0 B29R3.10106351 CC(=CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)C 2230a_100016990212_100011217483 [0,0,0,0,0,0|2,0,1]=3 1 B29R3.10106351 CC(=CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)C 269982a_100016990212_100011217483 [0,0,0,0,0,0|2,0,1]=3 2 B29R3.10106351 CC(=CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)C 34a_100016990212_100011217483 [0,0,0,0,0,0|2,0,1]=3 3 B29R3.10106351 CC(C)CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100011214892 [0,0,0,0,0,0|2,0,1]=3 4 B29R3.10106351 CC(C)CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100011214892 [0,0,0,0,0,0|2,0,1]=3 5 B29R3.10106351 CC(C)CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100011214892 [0,0,0,0,0,0|2,0,1]=3 6 B29R3.10106351 CC(C)SCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000730970 [0,0,0,0,0,0|3,0,1]=4 7 B29R3.10106351 CC(C)SCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000730970 [0,0,0,0,0,0|3,0,1]=4 8 B29R3.10106351 CC(C)SCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000730970 [0,0,0,0,0,0|3,0,1]=4 9 B29R3.10106351 FC(=CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)F 2230a_100016990212_200009816681 [0,0,0,0,0,0|2,0,1]=3 10 B29R3.10106351 FC(=CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)F 269982a_100016990212_200009816681 [0,0,0,0,0,0|2,0,1]=3 11 B29R3.10106351 FC(=CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)F 34a_100016990212_200009816681 [0,0,0,0,0,0|2,0,1]=3 12 B28R3.8592 C=CCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100011713584 [1,0,0,0,0,0|1,0,0]=2 13 B28R3.8592 C=CCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000757094 [1,0,0,0,0,0|1,0,0]=2 14 B28R3.8592 C=CCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000757094 [1,0,0,0,0,0|1,0,0]=2 15 B28R3.8592 CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000210326 [1,0,0,0,0,0|1,0,1]=3 16 B28R3.8592 CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000210215 [1,0,0,0,0,0|1,0,1]=3 17 B28R3.8592 CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000718602 [1,0,0,0,0,0|1,0,1]=3 18 B28R3.8592 CCSCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000757381 [1,0,0,0,0,0|2,0,1]=4 19 B28R3.8592 CCSCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000757381 [1,0,0,0,0,0|2,0,1]=4 20 B28R3.8592 CCSCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000757381 [1,0,0,0,0,0|2,0,1]=4 21 B28R3.8592 FCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000729493 [1,0,0,0,0,0|1,0,1]=3 22 B28R3.8592 FCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000729493 [1,0,0,0,0,0|1,0,1]=3 23 B28R3.8592 FCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000729493 [1,0,0,0,0,0|1,0,1]=3 24 B30R3.227407 CCC(=O)CCCN1CCC(CC1)O[C@@H](c2ccc(cc2)Cl)c3ccccn3 1458a_200020619139_100000210202 [0,1,0,0,0,0|1,0,0]=2 25 B30R3.11985678 FC(F)(F)CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100011215983 [0,1,0,0,0,0|2,0,1]=4 26 B30R3.11985678 FC(F)(F)CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100011216173 [0,1,0,0,0,0|2,0,1]=4 27 B30R3.11985678 FC(F)(F)CCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100011215983 [0,1,0,0,0,0|2,0,1]=4 28 B30R3.11985689 FC(=C(F)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)F 2230a_100016990212_100000036642 [0,1,0,0,0,0|2,0,1]=4 29 B30R3.11985689 FC(=C(F)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)F 269982a_100016990212_100009813398 [0,1,0,0,0,0|2,0,1]=4 30 B30R3.11985689 FC(=C(F)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)F 34a_100016990212_100009813398 [0,1,0,0,0,0|2,0,1]=4 31 B30R3.11985791 C=C(C)CCC(=O)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 11a_100016990212_200000688413 [0,1,0,0,0,0|2,0,1]=4 32 B30R3.11985791 C=C(C)CCC(=O)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 1626a_100016990212_200000688413 [0,1,0,0,0,0|2,0,1]=4 33 B30R3.11985791 C=C(C)CCC(=O)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 240690a_100016990212_200000688413 [0,1,0,0,0,0|2,0,1]=4 34 B30R3.11985791 C=C(C)CCC(=O)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 527a_100016990212_200000688413 [0,1,0,0,0,0|2,0,1]=4 35 B30R4.328729 CC1CCC(C1)N2CCC(CC2)OC(c3ccc(cc3)Cl)c4ccccn4 270004a_100016990212_100011215218 [0,0,0,1,0,0|2,0,1]=4 36 B28R3.7971325 C=C(C)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000730704 [0,0,0,0,1,0|2,0,0]=3 37 B28R3.7971325 C=C(C)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000730704 [0,0,0,0,1,0|2,0,0]=3 38 B28R3.7971325 C=C(C)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000730704 [0,0,0,0,1,0|2,0,0]=3 39 B28R3.7971325 CC(=CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)C 2230a_100016990212_100000761012 [0,0,0,0,1,0|2,0,1]=4 40 B28R3.7971325 CC(=CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)C 269982a_100016990212_100000761012 [0,0,0,0,1,0|2,0,1]=4 41 B28R3.7971325 CC(=CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3)C 34a_100016990212_100000761012 [0,0,0,0,1,0|2,0,1]=4 42 B28R3.7971325 CC(C)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000210312 [0,0,0,0,1,0|2,0,1]=4 43 B28R3.7971325 CC(C)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000210312 [0,0,0,0,1,0|2,0,1]=4 44 B28R3.7971325 CC(C)CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000210312 [0,0,0,0,1,0|2,0,1]=4 45 B30R3.11985789 CC(=O)CCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000735457 [0,0,0,0,0,1|1,0,0]=2 46 B30R3.11985789 CC(=O)CCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100009817362 [0,0,0,0,0,1|1,0,0]=2 47 B30R3.11985789 CC(=S)OCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_200135323944 [0,0,0,0,0,1|1,1,0]=3 48 B30R3.11985789 CC(=S)OCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_200135323944 [0,0,0,0,0,1|1,1,0]=3 49 B30R3.11985789 CC(=S)OCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_200135323944 [0,0,0,0,0,1|1,1,0]=3 50 B27R3.9004 C=CCCCN1CCC(CC1)OC(c2ccccc2)c3ccccc3 2230a_100016987672_100011713584 [2,0,0,0,0,0|2,0,0]=4 51 B27R3.9004 C=CCCCN1CCC(CC1)OC(c2ccccc2)c3ccccc3 269982a_100016987672_100000757094 [2,0,0,0,0,0|2,0,0]=4 52 B27R3.9004 C=CCCCN1CCC(CC1)OC(c2ccccc2)c3ccccc3 34a_100016987672_100000757094 [2,0,0,0,0,0|2,0,0]=4 53 B27R3.21730 CCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000210211 [2,0,0,0,0,0|0,0,1]=3 54 B27R3.21730 CCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000210211 [2,0,0,0,0,0|0,0,1]=3 55 B27R3.21730 CCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000210210 [2,0,0,0,0,0|0,0,1]=3 56 B29R3.144222 C#CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100010269958 [1,1,0,0,0,0|1,0,1]=4 57 B29R3.144222 C#CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100010269958 [1,1,0,0,0,0|1,0,1]=4 58 B29R3.144222 C#CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100010269958 [1,1,0,0,0,0|1,0,1]=4 59 B29R3.144222 C=CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100011215482 [1,1,0,0,0,0|1,0,0]=3 60 B29R3.144222 C=CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100011215482 [1,1,0,0,0,0|1,0,0]=3 61 B29R3.144222 C=CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100011215482 [1,1,0,0,0,0|1,0,0]=3 62 B29R3.144222 CC/C=C\CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100015370543 [1,1,0,0,0,0|1,0,1]=4 63 B29R3.144222 CC/C=C\CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100015370543 [1,1,0,0,0,0|1,0,1]=4 64 B29R3.144222 CC/C=C\CCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100015370543 [1,1,0,0,0,0|1,0,1]=4 65 B29R3.144222 CCCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000210314 [1,1,0,0,0,0|1,0,1]=4 66 B29R3.144222 CCCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000210757 [1,1,0,0,0,0|1,0,1]=4 67 B29R3.144222 CCCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000210314 [1,1,0,0,0,0|1,0,1]=4 68 B29R3.144222 CCCCOCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100011995733 [1,1,0,0,0,0|1,0,1]=4 69 B29R3.144222 CCCCOCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100011995733 [1,1,0,0,0,0|1,0,1]=4 70 B29R3.144222 CCCCOCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100011995733 [1,1,0,0,0,0|1,0,1]=4 71 B29R3.144222 FCCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000729378 [1,1,0,0,0,0|1,0,1]=4 72 B29R3.144222 FCCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100000729378 [1,1,0,0,0,0|1,0,1]=4 73 B29R3.144222 FCCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100000729378 [1,1,0,0,0,0|1,0,1]=4 74 B29R3.144222 N#CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100000211819 [1,1,0,0,0,0|1,0,1]=4 75 B29R3.144222 N#CCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100011219923 [1,1,0,0,0,0|1,0,1]=4 76 B29R3.276682 C=CCCC(C)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 270004a_100016990212_100000762624 [1,1,0,0,0,0|1,0,0]=3 77 B29R3.276682 CCCCC(C)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_200011215066 [1,1,0,0,0,0|1,0,1]=4 78 B29R3.276682 CCCCC(C)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_200011215066 [1,1,0,0,0,0|1,0,1]=4 79 B29R3.276682 CCCCC(C)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 270004a_100016990212_100000210087 [1,1,0,0,0,0|1,0,1]=4 80 B29R3.276682 CCCCC(C)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_200011215066 [1,1,0,0,0,0|1,0,1]=4 81 B29R3.276682 CSCCC(C)N1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 270004a_100016990212_100011217047 [1,1,0,0,0,0|2,0,0]=4 82 B29R3.286676 CCCC(C)CN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_100011216630 [1,1,0,0,0,0|1,0,1]=4 83 B29R3.286676 CCCC(C)CN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_100011216630 [1,1,0,0,0,0|1,0,1]=4 84 B29R3.286676 CCCC(C)CN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 270004a_100016990212_100000243154 [1,1,0,0,0,0|1,0,1]=4 85 B29R3.286676 CCCC(C)CN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_100011216630 [1,1,0,0,0,0|1,0,1]=4 86 B31R3.11530681 CC(=O)SCC(C)CN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_200000116872 [0,1,0,0,0,1|1,0,0]=3 87 B31R3.11530681 CC(=O)SCC(C)CN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_200000116872 [0,1,0,0,0,1|1,0,0]=3 88 B31R3.11530681 CC(=O)SCC(C)CN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_200000116872 [0,1,0,0,0,1|1,0,0]=3 89 B31R3.161387 C=CCC(=O)CCCN1CCC(CC1)O[C@@H](c2ccc(cc2)Cl)c3ccccn3 1458a_200020619139_100000210623 [0,2,0,0,0,0|1,0,0]=3 90 B31R3.161387 CCCC(=O)CCCN1CCC(CC1)O[C@@H](c2ccc(cc2)Cl)c3ccccn3 1458a_200020619139_100000210303 [0,2,0,0,0,0|1,0,0]=3 91 B31R3.161387 O=C(CCF)CCCN1CCC(CC1)O[C@@H](c2ccc(cc2)Cl)c3ccccn3 1458a_200020619139_100011217306 [0,2,0,0,0,0|1,0,0]=3 92 B29R4.323684 Clc1ccc(cc1)C(OC2CCN(CC2)C3CCCC3)c4ccccn4 2230a_100016990212_100000179811 [1,0,0,1,0,0|1,0,1]=4 93 B29R4.323684 Clc1ccc(cc1)C(OC2CCN(CC2)C3CCCC3)c4ccccn4 269982a_100016990212_100000179811 [1,0,0,1,0,0|1,0,1]=4 94 B29R4.323684 Clc1ccc(cc1)C(OC2CCN(CC2)C3CCCC3)c4ccccn4 270004a_100016990212_100000210133 [1,0,0,1,0,0|1,0,1]=4 95 B29R4.323684 Clc1ccc(cc1)C(OC2CCN(CC2)C3CCCC3)c4ccccn4 34a_100016990212_100000179811 [1,0,0,1,0,0|1,0,1]=4 96 B29R4.8353870 Clc1ccc(cc1)C(OC2CCN(CC2)CC3CCC3)c4ccccn4 2230a_100016990212_100000763275 [1,0,0,1,0,0|1,0,1]=4 97 B29R4.8353870 Clc1ccc(cc1)C(OC2CCN(CC2)CC3CCC3)c4ccccn4 269982a_100016990212_100000763275 [1,0,0,1,0,0|1,0,1]=4 98 B29R4.8353870 Clc1ccc(cc1)C(OC2CCN(CC2)CC3CCC3)c4ccccn4 34a_100016990212_100000763275 [1,0,0,1,0,0|1,0,1]=4 99 B29R4.8353872 Clc1ccc(cc1)C(OC2CCN(CC2)CCC3CC3)c4ccccn4 2230a_100016990212_100000694398 [1,0,0,1,0,0|1,0,1]=4 100 B29R4.8353872 Clc1ccc(cc1)C(OC2CCN(CC2)CCC3CC3)c4ccccn4 269982a_100016990212_100000694398 [1,0,0,1,0,0|1,0,1]=4 101 B29R4.8353872 Clc1ccc(cc1)C(OC2CCN(CC2)CCC3CC3)c4ccccn4 34a_100016990212_100000694398 [1,0,0,1,0,0|1,0,1]=4 102 B31R4.10421 C=C1CCC(CC1)N2CCC(CC2)OC(c3ccc(cc3)Cl)c4ccccn4 270004a_100016990212_100010272673 [0,1,0,1,0,0|2,0,0]=4 103 B29R3.244944 CC(=O)CCCCN1CCC(CC1)OC(c2ccccc2)c3ccccc3 269982a_100016987672_100000735457 [1,0,0,0,0,1|2,0,0]=4 104 B29R3.244944 CC(=O)CCCCN1CCC(CC1)OC(c2ccccc2)c3ccccc3 34a_100016987672_100009817362 [1,0,0,0,0,1|2,0,0]=4 105 B31R3.11530641 CC(=O)SCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 2230a_100016990212_200010402107 [0,0,0,0,0,2|1,0,0]=3 106 B31R3.11530641 CC(=O)SCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 269982a_100016990212_200010402107 [0,0,0,0,0,2|1,0,0]=3 107 B31R3.11530641 CC(=O)SCCCCN1CCC(CC1)OC(c2ccc(cc2)Cl)c3ccccn3 34a_100016990212_200010402107 [0,0,0,0,0,2|1,0,0]=3