4 742 B14R1.29 C[C@@H](NC(=O)CCN)c1ccccc1 Amb33338907 [0,1,0,0,1,0|1,0,1]=4 743 B14R1.121 CCC(NCCCO)c1ccccc1 Amb6733618 [0,1,0,0,1,0|1,0,0]=3 744 B14R1.121 CCC(NCCOC)c1ccccc1 Amb6685619 [0,1,0,0,1,0|2,0,0]=4 745 B14R1.121 CCCCNC(CC)c1ccccc1 Amb9736122 [0,1,0,0,1,0|1,0,0]=3 746 B14R1.121 CCCCNC(CO)c1ccccc1 Amb33496251 [0,1,0,0,1,0|1,0,0]=3 747 B14R1.121 CCCCOC(CBr)c1ccccc1 Amb33348519 [0,1,0,0,1,0|2,0,0]=4 748 B14R1.121 CCCCOC(CI)c1ccccc1 Amb33349136 [0,1,0,0,1,0|2,0,0]=4 749 B14R1.163 CC(OCC(O)CN)c1ccccc1 Amb6248358 [0,1,0,0,1,0|2,0,0]=4 750 B14R1.163 CCC(C)CNC(C)c1ccccc1 Amb6719459 [0,1,0,0,1,0|1,0,0]=3 751 B14R1.163 CCC(C)CNC(C)c1cccnc1 Amb6726575 [0,1,0,0,1,0|2,0,0]=4 752 B14R1.163 CCC(C)CNC(C)c1ccncc1 Amb6723460 [0,1,0,0,1,0|2,0,0]=4 753 B14R1.163 CCC(N)CNC(C)c1ccccc1 Amb33230038 [0,1,0,0,1,0|1,0,0]=3 754 B14R1.163 O=C(NCC(O)CCl)c1ccccc1 Amb17595793 [0,1,0,0,1,0|1,0,1]=4 755 B14R1.420 CC(=O)CCNC(C)c1ccccc1 Amb32675821 [0,1,0,0,1,0|1,0,1]=4 756 B14R1.420 CC(C)CCNC(C)c1ccccc1 Amb6684810 [0,1,0,0,1,0|1,0,0]=3 757 B14R1.420 CC(C)CCNC(C)c1ccccn1 Amb6692761 [0,1,0,0,1,0|2,0,0]=4 758 B14R1.420 CC(C)CCNC(C)c1cccnc1 Amb6692763 [0,1,0,0,1,0|2,0,0]=4 759 B14R1.420 CC(C)CCNC(C)c1ccncc1 Amb6692762 [0,1,0,0,1,0|2,0,0]=4 760 B14R1.420 CC(NCCC(=O)O)c1ccccc1 Amb2372473 [0,1,0,0,1,0|1,0,1]=4 761 B14R1.420 CC(NCCC(N)=O)c1ccccc1 Amb8841102 [0,1,0,0,1,0|1,0,1]=4 762 B14R1.420 CC(O)CCNC(C)c1ccccc1 Amb33455957 [0,1,0,0,1,0|1,0,0]=3 763 B14R1.420 CC(O)CCNC(C)c1ccccn1 Amb33455951 [0,1,0,0,1,0|2,0,0]=4 764 B14R1.420 CC(O)CCNC(C)c1cccnc1 Amb33455956 [0,1,0,0,1,0|2,0,0]=4 765 B14R1.420 CC(O)CCNC(C)c1ccncc1 Amb33455964 [0,1,0,0,1,0|2,0,0]=4 766 B14R1.420 C\C(Cl)=C/CNC(C)c1ccccc1 Amb2693168 [0,1,0,0,1,0|0,0,2]=4 767 B14R1.1035 CC(NCCCO)c1ccccc1Br Amb6733641 [0,1,0,0,1,0|1,0,0]=3 768 B14R1.1035 CC(NCCCO)c1ccccc1Cl Amb6733623 [0,1,0,0,1,0|1,0,0]=3 769 B14R1.1035 CC(NCCCO)c1ccccc1F Amb6733637 [0,1,0,0,1,0|1,0,0]=3 770 B14R1.1035 CCCCNC(C)c1ccccc1Br Amb6691028 [0,1,0,0,1,0|1,0,0]=3 771 B14R1.1035 CCCCNC(C)c1ccccc1C Amb6691057 [0,1,0,0,1,0|1,0,0]=3 772 B14R1.1035 COCCNC(C)c1ccccc1Br Amb6685646 [0,1,0,0,1,0|2,0,0]=4 773 B14R1.1035 COCCNC(C)c1ccccc1C Amb6685685 [0,1,0,0,1,0|2,0,0]=4 774 B14R1.1035 Cc1ccccc1C(=O)NCCCCl Amb1806472 [0,1,0,0,1,0|1,0,1]=4 775 B14R1.1035 Cc1ccccc1C(C)NCCCO Amb6733681 [0,1,0,0,1,0|1,0,0]=3 776 B14R1.1035 O=C(NCCCCl)c1ccccc1Br Amb6407753 [0,1,0,0,1,0|1,0,1]=4 777 B14R1.1035 O=C(NCCCCl)c1ccccc1Cl Amb3887496 [0,1,0,0,1,0|1,0,1]=4 778 B14R1.1035 O=C(NCCCCl)c1ccccc1F Amb3887234 [0,1,0,0,1,0|1,0,1]=4 779 B14R1.107 CC(NCCCO)C(O)c1cccs1 Amb18606113 [0,1,0,0,1,0|2,0,0]=4 780 B14R1.107 CCCCNC(C)C(O)c1cccs1 Amb18605685 [0,1,0,0,1,0|2,0,0]=4 781 B14R1.621 CC(Cc1ccco1)NC(=O)CCCl Amb9563980 [0,1,0,0,1,0|1,0,1]=4 782 B14R1.621 CC(Cc1cccs1)NC(=O)CCCl Amb9563952 [0,1,0,0,1,0|1,0,1]=4 783 B14R1.621 CC(Cn1cccc1)NC(=O)CCCl Amb17327773 [0,1,0,0,1,0|1,0,1]=4 784 B16R1.688 CCCCC#CC(C)NCc1ccccc1 Amb28129044 [0,1,0,0,0,1|2,0,0]=4 785 B16R1.688 CCCCCCC(C)NCc1ccccc1 Amb7756668 [0,1,0,0,0,1|2,0,0]=4 786 B16R1.688 CCCCNCC(O)COc1ccccc1 Amb1922317 [0,1,0,0,0,1|2,0,0]=4 787 B16R1.688 COCCNCC(C)OCc1ccccc1 Amb27611488 [0,1,0,0,0,1|2,0,0]=4 788 B16R1.688 OCCCNCC(O)COc1ccccc1 Amb1049222 [0,1,0,0,0,1|2,0,0]=4 789 B16R1.1516 CCCCC(=O)C(C)NCc1ccccc1 Amb27166557 [0,1,0,0,0,1|2,0,0]=4 790 B16R1.1516 CCCC[C@H](N)[C@H](C)OCc1ccccc1 Amb27826497 [0,1,0,0,0,1|2,0,0]=4 791 B16R1.1570 CC(CCc1ccccc1)NC(=O)CCCl Amb8859130 [0,1,0,0,0,1|0,0,1]=3 792 B16R1.54 CCCCCNC(C)Cc1ccc(N)cc1 Amb18550314 [0,2,0,0,0,0|1,0,0]=3 793 B16R1.54 COCCCNC(C)Cc1ccc(N)cc1 Amb18050877 [0,2,0,0,0,0|1,0,0]=3 794 B16R1.693 CN(CCNCCCO)Cc1ccccc1 Amb27780892 [0,2,0,0,0,0|2,0,0]=4 795 B16R1.705 CCCCCNC(C)C(O)c1ccccc1 Amb18604517 [0,2,0,0,0,0|1,0,0]=3 796 B16R1.705 COCCCNC(C)C(O)c1ccccc1 Amb18092958 [0,2,0,0,0,0|1,0,0]=3 797 B16R1.934 CC(CNC(=O)CCCl)Oc1ccccc1 Amb17324924 [0,2,0,0,0,0|1,0,1]=4 798 B16R1.1329 COC(=O)CCNC(C)Cc1ccccc1 Amb613968 [0,2,0,0,0,0|1,0,1]=4 799 B16R1.1407 CCN(CCOCCCl)Cc1ccccc1 Amb27174950 [0,2,0,0,0,0|2,0,0]=4 800 B16R1.1497 CC(Cc1ccccc1)NC(=O)CCCCl Amb17332905 [0,2,0,0,0,0|0,0,0]=2 801 B16R1.1497 CC(Cc1ccncc1)NC(=O)CCCCl Amb17327521 [0,2,0,0,0,0|1,0,0]=3 802 B16R1.61 CC(NCCCO)C(=O)c1ccc(N)cc1 Amb18051374 [0,2,0,0,0,0|1,0,1]=4 803 B16R1.61 CC(NCCCO)C(O)c1ccc(Cl)cc1 Amb18093538 [0,2,0,0,0,0|1,0,0]=3 804 B16R1.61 CC(NCCCO)C(O)c1ccc(F)cc1 Amb18093625 [0,2,0,0,0,0|1,0,0]=3 805 B16R1.61 CCCCNC(C)C(=O)c1ccc(N)cc1 Amb18550821 [0,2,0,0,0,0|1,0,1]=4 806 B16R1.61 CCCCNC(C)C(O)c1ccc(C)cc1 Amb18604620 [0,2,0,0,0,0|1,0,0]=3 807 B16R1.61 CCCCNC(C)C(O)c1ccc(Cl)cc1 Amb18093544 [0,2,0,0,0,0|1,0,0]=3 808 B16R1.61 CCCCNC(C)C(O)c1ccc(F)cc1 Amb18093631 [0,2,0,0,0,0|1,0,0]=3 809 B16R1.61 COCCNC(C)C(O)c1ccc(C)cc1 Amb18093160 [0,2,0,0,0,0|2,0,0]=4 810 B16R1.61 COCCNC(C)C(O)c1ccc(Cl)cc1 Amb18605024 [0,2,0,0,0,0|2,0,0]=4 811 B16R1.61 COCCNC(C)C(O)c1ccc(F)cc1 Amb18093640 [0,2,0,0,0,0|2,0,0]=4 812 B16R1.61 Cc1ccc(C(O)C(C)NCCCO)cc1 Amb18604618 [0,2,0,0,0,0|1,0,0]=3 813 B16R1.613 CC(C)CCNC(C)C(O)c1ccccc1 Amb18604543 [0,2,0,0,0,0|1,0,0]=3 814 B16R1.613 CC(NCCC(=O)O)C(O)c1ccccc1 Amb539293 [0,2,0,0,0,0|1,0,1]=4 815 B16R1.613 CC(NCCN(C)C)C(O)c1ccccc1 Amb18092990 [0,2,0,0,0,0|2,0,0]=4 816 B16R1.1244 CC(C(O)c1ccccc1)N(C)CCC#N Amb24122677 [0,2,0,0,0,0|1,0,1]=4 817 B16R1.1244 CCCCN(C)C(C)C(O)c1ccccc1 Amb2703244 [0,2,0,0,0,0|1,0,0]=3 818 B16R1.1420 CCC(NCCCO)C(O)c1ccccc1 Amb18604556 [0,2,0,0,0,0|1,0,0]=3 819 B16R1.1420 CCC(NCCOC)C(O)c1ccccc1 Amb18093014 [0,2,0,0,0,0|2,0,0]=4 820 B16R1.1420 CCCCNC(CC)C(O)c1ccccc1 Amb18604559 [0,2,0,0,0,0|1,0,0]=3 821 B16R1.658 CCCCN(C)C(C)Cc1ccc(N)cc1 Amb18050254 [0,2,0,0,0,0|1,0,0]=3 822 B16R1.658 CN(Cc1ccc(Cl)cc1)C(=O)CCCCl Amb17330736 [0,2,0,0,0,0|2,0,0]=4 823 B16R1.955 Cc1ccc(CC(C)NC(=O)CCBr)cc1 Amb17324576 [0,2,0,0,0,0|0,1,1]=4 824 B16R1.1067 CC(C)CCNC(C)Cc1ccc(N)cc1 Amb18050933 [0,2,0,0,0,0|1,0,0]=3 825 B16R1.1067 CC(Cc1ccc(N)cc1)NCCC(=O)O Amb18050916 [0,2,0,0,0,0|1,0,1]=4 826 B16R1.1067 CC(Cc1ccc(N)cc1)NCCN(C)C Amb18050923 [0,2,0,0,0,0|2,0,0]=4 827 B16R1.7382 CCCCNC(C)Cc1ccc(CC)cc1 Amb18053928 [0,2,0,0,0,0|1,0,0]=3 828 B16R1.7382 CCc1ccc(CC(C)NCCOC)cc1 Amb18053980 [0,2,0,0,0,0|2,0,0]=4 829 B16R1.7393 CCCCNC(C)Cc1ccc(C)c(C)c1 Amb18053927 [0,2,0,0,0,0|1,0,0]=3 830 B16R1.7393 CCCCNC(C)Cc1ccc(Cl)c(C)c1 Amb18053934 [0,2,0,0,0,0|1,0,0]=3 831 B16R1.7393 CCCCNC(C)Cc1ccc(Cl)c(Cl)c1 Amb18053938 [0,2,0,0,0,0|1,0,0]=3 832 B16R1.7393 CCCCNC(C)Cc1ccc(F)c(C)c1 Amb18553037 [0,2,0,0,0,0|1,0,0]=3 833 B16R1.7393 CCCCNC(C)Cc1ccc(F)c(F)c1 Amb18553046 [0,2,0,0,0,0|1,0,0]=3 834 B16R1.7393 COCCNC(C)Cc1ccc(C)c(C)c1 Amb18553083 [0,2,0,0,0,0|2,0,0]=4 835 B16R1.7393 COCCNC(C)Cc1ccc(Cl)c(C)c1 Amb18054005 [0,2,0,0,0,0|2,0,0]=4 836 B16R1.7393 COCCNC(C)Cc1ccc(Cl)c(Cl)c1 Amb18054007 [0,2,0,0,0,0|2,0,0]=4 837 B16R1.7393 COCCNC(C)Cc1ccc(F)c(C)c1 Amb18553106 [0,2,0,0,0,0|2,0,0]=4 838 B16R1.7393 COCCNC(C)Cc1ccc(F)c(F)c1 Amb18553115 [0,2,0,0,0,0|2,0,0]=4 839 B16R1.22955 CCCCNC(C)Cc1ccc(C)cc1C Amb18053932 [0,2,0,0,0,0|1,0,0]=3 840 B16R1.22955 CCCCNC(C)Cc1ccc(Cl)cc1Cl Amb18053929 [0,2,0,0,0,0|1,0,0]=3 841 B16R1.22955 COCCNC(C)Cc1ccc(C)cc1C Amb18054003 [0,2,0,0,0,0|2,0,0]=4 842 B16R1.22955 COCCNC(C)Cc1ccc(Cl)cc1Cl Amb18553088 [0,2,0,0,0,0|2,0,0]=4 843 B16R1.659 CN(Cc1cccc(Cl)c1)C(=O)CCCCl Amb17332787 [0,2,0,0,0,0|2,0,0]=4 844 B16R1.7379 CCCCNC(C)Cc1cc(F)ccc1F Amb18553045 [0,2,0,0,0,0|1,0,0]=3 845 B16R1.7379 COCCNC(C)Cc1cc(F)ccc1F Amb18054032 [0,2,0,0,0,0|2,0,0]=4 846 B16R1.7389 CCCCNC(C)Cc1cccc(OC)c1 Amb18553026 [0,2,0,0,0,0|1,0,0]=3 847 B16R1.7389 COCCNC(C)Cc1cccc(OC)c1 Amb18553094 [0,2,0,0,0,0|2,0,0]=4 848 B16R1.126 CCN(Cc1ccccc1)C(=O)CCCCl Amb17254999 [0,2,0,0,0,0|2,0,0]=4 849 B16R1.7523 CN(Cc1ccccc1Cl)C(=O)CCCCl Amb17328698 [0,2,0,0,0,0|2,0,0]=4 850 B16R1.7523 CN(Cc1ccccc1F)C(=O)CCCCl Amb17328819 [0,2,0,0,0,0|2,0,0]=4 851 B16R1.7641 CN(Cc1ccccc1)S(=O)(=O)CCCCl Amb9518887 [0,2,0,0,0,0|2,0,0]=4 852 B16R1.4235 Cc1ccccc1CC(C)NC(=O)CCBr Amb17332810 [0,2,0,0,0,0|0,1,1]=4 853 B16R1.1438 CCCN(CCCCCl)Cc1ccccc1 Amb27974312 [0,2,0,0,0,0|2,0,0]=4 854 B14R2.3 BrCCCC1CCc2ccccc21 Amb26468554 [1,0,0,1,0,0|1,1,0]=4 855 B14R2.3 BrCCCN1CCc2ccccc21 Amb27414544 [1,0,0,1,0,0|0,1,0]=3 856 B14R2.3 C#CCCN1CCc2ccccc21 Amb27775595 [1,0,0,1,0,0|1,0,1]=4 857 B14R2.3 CCCCN1CCc2ccccc21 Amb6360682 [1,0,0,1,0,0|1,0,0]=3 858 B14R2.3 CCCCN1CCc2ncccc21 Amb28070384 [1,0,0,1,0,0|2,0,0]=4 859 B14R2.3 CNCCN1CCc2ccccc21 Amb6715519 [1,0,0,1,0,0|2,0,0]=4 860 B14R2.3 ClCCCN1CCc2ccccc21 Amb17337049 [1,0,0,1,0,0|0,0,0]=2 861 B14R2.3 ClCCCn1cnc2ccccc21 Amb1130021 [1,0,0,1,0,0|1,0,1]=4 862 B14R2.3 ClCCCn1nnc2ccccc21 Amb10567174 [1,0,0,1,0,0|2,0,0]=4 863 B14R2.3 FCCCN1CCc2ccccc21 Amb27455976 [1,0,0,1,0,0|0,1,0]=3 864 B14R2.3 N#CCCN1CCc2ccccc21 Amb6666555 [1,0,0,1,0,0|1,0,1]=4 865 B14R2.3 NCCCN1CCc2ccccc21 Amb1108321 [1,0,0,1,0,0|1,0,0]=3 866 B14R2.3 NOCCN1CCc2ccccc21 Amb17104862 [1,0,0,1,0,0|2,0,0]=4 867 B14R2.3 OCCCC1CCc2ccccc21 Amb24353166 [1,0,0,1,0,0|2,0,0]=4 868 B14R2.3 OCCCN1CCc2ccccc21 Amb9246658 [1,0,0,1,0,0|1,0,0]=3 869 B14R2.3 SCCCC1CCc2ccccc21 Amb33144215 [1,0,0,1,0,0|2,0,0]=4 870 B14R2.3 [C-]#[N+]CCN1CCc2ccccc21 Amb19928690 [1,0,0,1,0,0|2,0,0]=4 871 B14R2.6 C1=CC(Cc2ccccc2)NCC1 Amb18127112 [1,0,0,1,0,0|1,0,1]=4 872 B14R2.6 c1cc(CC2CCCCN2)ccn1 Amb2235427 [1,0,0,1,0,0|2,0,0]=4 873 B14R2.6 c1ccc(CC2=NCCCN2)cc1 Amb25123799 [1,0,0,1,0,0|1,0,1]=4 874 B14R2.6 c1ccc(CC2CCCCC2)cc1 Amb4020088 [1,0,0,1,0,0|2,0,0]=4 875 B14R2.6 c1ccc(CC2CCCCN2)cc1 Amb17659191 [1,0,0,1,0,0|1,0,0]=3 876 B14R2.6 c1ccc(CC2CCCCN2)cc1 Amb9768306 [1,0,0,1,0,0|1,0,0]=3 877 B14R2.6 c1ccc(CC2CCCCN2)nc1 Amb2237229 [1,0,0,1,0,0|2,0,0]=4 878 B14R2.6 c1ccc(CC2CCCCN2)nc1 Amb32644425 [1,0,0,1,0,0|2,0,0]=4 879 B14R2.6 c1ccc(CC2CCCC[NH2+]2)cc1 Amb33513128 [1,0,0,1,0,0|1,0,1]=4 880 B14R2.6 c1ccc(CC2CNCCN2)cc1 Amb10068437 [1,0,0,1,0,0|2,0,0]=4 881 B14R2.6 c1ccc(CC2CNCCN2)cc1 Amb20240950 [1,0,0,1,0,0|2,0,0]=4 882 B14R2.6 c1ccc(CC2COCCN2)cc1 Amb10068897 [1,0,0,1,0,0|2,0,0]=4 883 B14R2.6 c1ccc(CC2COCCN2)cc1 Amb8009649 [1,0,0,1,0,0|2,0,0]=4 884 B14R2.6 c1ccc(CC2CSCCN2)cc1 Amb18565445 [1,0,0,1,0,0|2,0,0]=4 885 B14R2.6 c1ccc(CC2NCCCO2)cc1 Amb17506195 [1,0,0,1,0,0|1,0,0]=3 886 B14R2.6 c1ccc(CC2NCCCS2)cc1 Amb27177019 [1,0,0,1,0,0|1,0,0]=3 887 B14R2.6 c1ccc(C[C@@H]2CCCCN2)cc1 Amb22892828 [1,0,0,1,0,0|1,0,0]=3 888 B14R2.6 c1ccc(C[C@@H]2CNCCN2)cc1 Amb19515800 [1,0,0,1,0,0|2,0,0]=4 889 B14R2.6 c1ccc(C[C@@H]2CNCCN2)cc1 Amb22752073 [1,0,0,1,0,0|2,0,0]=4 890 B14R2.6 c1ccc(C[C@@H]2COCCN2)cc1 Amb20242985 [1,0,0,1,0,0|2,0,0]=4 891 B14R2.6 c1ccc(C[C@H]2CCCCN2)cc1 Amb27607714 [1,0,0,1,0,0|1,0,0]=3 892 B14R2.6 c1ccc(C[C@H]2CNCCN2)cc1 Amb15690734 [1,0,0,1,0,0|2,0,0]=4 893 B14R2.6 c1ccc(C[C@H]2CNCCN2)cc1 Amb34910880 [1,0,0,1,0,0|2,0,0]=4 894 B14R2.6 c1ccc(C[C@H]2COCCN2)cc1 Amb20242986 [1,0,0,1,0,0|2,0,0]=4 895 B14R2.6 c1ccc(C[C@H]2COCCN2)cc1 Amb22226651 [1,0,0,1,0,0|2,0,0]=4 896 B14R2.6 c1cncc(CC2CCCCN2)c1 Amb24085209 [1,0,0,1,0,0|2,0,0]=4 897 B14R2.14 CCC1CNCC1c2ccccc2 Amb24563782 [1,0,0,1,0,0|1,0,0]=3 898 B14R2.14 CO[C@@H]1CNC[C@H]1c2ccccc2 Amb27419896 [1,0,0,1,0,0|2,0,0]=4 899 B14R2.14 ClCC1CCCC1c2ccccc2 Amb27816406 [1,0,0,1,0,0|1,0,0]=3 900 B14R2.14 N#CC1CNCC1c2ccccc2 Amb23597889 [1,0,0,1,0,0|1,0,1]=4 901 B14R2.14 N#CC1CNCC1c2ccccc2 Amb32661064 [1,0,0,1,0,0|1,0,1]=4 902 B14R2.14 N#C[C@@H]1CNC[C@H]1c2ccccc2 Amb25175728 [1,0,0,1,0,0|1,0,1]=4 903 B14R2.14 N#C[C@@H]1CNC[C@H]1c2ccccc2 Amb26838387 [1,0,0,1,0,0|1,0,1]=4 904 B14R2.14 NCC1CCCC1c2ccccc2 Amb26980483 [1,0,0,1,0,0|2,0,0]=4 905 B14R2.14 NCC1CCCC1c2ccccc2 Amb28556058 [1,0,0,1,0,0|2,0,0]=4 906 B14R2.14 NCC1COCC1c2ccccc2 Amb27624694 [1,0,0,1,0,0|2,0,0]=4 907 B14R2.14 OCC1CNCC1c2ccccc2 Amb9781840 [1,0,0,1,0,0|1,0,0]=3 908 B14R2.14 OCC1CNCC1c2ccccn2 Amb27596998 [1,0,0,1,0,0|2,0,0]=4 909 B14R2.14 OC[C@@H]1CCC[C@H]1c2ccccc2 Amb27844164 [1,0,0,1,0,0|2,0,0]=4 910 B14R2.14 OC[C@@H]1CNC[C@H]1c2ccccc2 Amb22756588 [1,0,0,1,0,0|1,0,0]=3 911 B14R2.14 OC[C@@H]1CNC[C@H]1c2ccccc2 Amb35789802 [1,0,0,1,0,0|1,0,0]=3 912 B14R2.14 OC[C@H]1CNC[C@@H]1c2ccccc2 Amb26588980 [1,0,0,1,0,0|1,0,0]=3 913 B14R2.14 OC[C@H]1CNC[C@@H]1c2ccccn2 Amb27422097 [1,0,0,1,0,0|2,0,0]=4 914 B14R2.14 OC[C@H]1CNC[C@H]1c2ccccc2 Amb27964542 [1,0,0,1,0,0|1,0,0]=3 915 B14R2.24 BrC1CCOCC1c2ccccc2 Amb27786504 [1,0,0,1,0,0|1,1,0]=4 916 B14R2.24 CC1CCNCC1c2ccccc2 Amb26855487 [1,0,0,1,0,0|1,0,0]=3 917 B14R2.24 CC1CCNCC1c2ccccc2 Amb30051609 [1,0,0,1,0,0|1,0,0]=3 918 B14R2.24 CN1CCNCC1c2ccccc2 Amb21954179 [1,0,0,1,0,0|2,0,0]=4 919 B14R2.24 CN1CCNCC1c2ccccc2 Amb22586681 [1,0,0,1,0,0|2,0,0]=4 920 B14R2.24 CN1CCNCC1c2ccccc2 Amb3941171 [1,0,0,1,0,0|2,0,0]=4 921 B14R2.24 C[C@@H]1CCNC[C@@H]1c2ccccc2 Amb32682441 [1,0,0,1,0,0|1,0,0]=3 922 B14R2.24 C[C@@H]1CCNC[C@@H]1c2ccccc2 Amb32682462 [1,0,0,1,0,0|1,0,0]=3 923 B14R2.24 ClC1CCCCC1[n+]2ccccc2 Amb28140983 [1,0,0,1,0,0|2,0,0]=4 924 B14R2.24 Cl[C@@H]1CCCCC1[n+]2ccccc2 Amb30621849 [1,0,0,1,0,0|2,0,0]=4 925 B14R2.24 Cl[C@@H]1CCCO[C@H]1c2ccccc2 Amb27444641 [1,0,0,1,0,0|2,0,0]=4 926 B14R2.24 NC1CCCCC1c2ccccc2 Amb33553374 [1,0,0,1,0,0|2,0,0]=4 927 B14R2.24 NC1CCCCC1c2ccccc2 Amb9620845 [1,0,0,1,0,0|2,0,0]=4 928 B14R2.24 NC1CCNCC1c2ccccc2 Amb24398671 [1,0,0,1,0,0|1,0,0]=3 929 B14R2.24 NC1CCOCC1c2ccccc2 Amb27199871 [1,0,0,1,0,0|2,0,0]=4 930 B14R2.24 N[C@@H]1CCCC[C@H]1c2ccccc2 Amb22757825 [1,0,0,1,0,0|2,0,0]=4 931 B14R2.24 N[C@H]1CCCC[C@@H]1c2ccccc2 Amb27659258 [1,0,0,1,0,0|2,0,0]=4 932 B14R2.24 O=C1CCNCC1c2ccccc2 Amb18197173 [1,0,0,1,0,0|1,0,1]=4 933 B14R2.24 O=S1CCNCC1c2ccccc2 Amb18864028 [1,0,0,1,0,0|2,0,0]=4 934 B14R2.24 O=S1CCNC[C@H]1c2ccccc2 Amb27643356 [1,0,0,1,0,0|2,0,0]=4 935 B14R2.24 OC1CCCCC1c2ccccc2 Amb4005667 [1,0,0,1,0,0|2,0,0]=4 936 B14R2.24 OC1CCNCC1c2ccccc2 Amb26376883 [1,0,0,1,0,0|1,0,0]=3 937 B14R2.24 O[C@@H]1CCCCC1c2ccccc2 Amb27179098 [1,0,0,1,0,0|2,0,0]=4 938 B14R2.24 O[C@@H]1CCCC[C@@H]1c2ccccc2 Amb27844166 [1,0,0,1,0,0|2,0,0]=4 939 B14R2.24 O[C@@H]1CCCC[C@H]1c2ccccc2 Amb8384673 [1,0,0,1,0,0|2,0,0]=4 940 B14R2.24 O[C@H]1CCCC[C@@H]1c2ccccc2 Amb20242422 [1,0,0,1,0,0|2,0,0]=4 941 B14R2.24 O[C@H]1CCCC[C@H]1c2ccccc2 Amb28066562 [1,0,0,1,0,0|2,0,0]=4 942 B14R2.24 SC1CCCCC1c2ccccc2 Amb26490747 [1,0,0,1,0,0|2,0,0]=4 943 B14R2.30 CC1CCN[C@H]1Cc2ccccc2 Amb27947239 [1,0,0,1,0,0|1,0,0]=3 944 B14R2.30 C[C@@H]1CCN[C@H]1Cc2ccccc2 Amb18197090 [1,0,0,1,0,0|1,0,0]=3 945 B14R2.30 C[C@H]1CCN[C@@H]1Cc2ccccc2 Amb27624379 [1,0,0,1,0,0|1,0,0]=3 946 B14R2.30 ClC1CCCC1Cc2ccncc2 Amb27181063 [1,0,0,1,0,0|2,0,0]=4 947 B14R2.30 ClC1CCCC1Oc2ccccc2 Amb28040809 [1,0,0,1,0,0|2,0,0]=4 948 B14R2.30 ClC1CCOC1Oc2ccccc2 Amb27632462 [1,0,0,1,0,0|2,0,0]=4 949 B14R2.30 ClC1COCC1Cc2ccccc2 Amb29877819 [1,0,0,1,0,0|2,0,0]=4 950 B14R2.30 Cl[C@@H]1CCC[C@@H]1Sc2ccccc2 Amb27219497 [1,0,0,1,0,0|2,0,0]=4 951 B14R2.30 Cl[C@@H]1CCC[C@H]1Sc2ccccc2 Amb27219834 [1,0,0,1,0,0|2,0,0]=4 952 B14R2.30 Cl[C@H]1CCC[C@@H]1Sc2ccccc2 Amb28053491 [1,0,0,1,0,0|2,0,0]=4 953 B14R2.30 FC1CCNC1Cc2ccccc2 Amb27224993 [1,0,0,1,0,0|0,1,0]=3 954 B14R2.30 NC1CCCC1Cc2ccccc2 Amb18284144 [1,0,0,1,0,0|2,0,0]=4 955 B14R2.30 NC1CCN[C@@H]1Cc2ccccc2 Amb18196512 [1,0,0,1,0,0|1,0,0]=3 956 B14R2.30 NC1CCOC1Cc2ccccc2 Amb28349412 [1,0,0,1,0,0|2,0,0]=4 957 B14R2.30 N[C@H]1CCC[C@H]1Cc2ccccc2 Amb27244825 [1,0,0,1,0,0|2,0,0]=4 958 B14R2.30 O=C1CCNC1Cc2ccccc2 Amb27863834 [1,0,0,1,0,0|1,0,1]=4 959 B14R2.30 O=C1CCN[C@@H]1Cc2ccccc2 Amb18197192 [1,0,0,1,0,0|1,0,1]=4 960 B14R2.30 OC1CCCC1Cc2ccccc2 Amb18808902 [1,0,0,1,0,0|2,0,0]=4 961 B14R2.30 OC1CCC[C@@H]1Cc2ccccc2 Amb27260244 [1,0,0,1,0,0|2,0,0]=4 962 B14R2.30 OC1CCNC1Cc2ccccc2 Amb32410236 [1,0,0,1,0,0|1,0,0]=3 963 B14R2.30 OC1CCN[C@@H]1Cc2ccccc2 Amb18195900 [1,0,0,1,0,0|1,0,0]=3 964 B14R2.30 OC1CCN[C@H]1Cc2ccccc2 Amb24489269 [1,0,0,1,0,0|1,0,0]=3 965 B14R2.30 OC1CCOC1Cc2ccccc2 Amb27179516 [1,0,0,1,0,0|2,0,0]=4 966 B14R2.30 O[C@@H]1CCC[C@@H]1Cc2ccccc2 Amb27452089 [1,0,0,1,0,0|2,0,0]=4 967 B14R2.30 O[C@@H]1CCC[C@H]1Cc2ccccc2 Amb26905499 [1,0,0,1,0,0|2,0,0]=4 968 B14R2.30 O[C@H]1CCN[C@H]1Cc2ccccc2 Amb27966070 [1,0,0,1,0,0|1,0,0]=3 969 B14R2.31 OC1CCC1CCc2ccccc2 Amb32944290 [1,0,0,1,0,0|2,0,0]=4 970 B14R2.33 NCC[C@@H]1C[C@H]1Cc2ccccc2 Amb32721299 [1,0,0,1,0,0|2,0,0]=4 971 B14R2.33 OCC[C@@H]1C[C@H]1Cc2ccccc2 Amb32646037 [1,0,0,1,0,0|2,0,0]=4 972 B14R2.78 NCC1CCC1Cc2ccccc2 Amb27609004 [1,0,0,1,0,0|2,0,0]=4 973 B14R2.87 NCC1CC1CCc2ccccc2 Amb32951857 [1,0,0,1,0,0|2,0,0]=4 974 B14R2.87 NC[C@@H]1C[C@H]1CCc2ccccc2 Amb32951856 [1,0,0,1,0,0|2,0,0]=4 975 B14R2.101 C1=C(CCc2ccccc2)CCC1 Amb28288576 [1,0,0,1,0,0|2,0,0]=4 976 B14R2.101 c1cc(CCN2CCCC2)ccn1 Amb590690 [1,0,0,1,0,0|2,0,0]=4 977 B14R2.101 c1ccc(CCC2=NCCC2)cc1 Amb17619263 [1,0,0,1,0,0|2,0,0]=4 978 B14R2.101 c1ccc(CCC2CCCN2)cc1 Amb10609225 [1,0,0,1,0,0|2,0,0]=4 979 B14R2.101 c1ccc(CCC2CCCN2)cc1 Amb3788238 [1,0,0,1,0,0|2,0,0]=4 980 B14R2.101 c1ccc(CCN2CCCN2)cc1 Amb27779956 [1,0,0,1,0,0|1,0,0]=3 981 B14R2.101 c1ccc(CC[C@@H]2CCCN2)cc1 Amb27647579 [1,0,0,1,0,0|2,0,0]=4 982 B14R2.101 c1cncc(CCN2CCCN2)c1 Amb27969470 [1,0,0,1,0,0|2,0,0]=4 983 B14R2.1253 c1ccc(C2CCCCCC2)cc1 Amb27954588 [1,0,0,1,0,0|2,0,0]=4 984 B14R2.1253 c1ccc(C2CCCCCN2)cc1 Amb10609226 [1,0,0,1,0,0|2,0,0]=4 985 B14R2.1253 c1ccc(C2CCCCCN2)cc1 Amb2234659 [1,0,0,1,0,0|2,0,0]=4 986 B14R2.1253 c1ccc(C2CCCCNC2)cc1 Amb21937009 [1,0,0,1,0,0|1,0,0]=3 987 B14R2.1253 c1ccc(C2CCCCNC2)nc1 Amb27466206 [1,0,0,1,0,0|2,0,0]=4 988 B14R2.1253 c1ccc(C2CNCCCN2)cc1 Amb2696383 [1,0,0,1,0,0|1,0,0]=3 989 B14R2.1253 c1ccc(C2CNCCCO2)cc1 Amb20668525 [1,0,0,1,0,0|1,0,0]=3 990 B14R2.1253 c1ccc(C2CNCCCO2)cc1 Amb9358450 [1,0,0,1,0,0|1,0,0]=3 991 B14R2.1253 c1ccc(C2CNCCOC2)cc1 Amb18065703 [1,0,0,1,0,0|2,0,0]=4 992 B14R2.1253 c1ccc(C2CSCCCN2)cc1 Amb25341704 [1,0,0,1,0,0|2,0,0]=4 993 B14R2.1253 c1ccc([C@H]2CCCCCN2)cc1 Amb27655522 [1,0,0,1,0,0|2,0,0]=4 994 B14R2.2014 COC1CNCCc2ccccc21 Amb35789430 [1,0,0,1,0,0|2,0,0]=4 995 B14R2.2014 COC1CNCCc2ccccc21 Amb35789723 [1,0,0,1,0,0|2,0,0]=4 996 B14R2.2839 c1ccc2c(c1)CCCCCCN2 Amb9783376 [1,0,0,1,0,0|2,0,0]=4 997 B14R2.3018 c1ccc(CCNCC2CC2)cc1 Amb6686732 [1,0,0,1,0,0|1,0,0]=3 998 B14R2.3018 c1ccc(CCNCC2CC2)nc1 Amb9423079 [1,0,0,1,0,0|2,0,0]=4 999 B14R2.3018 c1ccc(CCOCC2CO2)cc1 Amb9208562 [1,0,0,1,0,0|2,0,0]=4 1000 B14R2.3018 c1ccc(CONCC2CC2)cc1 Amb27162934 [1,0,0,1,0,0|2,0,0]=4 1001 B14R2.3019 c1ccc(CCNC2CCC2)cc1 Amb18308956 [1,0,0,1,0,0|1,0,0]=3 1002 B14R2.3019 c1ccc(CCNC2CCC2)nc1 Amb18808909 [1,0,0,1,0,0|2,0,0]=4 1003 B14R2.7150 BrCCC1CCCc2ccccc21 Amb25882010 [1,0,0,1,0,0|1,1,0]=4 1004 B14R2.7150 CCCC1NCCc2ccccc21 Amb18961209 [1,0,0,1,0,0|1,0,0]=3 1005 B14R2.7150 CCCC1NCCc2ccccc21 Amb33330006 [1,0,0,1,0,0|1,0,0]=3 1006 B14R2.7150 CNCC1NCCc2ccccc21 Amb18956501 [1,0,0,1,0,0|2,0,0]=4 1007 B14R2.7150 COCC1NCCc2ccccc21 Amb29848144 [1,0,0,1,0,0|2,0,0]=4 1008 B14R2.7150 ClCCC1CCCc2ccccc21 Amb27645461 [1,0,0,1,0,0|1,0,0]=3 1009 B14R2.7150 ClCCC1CCCc2ncccc21 Amb27466203 [1,0,0,1,0,0|2,0,0]=4 1010 B14R2.7150 ClCCC1CCOc2ccccc21 Amb27969896 [1,0,0,1,0,0|2,0,0]=4 1011 B14R2.7150 ClCCN1CCCc2ccccc21 Amb17337045 [1,0,0,1,0,0|2,0,0]=4 1012 B14R2.7150 N#CCC1NCCc2ccccc21 Amb1993743 [1,0,0,1,0,0|1,0,1]=4 1013 B14R2.7150 N#CCC1NCCc2ccccc21 Amb1993774 [1,0,0,1,0,0|1,0,1]=4 1014 B14R2.7150 NCCC1CCCc2ccccc21 Amb17226685 [1,0,0,1,0,0|2,0,0]=4 1015 B14R2.7150 NCCC1NCCc2ncccc21 Amb18824948 [1,0,0,1,0,0|2,0,0]=4 1016 B14R2.7150 NCCC1OCCc2ccccc21 Amb22642244 [1,0,0,1,0,0|2,0,0]=4 1017 B14R2.7150 OCCC1CCCc2ccccc21 Amb17233225 [1,0,0,1,0,0|2,0,0]=4 1018 B14R2.7150 OCCC1NCCc2ccccc21 Amb17193933 [1,0,0,1,0,0|1,0,0]=3 1019 B14R2.7150 OCC[C@@H]1OCCc2ccccc21 Amb22757041 [1,0,0,1,0,0|2,0,0]=4 1020 B14R2.7150 OCC[C@H]1OCCc2ccccc21 Amb27752370 [1,0,0,1,0,0|2,0,0]=4 1021 B14R2.7150 SCCC1CCCc2ccccc21 Amb33379975 [1,0,0,1,0,0|2,0,0]=4 1022 B14R2.24101 NC1CCCCCc2ccccc21 Amb27184614 [1,0,0,1,0,0|2,0,0]=4 1023 B14R2.24101 OC1CCCCCc2ccccc21 Amb28400793 [1,0,0,1,0,0|2,0,0]=4 1024 B14R2.24101 O[C@H]1CCCCCc2ccccc21 Amb27978086 [1,0,0,1,0,0|2,0,0]=4 1025 B14R2.19 BrC1CCC(Cc2ccccc2)C1 Amb25345569 [1,0,0,1,0,0|0,1,0]=3 1026 B14R2.19 BrC1CCC(Cc2cccnc2)C1 Amb27483680 [1,0,0,1,0,0|1,1,0]=4 1027 B14R2.19 BrC1CCN(Cc2ccccc2)C1 Amb21861133 [1,0,0,1,0,0|1,1,0]=4 1028 B14R2.19 Br[C@@H]1CCN(Cc2ccccc2)C1 Amb22225143 [1,0,0,1,0,0|1,1,0]=4 1029 B14R2.19 Br[C@H]1CCN(Cc2ccccc2)C1 Amb22225474 [1,0,0,1,0,0|1,1,0]=4 1030 B14R2.19 CC1CC(Cc2ccccc2)CN1 Amb9777222 [1,0,0,1,0,0|2,0,0]=4 1031 B14R2.19 CC1CCC(Nc2ccccc2)C1 Amb25295035 [1,0,0,1,0,0|2,0,0]=4 1032 B14R2.19 CC1CCN(Cc2ccccc2)C1 Amb26319590 [1,0,0,1,0,0|2,0,0]=4 1033 B14R2.19 CC1CNC(Cc2ccccc2)S1 Amb28343147 [1,0,0,1,0,0|1,0,0]=3 1034 B14R2.19 C[C@@H]1CCN(Cc2ccccc2)C1 Amb27645266 [1,0,0,1,0,0|2,0,0]=4 1035 B14R2.19 C[C@@H]1CN[C@H](Cc2ccccc2)C1 Amb27427697 [1,0,0,1,0,0|0,0,0]=2 1036 B14R2.19 C[C@H]1CN[C@@H](Cc2ccccc2)C1 Amb18197087 [1,0,0,1,0,0|0,0,0]=2 1037 B14R2.19 ClC1CCC(Cc2ccccc2)C1 Amb27443400 [1,0,0,1,0,0|0,0,0]=2 1038 B14R2.19 ClC1CCC(Cc2ccncc2)C1 Amb27855920 [1,0,0,1,0,0|1,0,0]=3 1039 B14R2.19 ClC1CCN(Cc2ccccn2)C1 Amb27198187 [1,0,0,1,0,0|2,0,0]=4 1040 B14R2.19 Cl[C@@H]1CCN(Cc2ccccc2)C1 Amb22225145 [1,0,0,1,0,0|1,0,0]=3 1041 B14R2.19 Cl[C@H]1CCN(Cc2ccccc2)C1 Amb22225476 [1,0,0,1,0,0|1,0,0]=3 1042 B14R2.19 F[C@@H]1CCN(Cc2ccccc2)C1 Amb22296663 [1,0,0,1,0,0|1,1,0]=4 1043 B14R2.19 I[C@@H]1CCN(Cc2ccccc2)C1 Amb22225149 [1,0,0,1,0,0|1,1,0]=4 1044 B14R2.19 I[C@H]1CCN(Cc2ccccc2)C1 Amb22225479 [1,0,0,1,0,0|1,1,0]=4 1045 B14R2.19 NC1CCC(Cc2ccccc2)C1 Amb25337996 [1,0,0,1,0,0|1,0,0]=3 1046 B14R2.19 NC1CCN(Cc2ccccc2)C1 Amb1680318 [1,0,0,1,0,0|2,0,0]=4 1047 B14R2.19 NC1CCN(Cc2ccccc2)C1 Amb8396676 [1,0,0,1,0,0|2,0,0]=4 1048 B14R2.19 NC1COC(Cc2ccccc2)C1 Amb35593782 [1,0,0,1,0,0|2,0,0]=4 1049 B14R2.19 N[C@@H]1CCN(Cc2ccccc2)C1 Amb17739648 [1,0,0,1,0,0|2,0,0]=4 1050 B14R2.19 N[C@@H]1CCN(Cc2ccccc2)C1 Amb20242773 [1,0,0,1,0,0|2,0,0]=4 1051 B14R2.19 N[C@@H]1CCN(Cc2ccccc2)C1 Amb4297099 [1,0,0,1,0,0|2,0,0]=4 1052 B14R2.19 N[C@H]1CCN(Cc2ccccc2)C1 Amb3939621 [1,0,0,1,0,0|2,0,0]=4 1053 B14R2.19 N[C@H]1CCN(Cc2ccccc2)C1 Amb8384309 [1,0,0,1,0,0|2,0,0]=4 1054 B14R2.19 O=C1CCC(Cc2ccccc2)C1 Amb24455173 [1,0,0,1,0,0|1,0,1]=4 1055 B14R2.19 OC1CC(Cc2ccccc2)CO1 Amb22752560 [1,0,0,1,0,0|2,0,0]=4 1056 B14R2.19 OC1CCC(Cc2ccccc2)C1 Amb27664443 [1,0,0,1,0,0|1,0,0]=3 1057 B14R2.19 OC1CCC(Cc2ccncc2)C1 Amb27180953 [1,0,0,1,0,0|2,0,0]=4 1058 B14R2.19 OC1CCC(Sc2ccccc2)C1 Amb27169917 [1,0,0,1,0,0|2,0,0]=4 1059 B14R2.19 OC1CCN(Cc2ccccc2)C1 Amb9204474 [1,0,0,1,0,0|2,0,0]=4 1060 B14R2.19 OC1CNC(Cc2ccccc2)C1 Amb23454017 [1,0,0,1,0,0|1,0,0]=3 1061 B14R2.19 O[C@@H]1CCN(Cc2ccccc2)C1 Amb4606019 [1,0,0,1,0,0|2,0,0]=4 1062 B14R2.19 O[C@H]1CCN(Cc2ccccc2)C1 Amb2684678 [1,0,0,1,0,0|2,0,0]=4 1063 B14R2.19 SC1CCN(Cc2ccccc2)C1 Amb7808536 [1,0,0,1,0,0|2,0,0]=4 1064 B14R2.67 BrCCCC1Cc2ccccc2C1 Amb33432099 [1,0,0,1,0,0|0,1,0]=3 1065 B14R2.67 C#CCCC1Cc2ccccc2C1 Amb33342536 [1,0,0,1,0,0|1,0,1]=4 1066 B14R2.67 C=CCNC1Cc2ccccc2C1 Amb9373544 [1,0,0,1,0,0|0,0,2]=4 1067 B14R2.67 CCCNC1Cc2ccccc2C1 Amb2182882 [1,0,0,1,0,0|0,0,0]=2 1068 B14R2.67 CCCNC1Cc2ccccc2C1 Amb844698 [1,0,0,1,0,0|0,0,0]=2 1069 B14R2.67 CCCSC1Cc2ccccc2C1 Amb28051413 [1,0,0,1,0,0|1,0,0]=3 1070 B14R2.67 CCONC1Cc2ccccc2C1 Amb28399119 [1,0,0,1,0,0|1,0,0]=3 1071 B14R2.67 CNCCC1Cc2ccccc2C1 Amb25097431 [1,0,0,1,0,0|2,0,0]=4 1072 B14R2.67 N#CCCC1Cc2ccccc2C1 Amb33143759 [1,0,0,1,0,0|1,0,1]=4 1073 B14R2.67 NCCCC1Cc2ccccc2C1 Amb27606361 [1,0,0,1,0,0|1,0,0]=3 1074 B14R2.67 NCCCN1Cc2ccccc2C1 Amb1130974 [1,0,0,1,0,0|2,0,0]=4 1075 B14R2.67 NCCCN1Cc2ccccc2C1 Amb5248242 [1,0,0,1,0,0|2,0,0]=4 1076 B14R2.67 NCCOC1Cc2ccccc2C1 Amb33342510 [1,0,0,1,0,0|2,0,0]=4 1077 B14R2.67 NOCCC1Cc2ccccc2C1 Amb33342868 [1,0,0,1,0,0|2,0,0]=4 1078 B14R2.67 O=CCCC1Cc2ccccc2C1 Amb33342535 [1,0,0,1,0,0|1,0,1]=4 1079 B14R2.67 OCCCC1Cc2ccccc2C1 Amb25761184 [1,0,0,1,0,0|1,0,0]=3 1080 B14R2.67 OCCCC1Cc2ccccc2N1 Amb27463172 [1,0,0,1,0,0|2,0,0]=4 1081 B14R2.67 OCCCC1Cc2ccccc2O1 Amb27597695 [1,0,0,1,0,0|2,0,0]=4 1082 B14R2.67 OCCCN1Cc2ccccc2C1 Amb17233289 [1,0,0,1,0,0|2,0,0]=4 1083 B14R2.67 OCCNC1Cc2ccccc2C1 Amb9373822 [1,0,0,1,0,0|1,0,0]=3 1084 B14R2.67 OCCSC1Cc2ccccc2C1 Amb28043793 [1,0,0,1,0,0|2,0,0]=4 1085 B14R2.67 SCCCC1Cc2ccccc2C1 Amb33342307 [1,0,0,1,0,0|1,0,0]=3 1086 B14R2.67 [C-]#[N+]CCC1Cc2ccccc2C1 Amb33342893 [1,0,0,1,0,0|2,0,0]=4 1087 B14R2.84 OC[C@@H]1CC(O)[C@H]1c2ccccc2 Amb27978456 [1,0,0,1,0,0|2,0,0]=4 1088 B14R2.90 BrCC1CN(Cc2ccccc2)C1 Amb22499973 [1,0,0,1,0,0|1,1,0]=4 1089 B14R2.90 CCC1CC(Nc2ccccc2)C1 Amb27833286 [1,0,0,1,0,0|2,0,0]=4 1090 B14R2.90 ClCC1CC(Nc2ccccn2)C1 Amb35662999 [1,0,0,1,0,0|2,0,0]=4 1091 B14R2.90 ClCC1CC(Nc2ccncc2)C1 Amb35664494 [1,0,0,1,0,0|2,0,0]=4 1092 B14R2.90 ClCC1CN(Cc2ccccn2)C1 Amb27440672 [1,0,0,1,0,0|2,0,0]=4 1093 B14R2.90 NCC1CC(Cc2ccccc2)C1 Amb25045598 [1,0,0,1,0,0|1,0,0]=3 1094 B14R2.90 NCC1CC(Cc2ccccn2)C1 Amb26514242 [1,0,0,1,0,0|2,0,0]=4 1095 B14R2.90 NCC1CC(Cc2cccnc2)C1 Amb27983022 [1,0,0,1,0,0|2,0,0]=4 1096 B14R2.90 NCC1CC(Cc2ccncc2)C1 Amb26864879 [1,0,0,1,0,0|2,0,0]=4 1097 B14R2.90 NCC1CN(Cc2ccccc2)C1 Amb20240968 [1,0,0,1,0,0|2,0,0]=4 1098 B14R2.90 OCC1CC(Oc2ccccc2)C1 Amb26596752 [1,0,0,1,0,0|2,0,0]=4 1099 B14R2.90 OCC1CN(Cc2ccccc2)C1 Amb2444593 [1,0,0,1,0,0|2,0,0]=4 1100 B14R2.277 CC1CNC(C)C1c2ccncc2 Amb27489835 [1,0,0,1,0,0|1,0,0]=3 1101 B14R2.277 CC1CNC(C)C1c2cnccn2 Amb35600829 [1,0,0,1,0,0|2,0,0]=4 1102 B14R2.277 CC1CNC(C)C1c2cncnc2 Amb27469039 [1,0,0,1,0,0|2,0,0]=4 1103 B14R2.277 CC1CNC(C)N1c2ccccc2 Amb27482651 [1,0,0,1,0,0|1,0,0]=3 1104 B14R2.277 CN1CCC(N)C1c2ccccc2 Amb18196511 [1,0,0,1,0,0|2,0,0]=4 1105 B14R2.277 CN1CCC(N)C1c2ccccc2 Amb32412000 [1,0,0,1,0,0|2,0,0]=4 1106 B14R2.277 CN1CC[C@@H](N)[C@@H]1c2ccccc2 Amb33033203 [1,0,0,1,0,0|2,0,0]=4 1107 B14R2.277 C[C@H]1CCC(=O)[C@@H]1c2ccccc2 Amb27855033 [1,0,0,1,0,0|1,0,1]=4 1108 B14R2.277 C[C@H]1CNC(=O)[C@H]1c2ccccc2 Amb27782414 [1,0,0,1,0,0|1,0,1]=4 1109 B14R2.287 CC1CCC(C)c2ccccc2N1 Amb27667825 [1,0,0,1,0,0|2,0,0]=4 1110 B14R2.287 CC1CCC(N)Cc2ccccc21 Amb33096784 [1,0,0,1,0,0|2,0,0]=4 1111 B14R2.287 CC1CNC(C)c2ccccc2C1 Amb28243533 [1,0,0,1,0,0|2,0,0]=4 1112 B14R2.287 CC1Cc2ccccc2C(C)CN1 Amb27206602 [1,0,0,1,0,0|0,0,0]=2 1113 B14R2.287 CC1Cc2ccccc2C(O)CN1 Amb27638953 [1,0,0,1,0,0|1,0,0]=3 1114 B14R2.343 CC1CC1C(C)Nc2ccccc2 Amb28342564 [1,0,0,1,0,0|2,0,0]=4 1115 B14R2.343 CC1CC1C(Cl)Cc2ccccc2 Amb18317922 [1,0,0,1,0,0|2,0,0]=4 1116 B14R2.391 CN1CCCCc2ccccc2C1 Amb27946054 [1,0,0,1,0,0|2,0,0]=4 1117 B14R2.391 O=C1Cc2ccccc2CCCN1 Amb28252381 [1,0,0,1,0,0|1,0,1]=4 1118 B14R2.411 CC1(Cc2ccccc2)CCCN1 Amb24451316 [1,0,0,1,0,0|0,0,0]=2 1119 B14R2.411 CC1(Cc2ccccc2)CCCN1 Amb32835855 [1,0,0,1,0,0|0,0,0]=2 1120 B14R2.411 CC1(Cc2ccccc2)CCNC1 Amb18966917 [1,0,0,1,0,0|2,0,0]=4 1121 B14R2.411 CC1(Cc2ccccc2)NCCS1 Amb26847865 [1,0,0,1,0,0|1,0,0]=3 1122 B14R2.411 CC1(Cc2cnccn2)CCCN1 Amb35603009 [1,0,0,1,0,0|2,0,0]=4 1123 B14R2.411 FC1(Cc2ccccc2)CCCC1 Amb27816851 [1,0,0,1,0,0|2,0,0]=4 1124 B14R2.411 NC1(Cc2ccccc2)CCCC1 Amb32990145 [1,0,0,1,0,0|2,0,0]=4 1125 B14R2.411 NC1(Cc2ccccc2)CCCC1 Amb5737622 [1,0,0,1,0,0|2,0,0]=4 1126 B14R2.411 OC1(Cc2ccccc2)CCCC1 Amb9675988 [1,0,0,1,0,0|2,0,0]=4 1127 B14R2.517 CC1Cc2ccccc2N1CCCl Amb17337050 [1,0,0,1,0,0|0,0,0]=2 1128 B14R2.517 CC1Cc2ccccc2N1CCI Amb27586076 [1,0,0,1,0,0|0,1,0]=3 1129 B14R2.517 CC1Cc2ccccc2N1CCN Amb9677378 [1,0,0,1,0,0|1,0,0]=3 1130 B14R2.517 CC1Cc2ccccc2N1CCN Amb9713442 [1,0,0,1,0,0|1,0,0]=3 1131 B14R2.517 CCCN1c2ccccc2CC1C Amb27857753 [1,0,0,1,0,0|0,0,0]=2 1132 B14R2.517 CN1Cc2ccccc2C1CCN Amb18196566 [1,0,0,1,0,0|2,0,0]=4 1133 B14R2.517 CSCN1c2ccccc2CC1C Amb27789074 [1,0,0,1,0,0|1,0,0]=3 1134 B14R2.517 Cc1cc2ccccc2n1CCCl Amb27168563 [1,0,0,1,0,0|0,0,2]=4 1135 B14R2.517 Cc1nc2ccccc2n1CCCl Amb9209762 [1,0,0,1,0,0|1,0,1]=4 1136 B14R2.1039 CC1(Cc2ccccc2)CC1CCl Amb27608696 [1,0,0,1,0,0|0,0,0]=2 1137 B14R2.1146 C=CC1NC(C)Cc2ccccc21 Amb27224024 [1,0,0,1,0,0|0,0,2]=4 1138 B14R2.1146 CC1Cc2ccccc2C(CN)N1 Amb27974132 [1,0,0,1,0,0|1,0,0]=3 1139 B14R2.1146 CCC1NC(C)=Nc2ccccc21 Amb27828572 [1,0,0,1,0,0|1,0,1]=4 1140 B14R2.1146 CC[C@@H]1C[C@H](C)Nc2ccccc21 Amb27966067 [1,0,0,1,0,0|2,0,0]=4 1141 B14R2.1146 CN1Cc2ccccc2C(CN)C1 Amb17400579 [1,0,0,1,0,0|2,0,0]=4 1142 B14R2.9589 BrC(Cc1ccccc1)C2CCC2 Amb27458119 [1,0,0,1,0,0|2,0,0]=4 1143 B14R2.9589 CC(Cc1ccncc1)N2CCC2 Amb28078876 [1,0,0,1,0,0|1,0,0]=3 1144 B14R2.9589 CC(Nc1ccccc1)C2CCC2 Amb27975448 [1,0,0,1,0,0|2,0,0]=4 1145 B14R2.9589 ClC(Cc1ccccc1)C2CCC2 Amb18317923 [1,0,0,1,0,0|2,0,0]=4 1146 B14R2.9593 CN(Cc1ccccc1)CC2CC2 Amb17233128 [1,0,0,1,0,0|2,0,0]=4 1147 B14R2.9593 CN(Cc1ccccc1)CC2CO2 Amb9711892 [1,0,0,1,0,0|2,0,0]=4 1148 B14R2.9593 CN(Cc1ccccc1)C[C@@H]2CO2 Amb27775618 [1,0,0,1,0,0|2,0,0]=4 1149 B14R2.9593 O=C(Cc1ccccc1)NC2CC2 Amb16191813 [1,0,0,1,0,0|1,0,1]=4 1150 B14R2.8 BrCC1CCC(c2ccccc2)C1 Amb25118230 [0,0,0,1,1,0|1,1,0]=4 1151 B14R2.8 BrC[C@H]1CC[C@H](c2ccccc2)C1 Amb32663664 [0,0,0,1,1,0|1,1,0]=4 1152 B14R2.8 CCC1CNC(c2ccccc2)O1 Amb27803845 [0,0,0,1,1,0|2,0,0]=4 1153 B14R2.8 ClCC1CNC(c2ccccc2)O1 Amb22330510 [0,0,0,1,1,0|1,0,0]=3 1154 B14R2.8 ClCC1COC(c2ccccc2)O1 Amb534375 [0,0,0,1,1,0|2,0,0]=4 1155 B14R2.8 ClC[C@@H]1CO[C@H](c2ccccc2)O1 Amb28076704 [0,0,0,1,1,0|2,0,0]=4 1156 B14R2.8 ClC[C@@H]1CS[C@@H](c2ccccc2)O1 Amb27623218 [0,0,0,1,1,0|2,0,0]=4 1157 B14R2.8 ClC[C@H]1COC(c2ccccc2)O1 Amb28195089 [0,0,0,1,1,0|2,0,0]=4 1158 B14R2.8 ClC[C@H]1CS[C@@H](c2ccccc2)O1 Amb28053533 [0,0,0,1,1,0|2,0,0]=4 1159 B14R2.8 NCC1CCC(c2ccccc2)C1 Amb18065570 [0,0,0,1,1,0|2,0,0]=4 1160 B14R2.8 OCC1CCC(c2ccccc2)C1 Amb27415089 [0,0,0,1,1,0|2,0,0]=4 1161 B14R2.8 OCC1COC(c2ccccc2)C1 Amb27206483 [0,0,0,1,1,0|2,0,0]=4 1162 B14R2.8 OC[C@@H]1CC[C@@H](c2ccccc2)C1 Amb26389433 [0,0,0,1,1,0|2,0,0]=4 1163 B14R2.21 BrC1CCOC(c2ccccc2)C1 Amb25954318 [0,0,0,1,1,0|1,1,0]=4 1164 B14R2.21 Br[C@@H]1CCO[C@@H](c2ccccc2)C1 Amb27211880 [0,0,0,1,1,0|1,1,0]=4 1165 B14R2.21 Br[C@H]1CCO[C@H](c2ccccc2)C1 Amb22898808 [0,0,0,1,1,0|1,1,0]=4 1166 B14R2.21 CC1CCNC(c2ccccc2)C1 Amb24066154 [0,0,0,1,1,0|1,0,0]=3 1167 B14R2.21 CC1CCNC(c2ccccc2)S1 Amb27757530 [0,0,0,1,1,0|2,0,0]=4 1168 B14R2.21 CC1CCNC(c2cccnc2)C1 Amb27882256 [0,0,0,1,1,0|2,0,0]=4 1169 B14R2.21 CN1CCNC(c2ccccc2)C1 Amb1672626 [0,0,0,1,1,0|2,0,0]=4 1170 B14R2.21 CN1CCNC(c2ccccc2)C1 Amb24064755 [0,0,0,1,1,0|2,0,0]=4 1171 B14R2.21 CN1CCN[C@@H](c2ccccc2)C1 Amb22032546 [0,0,0,1,1,0|2,0,0]=4 1172 B14R2.21 ClC1CCCC(c2ccccc2)C1 Amb4035352 [0,0,0,1,1,0|1,0,0]=3 1173 B14R2.21 Cl[C@@H]1CCC[C@@H](c2ccccc2)C1 Amb28132362 [0,0,0,1,1,0|1,0,0]=3 1174 B14R2.21 NC1CCCC(c2ccccc2)C1 Amb24183813 [0,0,0,1,1,0|2,0,0]=4 1175 B14R2.21 NC1CCCC(c2ccccc2)C1 Amb33546016 [0,0,0,1,1,0|2,0,0]=4 1176 B14R2.21 NC1CCNC(c2ccccc2)C1 Amb25160938 [0,0,0,1,1,0|1,0,0]=3 1177 B14R2.21 NC1CCNC(c2ccccn2)C1 Amb27857227 [0,0,0,1,1,0|2,0,0]=4 1178 B14R2.21 NC1CCOC(c2ccccc2)C1 Amb27663848 [0,0,0,1,1,0|2,0,0]=4 1179 B14R2.21 NC1CCOC(c2ccccc2)C1 Amb33551617 [0,0,0,1,1,0|2,0,0]=4 1180 B14R2.21 N[C@@H]1CCO[C@@H](c2ccccc2)C1 Amb25940690 [0,0,0,1,1,0|2,0,0]=4 1181 B14R2.21 N[C@@H]1CCO[C@H](c2ccccc2)C1 Amb27203356 [0,0,0,1,1,0|2,0,0]=4 1182 B14R2.21 N[C@H]1CCO[C@@H](c2ccccc2)C1 Amb22747497 [0,0,0,1,1,0|2,0,0]=4 1183 B14R2.21 O=C1CCNC(c2ccccc2)C1 Amb17233086 [0,0,0,1,1,0|1,0,1]=4 1184 B14R2.21 O=C1CCNC(c2ccccc2)C1 Amb22274020 [0,0,0,1,1,0|1,0,1]=4 1185 B14R2.21 O=C1CCN[C@@H](c2ccccc2)C1 Amb27828475 [0,0,0,1,1,0|1,0,1]=4 1186 B14R2.21 O=C1CCN[C@H](c2ccccc2)C1 Amb27230890 [0,0,0,1,1,0|1,0,1]=4 1187 B14R2.21 O=S1CCNC(c2ccccc2)C1 Amb19374300 [0,0,0,1,1,0|2,0,0]=4 1188 B14R2.21 O=S1CCN[C@@H](c2ccccc2)C1 Amb27608680 [0,0,0,1,1,0|2,0,0]=4 1189 B14R2.21 OC1CCCC(c2ccccc2)C1 Amb26612874 [0,0,0,1,1,0|2,0,0]=4 1190 B14R2.21 OC1CCNC(c2ccccc2)C1 Amb17233271 [0,0,0,1,1,0|1,0,0]=3 1191 B14R2.21 OC1CCNC(c2ccccc2)C1 Amb22035160 [0,0,0,1,1,0|1,0,0]=3 1192 B14R2.21 OC1CCOC(c2ccccc2)C1 Amb21962863 [0,0,0,1,1,0|2,0,0]=4 1193 B14R2.21 O[C@@H]1CCO[C@@H](c2ccccc2)C1 Amb24722718 [0,0,0,1,1,0|2,0,0]=4 1194 B14R2.21 O[C@@H]1CCO[C@H](c2ccccc2)C1 Amb25685558 [0,0,0,1,1,0|2,0,0]=4 1195 B14R2.21 O[C@@H]1CCS[C@@H](c2ccccc2)C1 Amb27981625 [0,0,0,1,1,0|2,0,0]=4 1196 B14R2.21 O[C@H]1CCN[C@@H](c2ccccc2)C1 Amb28129750 [0,0,0,1,1,0|1,0,0]=3 1197 B14R2.21 O[C@H]1CCN[C@@H](c2ccccc2)C1 Amb33089192 [0,0,0,1,1,0|1,0,0]=3 1198 B14R2.21 O[C@H]1CCO[C@@H](c2ccccc2)C1 Amb22746392 [0,0,0,1,1,0|2,0,0]=4 1199 B14R2.41 ClCCN1CC(c2ccccc2)C1 Amb28458512 [0,0,0,1,1,0|2,0,0]=4 1200 B14R2.114 CC(c1ccccc1)C2CCCN2 Amb23536676 [0,0,0,1,1,0|2,0,0]=4 1201 B14R2.114 CC(c1ccccc1)N2CCCO2 Amb28324710 [0,0,0,1,1,0|1,0,0]=3 1202 B14R2.114 NC(c1ccccc1)N2CCCC2 Amb27881547 [0,0,0,1,1,0|2,0,0]=4 1203 B14R2.317 C[C@@H]1CCC[C@@]1(C)c2ccccc2 Amb26431459 [0,0,0,1,1,0|2,0,0]=4 1204 B14R2.317 C[C@H]1CCC[C@@]1(C)c2ccccc2 Amb24589220 [0,0,0,1,1,0|2,0,0]=4 1205 B14R2.352 CC(N[C@@H]1C[C@H]1C)c2ccccc2 Amb27809313 [0,0,0,1,1,0|1,0,0]=3 1206 B14R2.352 CC(N[C@@H]1C[C@H]1C)c2ccccn2 Amb27976005 [0,0,0,1,1,0|2,0,0]=4 1207 B14R2.352 CC(N[C@@H]1C[C@H]1C)c2ccncc2 Amb28146343 [0,0,0,1,1,0|2,0,0]=4 1208 B14R2.792 CC(NCC1CC1)c2ccccc2 Amb6537887 [0,0,0,1,1,0|1,0,0]=3 1209 B14R2.792 CC(NCC1CC1)c2ccccc2 Amb9742351 [0,0,0,1,1,0|1,0,0]=3 1210 B14R2.792 CC(NCC1CC1)c2ccccn2 Amb6686781 [0,0,0,1,1,0|2,0,0]=4 1211 B14R2.792 CC(NCC1CC1)c2cccnc2 Amb6686783 [0,0,0,1,1,0|2,0,0]=4 1212 B14R2.792 CC(NCC1CC1)c2ccncc2 Amb6686782 [0,0,0,1,1,0|2,0,0]=4 1213 B14R2.794 CC(NC1CCC1)c2ccccn2 Amb18989349 [0,0,0,1,1,0|2,0,0]=4 1214 B14R2.794 CC(NC1CCC1)c2cccnc2 Amb18296796 [0,0,0,1,1,0|2,0,0]=4 1215 B14R2.794 CC(NC1CSC1)c2ccccc2 Amb27456225 [0,0,0,1,1,0|2,0,0]=4 1216 B14R2.794 C[C@@H](NC1CCC1)c2ccccn2 Amb27608865 [0,0,0,1,1,0|2,0,0]=4 1217 B14R2.794 C[C@@H](NC1CCC1)c2cccnc2 Amb27164816 [0,0,0,1,1,0|2,0,0]=4 1218 B14R2.794 C[C@H](NC1CCC1)c2cccnc2 Amb28342783 [0,0,0,1,1,0|2,0,0]=4 1219 B14R2.794 C[C@H](NC1CCC1)c2ccncc2 Amb27609068 [0,0,0,1,1,0|2,0,0]=4 1220 B14R2.1131 CC1CCC(CN)c2ccccc21 Amb27241953 [0,0,0,1,1,0|2,0,0]=4 1221 B14R2.1131 CC1CCC(CO)c2ccccc21 Amb28045169 [0,0,0,1,1,0|2,0,0]=4 1222 B14R2.1131 CC1COC(CCl)c2ccccc21 Amb28245335 [0,0,0,1,1,0|2,0,0]=4 1223 B14R2.1131 CC[C@H]1CN[C@@H](C)c2ccccc21 Amb27637615 [0,0,0,1,1,0|1,0,0]=3 1224 B14R2.1131 C[C@@H]1CC[C@@H](CO)c2ccccc21 Amb28455579 [0,0,0,1,1,0|2,0,0]=4 1225 B14R2.1161 CC(c1ccccc1)C2CC2CN Amb33081880 [0,0,0,1,1,0|2,0,0]=4 1226 B14R2.1161 CC(c1ccccc1)C2CC2CO Amb27757281 [0,0,0,1,1,0|2,0,0]=4 1227 B14R2.1161 CC(c1ccccc1)[C@@H]2C[C@H]2CN Amb33081879 [0,0,0,1,1,0|2,0,0]=4 1228 B14R2.4510 CC1NCCN(C)c2ccccc21 Amb25787158 [0,0,0,1,1,0|2,0,0]=4 1229 B14R2.4510 CC1SCC[C@@H](N)c2ccccc21 Amb27235648 [0,0,0,1,1,0|2,0,0]=4 1230 B14R2.4510 CC1SCC[C@@H](O)c2ccccc21 Amb28204443 [0,0,0,1,1,0|2,0,0]=4 1231 B14R2.4510 CC1SCC[C@H](O)c2ccccc21 Amb28139024 [0,0,0,1,1,0|2,0,0]=4 1232 B14R2.5540 CC1(c2ccccc2)CCCCN1 Amb18063210 [0,0,0,1,1,0|1,0,0]=3 1233 B14R2.5540 CC1(c2ccccc2)COCCN1 Amb5751159 [0,0,0,1,1,0|2,0,0]=4 1234 B14R2.5540 CC1(c2ccccc2)OCCCO1 Amb1806265 [0,0,0,1,1,0|2,0,0]=4 1235 B14R2.5540 CC1(c2ccccn2)CCCCN1 Amb25157009 [0,0,0,1,1,0|2,0,0]=4 1236 B14R2.5540 CC1(c2cccnc2)CCCCN1 Amb26360387 [0,0,0,1,1,0|2,0,0]=4 1237 B14R2.5540 CC1(c2ccncc2)CCCCN1 Amb25722046 [0,0,0,1,1,0|2,0,0]=4 1238 B14R2.5540 C[C@@]1(c2ccccc2)CCCCN1 Amb24440188 [0,0,0,1,1,0|1,0,0]=3 1239 B14R2.5540 C[C@@]1(c2ccccc2)COCCN1 Amb33742234 [0,0,0,1,1,0|2,0,0]=4 1240 B14R2.5540 C[C@]1(c2ccccc2)CCCCN1 Amb28193287 [0,0,0,1,1,0|1,0,0]=3 1241 B14R2.5540 C[C@]1(c2ccccc2)COCCN1 Amb33734029 [0,0,0,1,1,0|2,0,0]=4 1242 B14R2.48 CC1NCCCOC1c2ccco2 Amb18280266 [0,0,0,1,1,0|2,0,0]=4 1243 B14R2.716 ClC1CCCC(Cc2cccs2)C1 Amb28206621 [0,0,0,1,1,0|2,0,0]=4 1244 B14R2.793 CC(Cc1cccs1)N2CCCC2 Amb27457310 [0,0,0,1,1,0|2,0,0]=4 1245 B14R2.2840 c1csc(CC2CCCCCN2)c1 Amb19374423 [0,0,0,1,1,0|2,0,0]=4 1246 B14R2.2840 c1csc(CC2CCCCCN2)c1 Amb4135048 [0,0,0,1,1,0|2,0,0]=4 1247 B14R2.5543 CC1(Cc2cccs2)NCCCS1 Amb29859795 [0,0,0,1,1,0|2,0,0]=4 1248 B14R2.5543 CC1(Cc2ccsc2)NCCCS1 Amb29859804 [0,0,0,1,1,0|2,0,0]=4 1249 B14R2.9066 CC1CCNC(C)C1n2cccc2 Amb27393843 [0,0,0,1,1,0|2,0,0]=4 1250 B16R2.252 CC1CCCC(NCc2ccccc2)C1 Amb6687358 [0,0,0,1,0,1|2,0,0]=4 1251 B16R2.252 CN1CCNC(CCc2ccccc2)C1 Amb18865095 [0,0,0,1,0,1|2,0,0]=4 1252 B16R2.252 ClC1CCCC(NCc2ccccc2)C1 Amb35740147 [0,0,0,1,0,1|1,0,0]=3 1253 B16R2.252 ClC1CCCC(NCc2ccccn2)C1 Amb35740150 [0,0,0,1,0,1|2,0,0]=4 1254 B16R2.252 ClC1CCCC(NCc2cccnc2)C1 Amb35740149 [0,0,0,1,0,1|2,0,0]=4 1255 B16R2.252 ClC1CCCC(NCc2ccncc2)C1 Amb35740148 [0,0,0,1,0,1|2,0,0]=4 1256 B16R2.252 N[C@@H]1CCC[C@H](OCc2ccccc2)C1 Amb27882752 [0,0,0,1,0,1|2,0,0]=4 1257 B16R2.252 N[C@H]1CCC[C@H](OCc2ccccc2)C1 Amb27222361 [0,0,0,1,0,1|2,0,0]=4 1258 B16R2.252 O=C1CCNC(CCc2ccccc2)C1 Amb18785348 [0,0,0,1,0,1|1,0,1]=4 1259 B16R2.252 OC1CCCC(NCc2ccccc2)C1 Amb9617271 [0,0,0,1,0,1|2,0,0]=4 1260 B16R2.252 OC1CCCC(OCc2ccccc2)C1 Amb25030389 [0,0,0,1,0,1|2,0,0]=4 1261 B16R2.252 O[C@@H]1CCC[C@@H](NCc2ccccc2)C1 Amb25168968 [0,0,0,1,0,1|2,0,0]=4 1262 B16R2.252 O[C@@H]1CCC[C@H](NCc2ccccc2)C1 Amb25168943 [0,0,0,1,0,1|2,0,0]=4 1263 B16R2.252 O[C@H]1CCC[C@@H](NCc2ccccc2)C1 Amb24631112 [0,0,0,1,0,1|2,0,0]=4 1264 B16R2.2334 ClCC1CCN(CCc2ccccc2)C1 Amb32430448 [0,0,0,1,0,1|2,0,0]=4 1265 B16R2.2441 CCCCNC1CCc2ccccc2C1 Amb9220726 [0,0,0,1,0,1|1,0,0]=3 1266 B16R2.2441 COCCNC1CCc2ccccc2C1 Amb9220598 [0,0,0,1,0,1|2,0,0]=4 1267 B16R2.2441 ClCCCCN1CCc2ccccc2C1 Amb17342937 [0,0,0,1,0,1|2,0,0]=4 1268 B16R2.2441 NCCCCC1COc2ccccc2C1 Amb33447915 [0,0,0,1,0,1|2,0,0]=4 1269 B16R2.2441 NCCCOC1COc2ccccc2C1 Amb33447549 [0,0,0,1,0,1|2,0,0]=4 1270 B16R2.2441 OCCCNC1CCc2ccccc2C1 Amb9220716 [0,0,0,1,0,1|1,0,0]=3 1271 B16R2.2443 CC1CCC(CN)C(c2ccccc2)N1 Amb33275368 [0,0,0,1,0,1|2,0,0]=4 1272 B16R2.2446 CC1CCC(CN)N1Cc2ccccc2 Amb18654794 [0,0,0,1,0,1|2,0,0]=4 1273 B16R2.3260 CC1CN(c2ccccc2)C(=O)CCN1 Amb31116714 [0,0,0,1,0,1|1,0,1]=4 1274 B16R2.3627 OCCC1CC(OCc2ccccc2)C1 Amb26613409 [0,0,0,1,0,1|2,0,0]=4 1275 B16R2.3627 OCC[C@H]1C[C@H](OCc2ccccc2)C1 Amb28206300 [0,0,0,1,0,1|2,0,0]=4 1276 B16R2.5334 C(=C\C1CCCCCN1)/c2ccccc2 Amb20667768 [0,0,0,1,0,1|1,0,1]=4 1277 B16R2.5334 c1ccc(CNC2CCCCCC2)cc1 Amb6687352 [0,0,0,1,0,1|2,0,0]=4 1278 B16R2.30013 CC1CCc2ccccc2N1CCCCl Amb27610840 [0,0,0,1,0,1|0,0,0]=2 1279 B16R2.30013 CC1COc2ccccc2N1CCCN Amb18061716 [0,0,0,1,0,1|1,0,0]=3 1280 B16R2.30013 CNCCN1c2ccccc2OCC1C Amb31143055 [0,0,0,1,0,1|2,0,0]=4 1281 B16R2.44148 CC(CC1CCC1)NCc2ccccc2 Amb27611188 [0,0,0,1,0,1|2,0,0]=4 1282 B16R2.44153 CC(CCc1ccccc1)NCC2CC2 Amb6686762 [0,0,0,1,0,1|1,0,0]=3 1283 B16R2.23 CCN1CCNC(Cc2ccccc2)C1 Amb21936966 [0,1,0,1,0,0|1,0,0]=3 1284 B16R2.23 ClCC1CCCN(Cc2ccccc2)C1 Amb15701623 [0,1,0,1,0,0|2,0,0]=4 1285 B16R2.23 ClCC1CCCN(Cc2ccccc2)C1 Amb21959747 [0,1,0,1,0,0|2,0,0]=4 1286 B16R2.23 ClCC1CN(Cc2ccccc2)CCO1 Amb1107615 [0,1,0,1,0,0|2,0,0]=4 1287 B16R2.23 ClC[C@@H]1CN(Cc2ccccc2)CCO1 Amb22232518 [0,1,0,1,0,0|2,0,0]=4 1288 B16R2.23 ClC[C@H]1CN(Cc2ccccc2)CCO1 Amb22232514 [0,1,0,1,0,0|2,0,0]=4 1289 B16R2.88 CC(Cc1ccccc1)C2CCNCC2 Amb33083006 [0,1,0,1,0,0|2,0,0]=4 1290 B16R2.88 CC(Cc1ccccc1)N2CCNCC2 Amb17089402 [0,1,0,1,0,0|1,0,0]=3 1291 B16R2.88 CC(Cc1ccccn1)N2CCNCC2 Amb17089399 [0,1,0,1,0,0|2,0,0]=4 1292 B16R2.88 CC(Cc1cccnc1)N2CCNCC2 Amb17089400 [0,1,0,1,0,0|2,0,0]=4 1293 B16R2.88 CC(Cc1ccncc1)N2CCNCC2 Amb17089401 [0,1,0,1,0,0|2,0,0]=4 1294 B16R2.92 ClCCC1CCN(Cc2ccccc2)C1 Amb22299851 [0,1,0,1,0,0|2,0,0]=4 1295 B16R2.92 ClCC[C@@H]1CCN(Cc2ccccc2)C1 Amb22299787 [0,1,0,1,0,0|2,0,0]=4 1296 B16R2.92 ClCC[C@H]1CCN(Cc2ccccc2)C1 Amb22299790 [0,1,0,1,0,0|2,0,0]=4 1297 B16R2.92 OCCC1CSC(Cc2ccccc2)N1 Amb32946501 [0,1,0,1,0,0|1,0,0]=3 1298 B16R2.524 NC(Cc1ccccc1)CN2CCCC2 Amb34914070 [0,1,0,1,0,0|2,0,0]=4 1299 B16R2.524 N[C@@H](Cc1ccccc1)CN2CCCC2 Amb34913976 [0,1,0,1,0,0|2,0,0]=4 1300 B16R2.524 N[C@@H](Cc1ccccc1)CN2CCCC2 Amb5782178 [0,1,0,1,0,0|2,0,0]=4 1301 B16R2.524 N[C@H](Cc1ccccc1)CN2CCCC2 Amb34912504 [0,1,0,1,0,0|2,0,0]=4 1302 B16R2.2875 CCCCCNC1Cc2ccccc2C1 Amb9373570 [0,1,0,1,0,0|1,0,0]=3 1303 B16R2.2875 CCOCCNC1Cc2ccccc2C1 Amb9454286 [0,1,0,1,0,0|1,0,0]=3 1304 B16R2.2875 COCCCNC1Cc2ccccc2C1 Amb9373757 [0,1,0,1,0,0|1,0,0]=3 1305 B16R2.2960 CC1(Cc2ccccc2)CCCCC1=O Amb10571312 [0,1,0,1,0,0|2,0,0]=4 1306 B16R2.6335 CC1Cc2ccccc2N1CCCCCl Amb17342938 [0,1,0,1,0,0|0,0,0]=2 1307 B16R2.12202 CC1CN(CCCN)c2ccccc2O1 Amb17307974 [0,1,0,1,0,0|2,0,0]=4 1308 B16R2.12202 CC1Cc2ccccc2N(CCCN)C1 Amb31142791 [0,1,0,1,0,0|1,0,0]=3 1309 B16R2.13402 CC1(Cc2ccccc2)CNCCNC1 Amb18865093 [0,1,0,1,0,0|2,0,0]=4 1310 B16R2.13402 CC1(Cc2ccccc2)CNCCOC1 Amb18567351 [0,1,0,1,0,0|2,0,0]=4 1311 B16R2.236 CC1CCCC(C(Br)c2ccccc2)C1 Amb27421657 [0,1,0,1,0,0|2,0,0]=4 1312 B16R2.248 CC1CCCC(C)C1(O)c2ccccc2 Amb32669884 [0,1,0,1,0,0|2,0,0]=4 1313 B16R2.2209 CC(c1ccccc1)C2CCCCCN2 Amb32684591 [0,1,0,1,0,0|1,0,0]=3 1314 B16R2.2209 NC(c1ccccc1)C2CCCCCC2 Amb22642934 [0,1,0,1,0,0|2,0,0]=4 1315 B16R2.2209 NC(c1ccccc1)C2CCCCCC2 Amb35745607 [0,1,0,1,0,0|2,0,0]=4 1316 B16R2.2209 O=C(c1ccccc1)C2CCCCCN2 Amb18785341 [0,1,0,1,0,0|1,0,1]=4 1317 B16R2.2209 OC(c1ccccc1)C2CCCCCN2 Amb18782213 [0,1,0,1,0,0|1,0,0]=3 1318 B16R2.6780 CC(C(O)c1ccccc1)N2CCCC2 Amb31292682 [0,1,0,1,0,0|1,0,0]=3 1319 B16R2.6780 C[C@@H]([C@H](N)c1ccccc1)N2CCCC2 Amb33742860 [0,1,0,1,0,0|1,0,0]=3 1320 B16R2.6780 C[C@@H]([C@H](O)c1ccccc1)N2CCCC2 Amb22366946 [0,1,0,1,0,0|1,0,0]=3 1321 B16R2.20 Fc1ccc(CN2CCC(CCl)C2)cc1 Amb27595162 [0,1,0,1,0,0|2,0,0]=4 1322 B16R2.131 CN1CCNC(Cc2ccc(Br)cc2)C1 Amb18593456 [0,1,0,1,0,0|2,0,0]=4 1323 B16R2.131 CN1CCNC(Cc2ccc(Cl)cc2)C1 Amb18571188 [0,1,0,1,0,0|2,0,0]=4 1324 B16R2.131 CN1CCNC(Cc2ccc(F)cc2)C1 Amb18568478 [0,1,0,1,0,0|2,0,0]=4 1325 B16R2.131 Cc1ccc(CC2CC(=O)CCN2)cc1 Amb18785346 [0,1,0,1,0,0|1,0,1]=4 1326 B16R2.131 Cc1ccc(CC2CN(C)CCN2)cc1 Amb18567113 [0,1,0,1,0,0|2,0,0]=4 1327 B16R2.131 ClC1CCCC(Cc2ccc(Br)cc2)C1 Amb28324888 [0,1,0,1,0,0|1,0,0]=3 1328 B16R2.131 Clc1ccc(CC2CCCC(Cl)C2)cc1 Amb27407209 [0,1,0,1,0,0|1,0,0]=3 1329 B16R2.131 Clc1ccc(CN2CCCC(Cl)C2)cc1 Amb27801898 [0,1,0,1,0,0|2,0,0]=4 1330 B16R2.131 Fc1ccc(CC2CCCC(Cl)C2)cc1 Amb27859943 [0,1,0,1,0,0|1,0,0]=3 1331 B16R2.131 N[C@H]1CCN[C@H](Cc2ccc(Cl)cc2)C1 Amb31378857 [0,1,0,1,0,0|1,0,0]=3 1332 B16R2.131 O=C1CCNC(Cc2ccc(Cl)cc2)C1 Amb18761582 [0,1,0,1,0,0|1,0,1]=4 1333 B16R2.131 O=C1CCNC(Cc2ccc(F)cc2)C1 Amb18779242 [0,1,0,1,0,0|1,0,1]=4 1334 B16R2.133 CC(Cc1ccc(N)cc1)N2CCCC2 Amb18050242 [0,1,0,1,0,0|1,0,0]=3 1335 B16R2.33107 CC1CCCC(C)C1c2ccc(N)cc2 Amb32653637 [0,1,0,1,0,0|2,0,0]=4 1336 B16R2.33330 Brc1ccc(CC2CCCCCN2)cc1 Amb3793479 [0,1,0,1,0,0|1,0,0]=3 1337 B16R2.33330 Cc1ccc(CC2CCCCCN2)cc1 Amb2235767 [0,1,0,1,0,0|1,0,0]=3 1338 B16R2.33330 Clc1ccc(CC2CCCCCN2)cc1 Amb3789636 [0,1,0,1,0,0|1,0,0]=3 1339 B16R2.33330 Fc1ccc(CC2CCCCCN2)cc1 Amb3788934 [0,1,0,1,0,0|1,0,0]=3 1340 B16R2.33330 Ic1ccc(CC2CCCCCN2)cc1 Amb32430445 [0,1,0,1,0,0|1,0,0]=3 1341 B16R2.33330 Oc1ccc(CC2CCCCCN2)cc1 Amb32430447 [0,1,0,1,0,0|1,0,0]=3 1342 B16R2.251 CN1CCNC(Cc2cccc(Br)c2)C1 Amb18074901 [0,1,0,1,0,0|2,0,0]=4 1343 B16R2.251 CN1CCNC(Cc2cccc(Cl)c2)C1 Amb18571184 [0,1,0,1,0,0|2,0,0]=4 1344 B16R2.251 CN1CCNC(Cc2cccc(F)c2)C1 Amb18568482 [0,1,0,1,0,0|2,0,0]=4 1345 B16R2.251 Cc1cccc(CC2CCCC(Br)C2)c1 Amb28206627 [0,1,0,1,0,0|1,1,0]=4 1346 B16R2.251 Cc1cccc(CC2CCCC(Cl)C2)c1 Amb28075824 [0,1,0,1,0,0|1,0,0]=3 1347 B16R2.251 Cc1cccc(CC2CN(C)CCN2)c1 Amb18567109 [0,1,0,1,0,0|2,0,0]=4 1348 B16R2.2333 Fc1cccc(CN2CCC(CCl)C2)c1 Amb27981064 [0,1,0,1,0,0|2,0,0]=4 1349 B16R2.11922 CC1CCCC(C)C1c2cccc(N)c2 Amb32653685 [0,1,0,1,0,0|2,0,0]=4 1350 B16R2.317 CC1CCC(Cl)CC1Cc2ccccn2 Amb32865825 [0,1,0,1,0,0|2,0,0]=4 1351 B16R2.317 CC1CCC(Cl)CC1Cc2cccnc2 Amb32865830 [0,1,0,1,0,0|2,0,0]=4 1352 B16R2.317 CC1CCC(Cl)CC1Cc2ccncc2 Amb32865828 [0,1,0,1,0,0|2,0,0]=4 1353 B16R2.317 CC1CCC(Cl)CN1Cc2ccccc2 Amb27795776 [0,1,0,1,0,0|2,0,0]=4 1354 B16R2.317 CC1CCC(N)CC1Cc2ccccc2 Amb32866203 [0,1,0,1,0,0|2,0,0]=4 1355 B16R2.734 COCC(C)NC1Cc2ccccc2C1 Amb9373582 [0,1,0,1,0,0|2,0,0]=4 1356 B16R2.734 NCCC(=O)NC1Cc2ccccc2C1 Amb31103147 [0,1,0,1,0,0|1,0,1]=4 1357 B16R2.734 O=C(CCCl)NC1Cc2ccccc2C1 Amb27814767 [0,1,0,1,0,0|0,0,1]=3 1358 B16R2.734 O=C(NC1Cc2ccccc2C1)OCCl Amb35609385 [0,1,0,1,0,0|1,0,1]=4 1359 B16R2.2374 CC1CN(Cc2ccccc2)CC1CCl Amb27647011 [0,1,0,1,0,0|2,0,0]=4 1360 B16R2.2374 ClCC1CN(Cc2ccccc2)CC1Cl Amb26005360 [0,1,0,1,0,0|2,0,0]=4 1361 B16R2.2374 NC1CN(Cc2ccccc2)CC1CCl Amb27795014 [0,1,0,1,0,0|2,0,0]=4 1362 B16R2.2374 OC1CN(Cc2ccccc2)CC1CCl Amb27423422 [0,1,0,1,0,0|2,0,0]=4 1363 B16R2.2374 SC1CN(Cc2ccccc2)CC1CCl Amb27209111 [0,1,0,1,0,0|2,0,0]=4 1364 B16R2.2822 CC1CC(Cl)CN(Cc2ccccc2)C1 Amb27880056 [0,1,0,1,0,0|2,0,0]=4 1365 B16R2.2822 CC1CN(C)C[C@@H](Cc2ccccc2)N1 Amb18783735 [0,1,0,1,0,0|2,0,0]=4 1366 B16R2.2822 C[C@@H]1CN(C)CC(Cc2ccccc2)N1 Amb18783736 [0,1,0,1,0,0|2,0,0]=4 1367 B16R2.3334 CN(Cc1ccccc1)CC2CC(Cl)C2 Amb27950402 [0,1,0,1,0,0|2,0,0]=4 1368 B16R2.29842 CC1Cc2ccccc2N1C(=O)CCBr Amb17333566 [0,1,0,1,0,0|0,1,1]=4 1369 B16R2.29842 CC1Cc2ccccc2N1C(=O)CCCl Amb9711971 [0,1,0,1,0,0|0,0,1]=3 1370 B16R2.29842 CC1Cc2ccccc2N1C(=O)OCCl Amb35609381 [0,1,0,1,0,0|1,0,1]=4 1371 B16R2.2 ClCC1CCN(Cc2ccccc2)CC1 Amb15701460 [0,1,0,1,0,0|2,0,0]=4 1372 B16R2.2 ClCC1CCN(Cc2ccccc2)CC1 Amb21959735 [0,1,0,1,0,0|2,0,0]=4 1373 B16R2.2 NCC1CCC(Cc2ccccc2)NC1 Amb18783818 [0,1,0,1,0,0|1,0,0]=3 1374 B16R2.2 OCC1CNC(Cc2ccccc2)CN1 Amb17579160 [0,1,0,1,0,0|1,0,0]=3 1375 B16R2.124 C[C@@H]1CN[C@H](Cc2ccccc2)CN1C Amb18783748 [0,1,0,1,0,0|2,0,0]=4 1376 B16R2.3258 ClC1CCCN(Cc2ccccc2)CC1 Amb28383048 [0,1,0,1,0,0|2,0,0]=4 1377 B16R2.11149 CC1(Cc2ccccc2)CCC(CBr)O1 Amb28191548 [0,1,0,1,0,0|1,1,0]=4 1378 B16R2.11149 CC1(Cc2ccccc2)CCC(CI)O1 Amb27872854 [0,1,0,1,0,0|1,1,0]=4 1379 B16R2.33562 CC1Cc2ccccc2N1CC(O)CBr Amb27247962 [0,1,0,1,0,0|0,1,0]=3 1380 B16R2.33562 CC1Cc2ccccc2N1CC(O)CF Amb33220193 [0,1,0,1,0,0|0,1,0]=3 1381 B16R2.33562 Cc1cc2ccccc2n1CC(C)CCl Amb27658398 [0,1,0,1,0,0|0,0,2]=4 1382 B16R2.35 CC1C(Cl)CCCN1Cc2ccccc2 Amb27227801 [0,1,0,1,0,0|2,0,0]=4 1383 B16R2.101 CNC(Cc1ccccc1)C2CCCO2 Amb33483452 [0,1,0,1,0,0|2,0,0]=4 1384 B16R2.101 CNC(Cc1ccccc1)C2CCCO2 Amb33483453 [0,1,0,1,0,0|2,0,0]=4 1385 B16R2.101 CNC(Cc1ccccc1)C2CCCO2 Amb33483862 [0,1,0,1,0,0|2,0,0]=4 1386 B16R2.101 CNC(Cc1ccccc1)C2CCCO2 Amb33483869 [0,1,0,1,0,0|2,0,0]=4 1387 B16R2.101 CNC(Cc1ccccc1)C2CCCO2 Amb33620457 [0,1,0,1,0,0|2,0,0]=4 1388 B16R2.101 CNC(Cc1ccccc1)C2CCCO2 Amb33621285 [0,1,0,1,0,0|2,0,0]=4 1389 B16R2.101 N#CC(Cc1ccccc1)N2CCCC2 Amb9283580 [0,1,0,1,0,0|1,0,1]=4 1390 B16R2.101 NCC(Cc1ccccc1)N2CCCC2 Amb1129117 [0,1,0,1,0,0|1,0,0]=3 1391 B16R2.101 NCC(Cc1cccnc1)N2CCCC2 Amb17238605 [0,1,0,1,0,0|2,0,0]=4 1392 B16R2.101 OC[C@@H](Cc1ccccc1)N2CCCC2 Amb30628595 [0,1,0,1,0,0|1,0,0]=3 1393 B16R2.112 CCc1nc2ccccc2n1CCCCl Amb20573230 [0,1,0,1,0,0|1,0,1]=4 1394 B16R2.676 C#CC(Cc1ccccc1)NCC2CC2 Amb32677170 [0,1,0,1,0,0|1,0,1]=4 1395 B16R2.676 CCC(Cc1ccccc1)NCC2CC2 Amb33496244 [0,1,0,1,0,0|1,0,0]=3 1396 B16R2.7942 CNC1(Cc2ccccc2)CCCCC1 Amb17402781 [0,1,0,1,0,0|2,0,0]=4 1397 B16R2.7942 CNC1(Cc2ccccc2)CCCCC1 Amb32686509 [0,1,0,1,0,0|2,0,0]=4 1398 B16R2.7942 NCC1(Cc2ccccc2)CCCCC1 Amb31217623 [0,1,0,1,0,0|2,0,0]=4 1399 B16R2.11144 CC1C(CCl)CCN1Cc2ccccc2 Amb28322711 [0,1,0,1,0,0|2,0,0]=4 1400 B16R2.492 CC(C)CCNC1Cc2ccccc2C1 Amb9373618 [0,1,0,1,0,0|1,0,0]=3 1401 B16R2.492 CC(O)CCNC1Cc2ccccc2C1 Amb33455978 [0,1,0,1,0,0|1,0,0]=3 1402 B16R2.4003 CC(=O)CCN1c2ccccc2CC1C Amb17402744 [0,1,0,1,0,0|1,0,1]=4 1403 B16R2.4003 CC1Cc2ccccc2N1CCC(=O)Cl Amb17143975 [0,1,0,1,0,0|0,0,1]=3 1404 B16R2.4003 CC1Cc2ccccc2N1CCC(N)=O Amb17143315 [0,1,0,1,0,0|1,0,1]=4 1405 B16R2.14817 O=S1(=O)CCNC(Cc2ccccc2)C1 Amb18571307 [0,1,0,1,0,0|2,0,0]=4 1406 B16R2.2923 CN1CCNC(Cc2ccccc2Br)C1 Amb18593460 [0,1,0,1,0,0|2,0,0]=4 1407 B16R2.2923 CN1CCNC(Cc2ccccc2Cl)C1 Amb18571180 [0,1,0,1,0,0|2,0,0]=4 1408 B16R2.2923 CN1CCNC(Cc2ccccc2F)C1 Amb18568474 [0,1,0,1,0,0|2,0,0]=4 1409 B16R2.2923 Cc1ccccc1CC2CC(=O)CCN2 Amb18785347 [0,1,0,1,0,0|1,0,1]=4 1410 B16R2.2923 Cc1ccccc1CC2CCCC(Br)C2 Amb28435940 [0,1,0,1,0,0|1,1,0]=4 1411 B16R2.2923 Cc1ccccc1CC2CN(C)CCN2 Amb18567105 [0,1,0,1,0,0|2,0,0]=4 1412 B16R2.2923 Cc1ccccc1CN2CCCC(Cl)C2 Amb27761791 [0,1,0,1,0,0|2,0,0]=4 1413 B16R2.2923 Clc1ccccc1CN2CCCC(Cl)C2 Amb27197792 [0,1,0,1,0,0|2,0,0]=4 1414 B16R2.2923 O=C1CCNC(Cc2ccccc2Cl)C1 Amb18761580 [0,1,0,1,0,0|1,0,1]=4 1415 B16R2.2923 O=C1CCNC(Cc2ccccc2F)C1 Amb18779243 [0,1,0,1,0,0|1,0,1]=4 1416 B16R2.12469 CC1CCCC(C)C1c2ccccc2N Amb32653662 [0,1,0,1,0,0|2,0,0]=4 1417 B16R2.24848 Cc1ccccc1CC2CCCCCN2 Amb2235764 [0,1,0,1,0,0|1,0,0]=3 1418 B16R2.24848 Cc1cnccc1CC2CCCCCN2 Amb2235548 [0,1,0,1,0,0|2,0,0]=4 1419 B16R2.24848 Clc1ccccc1CC2CCCCCN2 Amb3789633 [0,1,0,1,0,0|1,0,0]=3 1420 B16R2.24848 Fc1ccccc1CC2CCCCCN2 Amb3788932 [0,1,0,1,0,0|1,0,0]=3 1421 B16R3.1272 OCC1CC2Cc3ccccc3N2C1 Amb28077949 [0,0,0,2,0,0|1,0,0]=3 1422 B16R3.1739 NC1C(c2ccccc2)[C@@H]3CC[C@H]1C3 Amb27781125 [0,0,0,2,0,0|2,0,0]=4 1423 B16R3.1739 NC1C(c2ccccc2)[C@H]3CC[C@@H]1C3 Amb28346263 [0,0,0,2,0,0|2,0,0]=4 1424 B16R3.1739 NC1C2CCC(C2)C1c3ccccc3 Amb22731668 [0,0,0,2,0,0|2,0,0]=4 1425 B16R3.1739 NC1C2CCC(C2)C1c3ccccc3 Amb33331022 [0,0,0,2,0,0|2,0,0]=4 1426 B16R3.1739 N[C@@H]1[C@H]2CC[C@H](C2)[C@@H]1c3ccccc3 Amb28436683 [0,0,0,2,0,0|2,0,0]=4 1427 B16R3.1739 N[C@H]1[C@@H]2CC[C@@H](C2)[C@@H]1c3ccccc3 Amb27250659 [0,0,0,2,0,0|2,0,0]=4 1428 B16R3.1739 N[C@H]1[C@H]2CC[C@H](C2)[C@@H]1c3ccccc3 Amb27420051 [0,0,0,2,0,0|2,0,0]=4 1429 B16R3.1739 O[C@@H]1C2CCC(C2)[C@@H]1c3ccccc3 Amb28455165 [0,0,0,2,0,0|2,0,0]=4 1430 B16R3.1739 O[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1c3ccccc3 Amb28248728 [0,0,0,2,0,0|2,0,0]=4 1431 B16R3.1798 c1ccc(C2NCC3CCC2C3)cc1 Amb27259518 [0,0,0,2,0,0|2,0,0]=4 1432 B16R3.2694 ClC1C2CN(Cc3ccccc3)CC12 Amb27647818 [0,0,0,2,0,0|2,0,0]=4 1433 B16R3.2694 NC1[C@H]2CC(Cc3ccccc3)C[C@@H]12 Amb27596526 [0,0,0,2,0,0|2,0,0]=4 1434 B16R3.2274 CN1CC2Cc3ccccc3C(C1)N2 Amb28208495 [0,0,0,2,0,0|2,0,0]=4 1435 B16R3.2274 O=C1CC2Cc3ccccc3C(C1)N2 Amb27749330 [0,0,0,2,0,0|1,0,1]=4 1436 B16R3.2570 O[C@H]1CC[C@@H]2C(Cc3ccccc3)[C@H]12 Amb27853927 [0,0,0,2,0,0|2,0,0]=4 1437 B16R3.2637 CN1CCN2c3ccccc3CC2C1 Amb25063226 [0,0,0,2,0,0|2,0,0]=4 1438 B16R3.3555 O[C@H]1C[C@@H]2CC[C@H]1C2c3ccccc3 Amb27195859 [0,0,0,2,0,0|2,0,0]=4 1439 B16R3.27838 CC1CCN[C@@H]2Cc3ccccc3[C@H]12 Amb28255574 [0,0,0,2,0,0|1,0,0]=3 1440 B16R3.27838 CC1NCCN2Cc3ccccc3C12 Amb18650018 [0,0,0,2,0,0|2,0,0]=4 1441 B16R3.27838 ClC1CCCC2Oc3ccccc3C12 Amb27588003 [0,0,0,2,0,0|2,0,0]=4 1442 B16R3.27838 O[C@@H]1CCC[C@@H]2Cc3ccccc3[C@H]12 Amb27775828 [0,0,0,2,0,0|2,0,0]=4 1443 B16R3.1722 c1ccc2c(c1)CC3CCCCNC23 Amb27750798 [0,0,0,2,0,0|2,0,0]=4 1444 B16R3.1722 c1ccc2c(c1)CC3CCNCCN23 Amb27597489 [0,0,0,2,0,0|2,0,0]=4 1445 B16R3.1722 c1ccc2c(c1)CC3CNCCCN23 Amb25689634 [0,0,0,2,0,0|1,0,0]=3 1446 B16R3.1722 c1ccc2c(c1)CC3NCCCOC23 Amb20668498 [0,0,0,2,0,0|1,0,0]=3 1447 B16R3.1722 c1ccc2c(c1)CC3NCCCOC23 Amb9358469 [0,0,0,2,0,0|1,0,0]=3 1448 B16R3.1722 c1ccc2c(c1)CC3SCCCNC23 Amb27831769 [0,0,0,2,0,0|2,0,0]=4 1449 B16R3.3330 OC1CCCC2CC12c3ccccc3 Amb27764826 [0,0,0,2,0,0|2,0,0]=4 1450 B16R3.5925 c1ccc2c(c1)CC(C3CCCN3)C2 Amb26507879 [0,0,0,2,0,0|2,0,0]=4 1451 B16R3.5925 c1ccc2c(c1)CC(N3CCCC3)C2 Amb22522026 [0,0,0,2,0,0|1,0,0]=3 1452 B16R3.2169 OC1CCC[C@]12C[C@H]2c3ccccc3 Amb27805324 [0,0,0,2,0,0|2,0,0]=4 1453 B16R3.15144 CC12NCCC1(C)c3ccccc3N2 Amb2795581 [0,0,0,2,0,0|2,0,0]=4 1454 B16R3.15144 C[C@@]12NCC[C@]1(C)c3ccccc3N2 Amb27845542 [0,0,0,2,0,0|2,0,0]=4 1455 B16R3.5985 c1ccc([C@H]2[C@@H]3CC[C@H]2CNC3)cc1 Amb27244832 [0,0,0,2,0,0|2,0,0]=4 1456 B16R3.30024 N[C@H]1C[C@H]2C[C@@H](Cl)[C@@H]1c3ccccc32 Amb27623909 [0,0,0,2,0,0|2,0,0]=4 1457 B16R3.3385 NC1CCC1C2CC2c3ccccc3 Amb27410133 [0,0,0,2,0,0|2,0,0]=4 1458 B16R3.3509 CC1Cc2ccncc2C(C3CC3)N1 Amb28292393 [0,0,0,2,0,0|2,0,0]=4 1459 B16R3.3519 CC1Cc2ccccc2N1C[C@@H]3CO3 Amb28076034 [0,0,0,2,0,0|1,0,0]=3 1460 B16R3.275948 c1ccc2c(c1)CC(NCC3CC3)C2 Amb9373559 [0,0,0,2,0,0|1,0,0]=3 1461 B16R3.990 OCC1CC1C2CC2c3ccccc3 Amb27981837 [0,0,0,2,0,0|2,0,0]=4 1462 B16R3.990 OCC1CC1[C@H]2C[C@@H]2c3ccccc3 Amb28455277 [0,0,0,2,0,0|2,0,0]=4 1463 B16R3.990 OC[C@H]1C[C@H]1[C@H]2C[C@@H]2c3ccccc3 Amb27420469 [0,0,0,2,0,0|2,0,0]=4 1464 B16R3.42430 NCC1CC1C2Cc3ccccc3C2 Amb33342545 [0,0,0,2,0,0|2,0,0]=4 1465 B16R3.42430 NC[C@@H]1C[C@H]1C2Cc3ccccc3C2 Amb33342546 [0,0,0,2,0,0|2,0,0]=4 1466 B16R3.63995 c1ccc2c(c1)CC(NC3CNC3)C2 Amb28280351 [0,0,0,2,0,0|2,0,0]=4 1467 B16R3.65859 c1ccc2c(c1)CC3(COCCN3)C2 Amb27859520 [0,0,0,2,0,0|2,0,0]=4 1468 B16R3.53460 CC1Cc2cccc3c2C(CC3C)N1 Amb27831798 [0,0,0,2,0,0|1,0,0]=3 1469 B12R1.37 NCCCNCCc1cccs1 Amb18608752 [1,0,0,0,1,0|2,0,0]=4 1470 B12R1.30 C#CCCC(C)c1ccccc1 Amb33081910 [1,0,0,0,1,0|1,0,1]=4 1471 B12R1.30 C#CCNC(C)c1ccccc1 Amb2721857 [1,0,0,0,1,0|0,0,2]=4 1472 B12R1.30 C#CCN[C@H](C)c1ccccc1 Amb27389242 [1,0,0,0,1,0|0,0,2]=4 1473 B12R1.30 C=CCCC(C)c1ccccc1 Amb24062989 [1,0,0,0,1,0|1,0,1]=4 1474 B12R1.30 C=CCNC(C)c1ccccc1 Amb6683836 [1,0,0,0,1,0|0,0,2]=4 1475 B12R1.30 CC(CCC#N)c1ccccc1 Amb18645228 [1,0,0,0,1,0|1,0,1]=4 1476 B12R1.30 CC(CCC=O)c1ccccc1 Amb18645711 [1,0,0,0,1,0|1,0,1]=4 1477 B12R1.30 CC(CCCBr)c1ccccc1 Amb33082370 [1,0,0,0,1,0|0,1,0]=3 1478 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [1,0,0,0,1,0|1,0,0]=3 1479 B12R1.30 CC(CCCO)c1ccccc1 Amb33213887 [1,0,0,0,1,0|1,0,0]=3 1480 B12R1.30 CC(CCCS)c1ccccc1 Amb33082130 [1,0,0,0,1,0|1,0,0]=3 1481 B12R1.30 CC(CCON)c1ccccc1 Amb33081860 [1,0,0,0,1,0|2,0,0]=4 1482 B12R1.30 CC(NCC#N)c1ccccc1 Amb6706903 [1,0,0,0,1,0|1,0,1]=4 1483 B12R1.30 CC(NCCCl)c1ccccc1 Amb17335659 [1,0,0,0,1,0|0,0,0]=2 1484 B12R1.30 CC(NCCN)c1ccccc1 Amb17091024 [1,0,0,0,1,0|1,0,0]=3 1485 B12R1.30 CC(NCCO)c1ccccc1 Amb2092663 [1,0,0,0,1,0|1,0,0]=3 1486 B12R1.30 CC(NCCO)c1ccccn1 Amb7809203 [1,0,0,0,1,0|2,0,0]=4 1487 B12R1.30 CC(NCCO)c1cccnc1 Amb7809201 [1,0,0,0,1,0|2,0,0]=4 1488 B12R1.30 CC(NCCO)c1ccncc1 Amb7809202 [1,0,0,0,1,0|2,0,0]=4 1489 B12R1.30 CC(OCCN)c1ccccc1 Amb6248427 [1,0,0,0,1,0|2,0,0]=4 1490 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [1,0,0,0,1,0|2,0,0]=4 1491 B12R1.30 CC(SCCN)c1ccccc1 Amb17500453 [1,0,0,0,1,0|2,0,0]=4 1492 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [1,0,0,0,1,0|0,0,2]=4 1493 B12R1.30 CCCCC(N)c1ccccc1 Amb9717704 [1,0,0,0,1,0|2,0,0]=4 1494 B12R1.30 CCCCC(O)c1ccccc1 Amb4034459 [1,0,0,0,1,0|2,0,0]=4 1495 B12R1.30 CCCCC(S)c1ccccc1 Amb32788793 [1,0,0,0,1,0|2,0,0]=4 1496 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb28555742 [1,0,0,0,1,0|2,0,0]=4 1497 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb33276169 [1,0,0,0,1,0|2,0,0]=4 1498 B12R1.30 CCCC[C@@H](O)c1ccccc1 Amb30627576 [1,0,0,0,1,0|2,0,0]=4 1499 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb28555741 [1,0,0,0,1,0|2,0,0]=4 1500 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb33276167 [1,0,0,0,1,0|2,0,0]=4 1501 B12R1.30 CCCC[C@H](O)c1ccccc1 Amb28555740 [1,0,0,0,1,0|2,0,0]=4 1502 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [1,0,0,0,1,0|1,0,1]=4 1503 B12R1.30 CCCNC(C)c1ccccc1 Amb6335367 [1,0,0,0,1,0|0,0,0]=2 1504 B12R1.30 CCCNC(C)c1ccccc1 Amb9726952 [1,0,0,0,1,0|0,0,0]=2 1505 B12R1.30 CCCNC(C)c1ccccn1 Amb6267689 [1,0,0,0,1,0|1,0,0]=3 1506 B12R1.30 CCCNC(C)c1cccnc1 Amb6278552 [1,0,0,0,1,0|1,0,0]=3 1507 B12R1.30 CCCNC(C)c1ccncc1 Amb6279575 [1,0,0,0,1,0|1,0,0]=3 1508 B12R1.30 CCC\N=C(/C)c1ccccc1 Amb17779516 [1,0,0,0,1,0|0,0,2]=4 1509 B12R1.30 CCNCC(C)c1ccccc1 Amb6729198 [1,0,0,0,1,0|2,0,0]=4 1510 B12R1.30 CC\C=N\[C@H](C)c1ccccc1 Amb27852444 [1,0,0,0,1,0|0,0,2]=4 1511 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664174 [1,0,0,0,1,0|1,1,0]=4 1512 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664423 [1,0,0,0,1,0|1,1,0]=4 1513 B12R1.30 CN(CCCCl)c1ccccc1 Amb17335669 [1,0,0,0,1,0|1,0,0]=3 1514 B12R1.30 CN(CCCN)c1ccccc1 Amb2786601 [1,0,0,0,1,0|2,0,0]=4 1515 B12R1.30 CN(CCCO)c1ccccc1 Amb9246590 [1,0,0,0,1,0|2,0,0]=4 1516 B12R1.30 CNCCC(C)c1ccccc1 Amb5739286 [1,0,0,0,1,0|2,0,0]=4 1517 B12R1.30 C[C@@H](NCCCl)c1ccccc1 Amb30621967 [1,0,0,0,1,0|0,0,0]=2 1518 B12R1.30 C[C@@H](NCCO)c1ccccc1 Amb2721786 [1,0,0,0,1,0|1,0,0]=3 1519 B12R1.30 C[C@H](NCC#N)c1ccccc1 Amb27413002 [1,0,0,0,1,0|1,0,1]=4 1520 B12R1.30 C[C@H](NCCO)c1ccccc1 Amb2698698 [1,0,0,0,1,0|1,0,0]=3 1521 B12R1.30 C\C(=C/CCCl)c1ccccc1 Amb17233775 [1,0,0,0,1,0|0,0,2]=4 1522 B12R1.30 C\C=C\NC(C)c1ccccc1 Amb27791879 [1,0,0,0,1,0|0,0,2]=4 1523 B12R1.30 NC(CCCO)c1ccccc1 Amb9783958 [1,0,0,0,1,0|2,0,0]=4 1524 B12R1.30 NCCCC(O)c1ccccc1 Amb17079154 [1,0,0,0,1,0|2,0,0]=4 1525 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [1,0,0,0,1,0|2,0,0]=4 1526 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [1,0,0,0,1,0|2,0,0]=4 1527 B12R1.30 O=C(CCCCl)c1ccccc1 Amb1229841 [1,0,0,0,1,0|1,0,1]=4 1528 B12R1.30 O=C(NCCCl)c1ccccc1 Amb2414312 [1,0,0,0,1,0|1,0,1]=4 1529 B12R1.30 OC(CCCCl)c1ccccc1 Amb17194564 [1,0,0,0,1,0|1,0,0]=3 1530 B12R1.30 OCCCC(O)c1ccccc1 Amb17334675 [1,0,0,0,1,0|2,0,0]=4 1531 B12R1.30 S=C(NCCCl)c1ccccc1 Amb28118876 [1,0,0,0,1,0|1,0,1]=4 1532 B12R1.30 [C-]#[N+]CCC(C)c1ccccc1 Amb33081599 [1,0,0,0,1,0|2,0,0]=4 1533 B12R1.35 CC(NCCCO)c1ccco1 Amb6733643 [0,0,0,0,2,0|2,0,0]=4 1534 B12R1.35 CC(NCCCO)c1cccs1 Amb6733633 [0,0,0,0,2,0|2,0,0]=4 1535 B12R1.35 CC(NCCCO)c1ccsc1 Amb19075400 [0,0,0,0,2,0|2,0,0]=4 1536 B12R1.35 CCCCNC(C)c1ccco1 Amb6691030 [0,0,0,0,2,0|2,0,0]=4 1537 B12R1.35 CCCCNC(C)c1cccs1 Amb6691021 [0,0,0,0,2,0|2,0,0]=4 1538 B12R1.35 CCCCNC(C)c1ccsc1 Amb19074601 [0,0,0,0,2,0|2,0,0]=4 1539 B16R1.1694 CC(COCc1ccccc1)NCCC#N Amb27214312 [0,0,0,0,0,2|1,0,1]=4 1540 B16R1.1694 CC(COCc1ccccc1)NCCCF Amb27442529 [0,0,0,0,0,2|0,1,0]=3 1541 B16R1.1694 CCCCNC(C)COCc1ccccc1 Amb27214311 [0,0,0,0,0,2|1,0,0]=3 1542 B16R1.1694 CCCCOC(C)OCCc1ccccc1 Amb3777426 [0,0,0,0,0,2|2,0,0]=4 1543 B16R1.1694 COCCNC(C)COCc1ccccc1 Amb27266320 [0,0,0,0,0,2|2,0,0]=4