0 B13R2.15 CN1CCCC1c2ccccc2 2230a_100000243309_200000210301 [1,0,0,0,0,0|1,0,1]=3 1 B13R2.15 CN1CCCC1c2ccccc2 269982a_100000243309_200000210301 [1,0,0,0,0,0|1,0,1]=3 2 B13R2.15 CN1CCCC1c2ccccc2 34a_100000243309_200000210301 [1,0,0,0,0,0|1,0,1]=3 3 B13R2.15 CN1CCCC1c2ccccn2 2230a_100000744244_200000210301 [1,0,0,0,0,0|2,0,1]=4 4 B13R2.15 CN1CCCC1c2ccccn2 269982a_100000744244_200000210301 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.15 CN1CCCC1c2cccnc2 2230a_100000233489_200000210301 [1,0,0,0,0,0|0,0,1]=2 6 B13R2.15 CN1CCCC1c2cccnc2 269982a_100000233489_200000210301 [1,0,0,0,0,0|0,0,1]=2 7 B13R2.15 CN1CCCC1c2ccncc2 2230a_106446545576_200000210301 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.15 CN1CCCC1c2ccncc2 269982a_106446545576_200000210301 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.15 CN1CCSC1c2ccccc2 2230a_100000215944_200000210301 [1,0,0,0,0,0|2,0,1]=4 10 B13R2.15 CN1CCSC1c2ccccc2 269982a_100000215944_200000210301 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.15 CN1CCSC1c2ccccc2 34a_100000215944_200000210301 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.15 CN1CCSC1c2ccccc2 7a_100000215944_200000210301 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.15 C[C@@H]1CCCN1c2cccnn2 27a_100015189458_100016991348 [1,0,0,0,0,0|3,0,0]=4 14 B13R2.15 C[C@@H]1CCCN1c2cnccn2 27a_100015189458_100000211759 [1,0,0,0,0,0|3,0,0]=4 15 B13R2.15 C[C@H]1CCCN1c2cccnn2 27a_100020605311_100016991348 [1,0,0,0,0,0|3,0,0]=4 16 B13R2.15 C[C@H]1CCCN1c2cnccn2 27a_100020605311_100000211759 [1,0,0,0,0,0|3,0,0]=4 17 B13R2.15 [13CH3]N1CCCC1c2ccccc2 2230a_100000243309_200025704644 [1,0,0,0,0,0|1,0,1]=3 18 B13R2.15 [13CH3]N1CCCC1c2ccccc2 269982a_100000243309_200025704644 [1,0,0,0,0,0|1,0,1]=3 19 B13R2.15 [13CH3]N1CCCC1c2ccccc2 34a_100000243309_200025704644 [1,0,0,0,0,0|1,0,1]=3 20 B13R2.15 [13CH3]N1CCCC1c2ccccn2 2230a_100000744244_200025704644 [1,0,0,0,0,0|2,0,1]=4 21 B13R2.15 [13CH3]N1CCCC1c2ccccn2 269982a_100000744244_200025704644 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.15 [13CH3]N1CCCC1c2cccnc2 2230a_100000233489_200025704644 [1,0,0,0,0,0|0,0,1]=2 23 B13R2.15 [13CH3]N1CCCC1c2cccnc2 269982a_100000233489_200025704644 [1,0,0,0,0,0|0,0,1]=2 24 B13R2.15 [13CH3]N1CCCC1c2ccncc2 2230a_106446545576_200025704644 [1,0,0,0,0,0|2,0,1]=4 25 B13R2.15 [13CH3]N1CCCC1c2ccncc2 269982a_106446545576_200025704644 [1,0,0,0,0,0|2,0,1]=4 26 B13R2.15 [13CH3]N1CCSC1c2ccccc2 2230a_100000215944_200025704644 [1,0,0,0,0,0|2,0,1]=4 27 B13R2.15 [13CH3]N1CCSC1c2ccccc2 269982a_100000215944_200025704644 [1,0,0,0,0,0|2,0,1]=4 28 B13R2.15 [13CH3]N1CCSC1c2ccccc2 34a_100000215944_200025704644 [1,0,0,0,0,0|2,0,1]=4 29 B13R2.15 [13CH3]N1CCSC1c2ccccc2 7a_100000215944_200025704644 [1,0,0,0,0,0|2,0,1]=4 30 B13R1.337 C=C(C)CCOCc1cccnc1 34a_100000764851_100000733263 [0,0,1,0,0,0|3,0,0]=4 31 B13R1.337 C=C(C)CCSCc1cccnc1 62a_100000730704_100000741622 [0,0,1,0,0,0|3,0,0]=4 32 B13R1.337 C=C(C)CCSCc1cccnc1 62a_100000741622_100000730704 [0,0,1,0,0,0|3,0,0]=4 33 B13R1.337 C=C(C)CNCCc1cccnc1 2230a_100000736294_100000748629 [0,0,1,0,0,0|3,0,0]=4 34 B13R1.337 C=C(C)COCCc1cccnc1 34a_100011217484_100000748629 [0,0,1,0,0,0|3,0,0]=4 35 B13R1.337 C=C(C)CSCCc1cccnc1 62a_100000748629_200011713674 [0,0,1,0,0,0|3,0,0]=4 36 B13R1.337 C=C(C)CSCCc1cccnc1 62a_200011713674_100000211660 [0,0,1,0,0,0|3,0,0]=4 37 B13R1.337 CC(=O)CCCCc1ccccc1 1458a_100000070787_100000701786 [0,0,1,0,0,0|2,0,1]=4 38 B13R1.337 CC(=O)CCCCc1ccccc1 1458a_100011215911_200000210301 [0,0,1,0,0,0|2,0,1]=4 39 B13R1.337 CC(=O)CCCOc1cccnc1 34a_100000210849_100000685027 [0,0,1,0,0,0|2,0,1]=4 40 B13R1.337 CC(=O)CCCOc1cccnc1 7a_100000210849_100011215641 [0,0,1,0,0,0|2,0,1]=4 41 B13R1.337 CC(=O)CCCSc1cccnc1 62a_100000210063_100011215641 [0,0,1,0,0,0|2,0,1]=4 42 B13R1.337 CC(=O)CCCSc1cccnc1 62a_100011215641_100000210063 [0,0,1,0,0,0|2,0,1]=4 43 B13R1.337 CC(=O)CCOCc1cccnc1 34a_100000759926_100000733263 [0,0,1,0,0,0|2,0,1]=4 44 B13R1.337 CC(=O)CCOCc1cccnc1 7a_100000759926_100000741622 [0,0,1,0,0,0|2,0,1]=4 45 B13R1.337 CC(=O)CCSCc1cccnc1 62a_100000053229_100000741622 [0,0,1,0,0,0|2,0,1]=4 46 B13R1.337 CC(=O)CCSCc1cccnc1 62a_100000741622_100000053229 [0,0,1,0,0,0|2,0,1]=4 47 B13R1.337 CC(=O)NCCCc1cccnc1 11a_100011532358_100015343762 [0,0,1,0,0,0|2,0,1]=4 48 B13R1.337 CC(=O)NCCCc1cccnc1 240690a_100011532358_100015343762 [0,0,1,0,0,0|2,0,1]=4 49 B13R1.337 CC(Br)CCOCc1cccnc1 34a_100009893172_100000733263 [0,0,1,0,0,0|3,0,0]=4 50 B13R1.337 CC(C)CCCOc1cccnc1 34a_100000210849_100011214892 [0,0,1,0,0,0|3,0,0]=4 51 B13R1.337 CC(C)CCCOc1cccnc1 7a_100000210849_100011214892 [0,0,1,0,0,0|3,0,0]=4 52 B13R1.337 CC(C)CCCSc1cccnc1 62a_100000210063_100011214892 [0,0,1,0,0,0|3,0,0]=4 53 B13R1.337 CC(C)CCCSc1cccnc1 62a_100011214892_100000210063 [0,0,1,0,0,0|3,0,0]=4 54 B13R1.337 CC(C)CCNCc1cccnc1 207a_100000210545_100000209961 [0,0,1,0,0,0|3,0,0]=4 55 B13R1.337 CC(C)CCNCc1cccnc1 269862a_100000210453_100000185833 [0,0,1,0,0,0|3,0,0]=4 56 B13R1.337 CC(C)CCNCc1cccnc1 270004a_100000210545_100000209961 [0,0,1,0,0,0|3,0,0]=4 57 B13R1.337 CC(C)CCOCc1cccnc1 34a_100000210254_100000733263 [0,0,1,0,0,0|3,0,0]=4 58 B13R1.337 CC(C)CCOCc1cccnc1 7a_100000210254_100000741622 [0,0,1,0,0,0|3,0,0]=4 59 B13R1.337 CC(C)CCSCc1cccnc1 62a_100000210312_100000741622 [0,0,1,0,0,0|3,0,0]=4 60 B13R1.337 CC(C)CCSCc1cccnc1 62a_100000741622_100000210312 [0,0,1,0,0,0|3,0,0]=4 61 B13R1.337 CC(C)CNCCc1cccnc1 2230a_100000210953_200011713674 [0,0,1,0,0,0|3,0,0]=4 62 B13R1.337 CC(C)CNCCc1cccnc1 2230a_100000736294_100000210760 [0,0,1,0,0,0|3,0,0]=4 63 B13R1.337 CC(C)CNCCc1cccnc1 270004a_100000736294_100000210432 [0,0,1,0,0,0|3,0,0]=4 64 B13R1.337 CC(C)COCCc1cccnc1 34a_100011217484_100000210624 [0,0,1,0,0,0|3,0,0]=4 65 B13R1.337 CC(C)CSCCc1cccnc1 62a_100000210624_200011713674 [0,0,1,0,0,0|3,0,0]=4 66 B13R1.337 CC(C)CSCCc1cccnc1 62a_200011713674_100000210760 [0,0,1,0,0,0|3,0,0]=4 67 B13R1.337 CC(C)NCCCc1cccnc1 2230a_100011532358_100000210206 [0,0,1,0,0,0|3,0,0]=4 68 B13R1.337 CC(C)NCCCc1cccnc1 34a_100011532358_100000210206 [0,0,1,0,0,0|3,0,0]=4 69 B13R1.337 CC(C)OCCCc1cccnc1 34a_100000211284_100000210206 [0,0,1,0,0,0|3,0,0]=4 70 B13R1.337 CC(O)CCCOc1cccnc1 34a_100000210849_200000718107 [0,0,1,0,0,0|2,0,1]=4 71 B13R1.337 CC(O)CCCOc1cccnc1 7a_100000210849_200000718107 [0,0,1,0,0,0|2,0,1]=4 72 B13R1.337 CC(O)CCCSc1cccnc1 62a_100000210063_200000718107 [0,0,1,0,0,0|2,0,1]=4 73 B13R1.337 CC(O)CCCSc1cccnc1 62a_200000718107_100000210063 [0,0,1,0,0,0|2,0,1]=4 74 B13R1.337 CC(O)CCNCc1cccnc1 207a_200000755665_100000209961 [0,0,1,0,0,0|2,0,1]=4 75 B13R1.337 CC(O)CCNCc1cccnc1 2230a_200000755665_100000741622 [0,0,1,0,0,0|2,0,1]=4 76 B13R1.337 CC(O)CCNCc1cccnc1 270004a_200000755665_100000209961 [0,0,1,0,0,0|2,0,1]=4 77 B13R1.337 CC(O)CCSCc1cccnc1 62a_100000741622_100012276601 [0,0,1,0,0,0|2,0,1]=4 78 B13R1.337 CC(O)CCSCc1cccnc1 62a_100012276601_100000741622 [0,0,1,0,0,0|2,0,1]=4 79 B13R1.337 CC(O)CNCCc1cccnc1 2230a_100000210904_200011713674 [0,0,1,0,0,0|2,0,1]=4 80 B13R1.337 CC(O)CNCCc1cccnc1 2230a_100000736294_100011218427 [0,0,1,0,0,0|2,0,1]=4 81 B13R1.337 CC(O)COCCc1cccnc1 34a_100011217484_100011218427 [0,0,1,0,0,0|2,0,1]=4 82 B13R1.337 CC(O)CSCCc1cccnc1 62a_100011218427_200011713674 [0,0,1,0,0,0|2,0,1]=4 83 B13R1.337 CC(O)CSCCc1cccnc1 62a_200011713674_100011218427 [0,0,1,0,0,0|2,0,1]=4 84 B13R1.337 CN(C)CCCCc1ccccc1 2230a_100000741445_200000210301 [0,0,1,0,0,0|2,0,1]=4 85 B13R1.337 CN(C)CCCCc1ccccc1 2230a_100102631434_100000701786 [0,0,1,0,0,0|2,0,1]=4 86 B13R1.337 CN(C)CCCCc1ccccc1 269982a_100000741445_200000210301 [0,0,1,0,0,0|2,0,1]=4 87 B13R1.337 CN(C)CCCCc1ccccc1 269982a_100102631434_100000701786 [0,0,1,0,0,0|2,0,1]=4 88 B13R1.337 CN(C)CCCCc1ccccc1 34a_100000741445_200000210301 [0,0,1,0,0,0|2,0,1]=4 89 B13R1.337 CN(C)CCCOc1cccnc1 7a_100000210849_100000757444 [0,0,1,0,0,0|2,0,1]=4 90 B13R1.337 CN(C)CCCSc1cccnc1 62a_100000210063_100000757444 [0,0,1,0,0,0|2,0,1]=4 91 B13R1.337 CN(C)CCNCc1cccnc1 207a_100000210585_100000209961 [0,0,1,0,0,0|2,0,1]=4 92 B13R1.337 CN(C)CCNCc1cccnc1 270004a_100000210585_100000209961 [0,0,1,0,0,0|2,0,1]=4 93 B13R1.337 CN(C)CCSCc1cccnc1 62a_100000741622_100000755713 [0,0,1,0,0,0|2,0,1]=4 94 B13R1.337 CN([13CH3])CCCCc1ccccc1 2230a_100000741445_200025704644 [0,0,1,0,0,0|2,0,1]=4 95 B13R1.337 CN([13CH3])CCCCc1ccccc1 269982a_100000741445_200025704644 [0,0,1,0,0,0|2,0,1]=4 96 B13R1.337 CN([13CH3])CCCCc1ccccc1 34a_100000741445_200025704644 [0,0,1,0,0,0|2,0,1]=4 97 B13R1.337 C[C@@H](N)CCOCc1cccnc1 34a_100000706166_100000733263 [0,0,1,0,0,0|3,0,0]=4 98 B13R1.337 C[C@@H](O)CNCCc1cccnc1 2230a_100000736294_100009817552 [0,0,1,0,0,0|2,0,1]=4 99 B13R1.337 C[C@@H](O)COCCc1cccnc1 34a_100011217484_100009817552 [0,0,1,0,0,0|2,0,1]=4 100 B13R1.337 C[C@@H](O)CSCCc1cccnc1 62a_100009817552_200011713674 [0,0,1,0,0,0|2,0,1]=4 101 B13R1.337 C[C@@H](O)CSCCc1cccnc1 62a_200011713674_100009817552 [0,0,1,0,0,0|2,0,1]=4 102 B13R1.337 O=C([O-])COCCc1cccnc1 34a_100011217484_100020667443 [0,0,1,0,0,0|3,0,0]=4 103 B13R1.337 O=C([O-])CSCCc1cccnc1 62a_100020667443_200011713674 [0,0,1,0,0,0|3,0,0]=4 104 B13R1.337 O=C([O-])CSCCc1cccnc1 62a_200011713674_100020667443 [0,0,1,0,0,0|3,0,0]=4 105 B13R1.337 O=[N+]([O-])COCCc1cccnc1 34a_100011217484_100000761209 [0,0,1,0,0,0|2,0,1]=4 106 B13R1.337 O=[N+]([O-])CSCCc1cccnc1 62a_200011713674_100000761209 [0,0,1,0,0,0|2,0,1]=4 107 B13R1.337 [13CH3]C(=O)CCCCc1ccccc1 1458a_100011215911_200025704644 [0,0,1,0,0,0|2,0,1]=4 108 B13R1.405 CCNC(c1cccnc1)C(C)C 2230a_100015185317_100000210202 [0,0,1,0,0,0|3,0,0]=4 109 B15R2.388 CC1(CCCN1Cc2cccnc2)C 2230a_100000761399_100000741622 [0,0,0,0,0,1|3,0,0]=4 110 B15R2.388 CC1(CCCN1Cc2cccnc2)C 269982a_100000761399_100000733263 [0,0,0,0,0,1|3,0,0]=4 111 B15R2.388 CC1(CCCN1Cc2cccnc2)C 270004a_100000761399_100000209961 [0,0,0,0,0,1|3,0,0]=4 112 B15R2.388 CC1(CCCN1Cc2cccnc2)C 34a_100000761399_100000733263 [0,0,0,0,0,1|3,0,0]=4 113 B15R2.388 C[C@]1(CCC[C@H]1Nc2cccnn2)O 27a_100015977457_100016991348 [0,0,0,0,0,1|2,0,1]=4 114 B15R2.388 C[C@]1(CCC[C@H]1Nc2cnccn2)O 27a_100015977457_100000211759 [0,0,0,0,0,1|2,0,1]=4 115 B15R2.388 FC1(CCCC1Oc2cccnc2)F 34a_100000210849_100119073726 [0,0,0,0,0,1|3,0,0]=4 116 B15R2.388 FC1(CCCC1Sc2cccnc2)F 62a_100000210063_100119073726 [0,0,0,0,0,1|3,0,0]=4 117 B15R2.388 FC1(CCCC1Sc2cccnc2)F 62a_100119073726_100000210063 [0,0,0,0,0,1|3,0,0]=4 118 B12R1.34 CC(c1cccnc1)N(C)CF 269982a_100000232774_100015361967 [1,0,1,0,0,0|1,0,1]=4 119 B12R1.34 CCN(C)C(C)c1ccccc1 2230a_100000195388_100000210202 [1,0,1,0,0,0|1,0,1]=4 120 B12R1.34 CCN(C)C(C)c1ccccc1 2230a_100000225621_100000230085 [1,0,1,0,0,0|1,0,1]=4 121 B12R1.34 CCN(C)C(C)c1ccccc1 269982a_100000195388_100000204670 [1,0,1,0,0,0|1,0,1]=4 122 B12R1.34 CCN(C)C(C)c1ccccc1 269982a_100000225621_100000230085 [1,0,1,0,0,0|1,0,1]=4 123 B12R1.34 CCN(C)C(C)c1cccnc1 2230a_100000232774_100000210202 [1,0,1,0,0,0|0,0,1]=3 124 B12R1.34 CCN(C)C(C)c1cccnc1 269982a_100000232774_100000204670 [1,0,1,0,0,0|0,0,1]=3 125 B12R1.34 CCN(C)C(C)c1cnccn1 2230a_100000225621_200000703233 [1,0,1,0,0,0|1,0,1]=4 126 B12R1.34 CCN(C)C(C)c1cnccn1 269982a_100000225621_200000703233 [1,0,1,0,0,0|1,0,1]=4 127 B12R1.8 CCCCCOc1cccnc1 34a_100000210849_100000718602 [1,0,1,0,0,0|2,0,0]=4 128 B12R1.8 CCCCCOc1cccnc1 7a_100000210849_100000210326 [1,0,1,0,0,0|2,0,0]=4 129 B12R1.8 CCCCCSc1cccnc1 62a_100000210063_100000210326 [1,0,1,0,0,0|2,0,0]=4 130 B12R1.8 CCCCCSc1cccnc1 62a_100000210326_100000210063 [1,0,1,0,0,0|2,0,0]=4 131 B12R1.8 CCCCNCc1cccnc1 207a_100000102301_100000209961 [1,0,1,0,0,0|2,0,0]=4 132 B12R1.8 CCCCNCc1cccnc1 2230a_100000102301_100000741622 [1,0,1,0,0,0|2,0,0]=4 133 B12R1.8 CCCCNCc1cccnc1 270004a_100000102301_100000209961 [1,0,1,0,0,0|2,0,0]=4 134 B12R1.8 CCCCNCc1cccnc1 7a_106832991798_100000741622 [1,0,1,0,0,0|2,0,0]=4 135 B12R1.8 CCCCOCc1cccnc1 34a_100000210227_100000733263 [1,0,1,0,0,0|2,0,0]=4 136 B12R1.8 CCCCOCc1cccnc1 7a_100000210227_100000741622 [1,0,1,0,0,0|2,0,0]=4 137 B12R1.8 CCCCSCc1cccnc1 62a_100000210211_100000741622 [1,0,1,0,0,0|2,0,0]=4 138 B12R1.8 CCCCSCc1cccnc1 62a_100000741622_100000210210 [1,0,1,0,0,0|2,0,0]=4 139 B12R1.8 CCCNCCc1cccnc1 2230a_100000736294_100000210303 [1,0,1,0,0,0|2,0,0]=4 140 B12R1.8 CCCOCCc1cccnc1 34a_100011217484_100000210303 [1,0,1,0,0,0|2,0,0]=4 141 B12R1.8 CCCSCCc1cccnc1 62a_100000210303_200011713674 [1,0,1,0,0,0|2,0,0]=4 142 B12R1.8 CCCSCCc1cccnc1 62a_200011713674_100000210303 [1,0,1,0,0,0|2,0,0]=4 143 B12R1.8 CCNCCCc1cccnc1 2230a_100011532358_100000210202 [1,0,1,0,0,0|2,0,0]=4 144 B12R1.8 CCNCCCc1cccnc1 34a_100011532358_100000210202 [1,0,1,0,0,0|2,0,0]=4 145 B12R1.8 CCOCCCc1cccnc1 34a_100000211284_100000210202 [1,0,1,0,0,0|2,0,0]=4 146 B12R1.8 CNCCCCc1ccccc1 2230a_100015280158_200000210301 [1,0,1,0,0,0|1,0,1]=4 147 B12R1.8 CNCCCCc1ccccc1 2230a_106832991635_100000701786 [1,0,1,0,0,0|1,0,1]=4 148 B12R1.8 CNCCCCc1ccccc1 34a_100015280158_200000210301 [1,0,1,0,0,0|1,0,1]=4 149 B12R1.8 CNCCCCc1ccccc1 34a_100102657272_100000701786 [1,0,1,0,0,0|1,0,1]=4 150 B12R1.8 CNCCCCc1ccccc1 7a_106832991635_100000701786 [1,0,1,0,0,0|1,0,1]=4 151 B12R1.8 COCCCCc1ccccc1 34a_100000703073_200000210301 [1,0,1,0,0,0|2,0,0]=4 152 B12R1.8 COCCCCc1ccccc1 34a_100138415774_100000701786 [1,0,1,0,0,0|2,0,0]=4 153 B12R1.8 COCCCCc1ccccc1 7a_100000703073_200000210301 [1,0,1,0,0,0|2,0,0]=4 154 B12R1.8 COCCCCc1cccnc1 34a_100012039607_200000210301 [1,0,1,0,0,0|1,0,0]=3 155 B12R1.8 COCCCCc1cccnc1 7a_100012039607_200000210301 [1,0,1,0,0,0|1,0,0]=3 156 B12R1.8 COCCCOc1cccnc1 34a_100000210849_100000740836 [1,0,1,0,0,0|2,0,0]=4 157 B12R1.8 COCCCOc1cccnc1 7a_100000210849_100000740836 [1,0,1,0,0,0|2,0,0]=4 158 B12R1.8 COCCCSc1cccnc1 62a_100000210063_100000709357 [1,0,1,0,0,0|2,0,0]=4 159 B12R1.8 COCCCSc1cccnc1 62a_100000709357_100000210063 [1,0,1,0,0,0|2,0,0]=4 160 B12R1.8 COCCNCc1cccnc1 207a_100000209980_100000209961 [1,0,1,0,0,0|2,0,0]=4 161 B12R1.8 COCCNCc1cccnc1 2230a_100000209980_100000741622 [1,0,1,0,0,0|2,0,0]=4 162 B12R1.8 COCCNCc1cccnc1 270004a_100000209980_100000209961 [1,0,1,0,0,0|2,0,0]=4 163 B12R1.8 COCCOCc1cccnc1 34a_100000210237_100000733263 [1,0,1,0,0,0|2,0,0]=4 164 B12R1.8 COCCSCc1cccnc1 62a_100000233755_100000741622 [1,0,1,0,0,0|2,0,0]=4 165 B12R1.8 COCCSCc1cccnc1 62a_100000741622_100000233755 [1,0,1,0,0,0|2,0,0]=4 166 B12R1.8 COCNCCc1cccnc1 2230a_100000736294_100000766300 [1,0,1,0,0,0|2,0,0]=4 167 B12R1.8 COCSCCc1cccnc1 62a_100000766300_200011713674 [1,0,1,0,0,0|2,0,0]=4 168 B12R1.8 COCSCCc1cccnc1 62a_200011713674_100000766300 [1,0,1,0,0,0|2,0,0]=4 169 B12R1.8 CSCCCCc1ccccc1 62a_100000701786_200000210301 [1,0,1,0,0,0|2,0,0]=4 170 B12R1.8 CSCCCCc1ccccc1 62a_200000210301_100000701786 [1,0,1,0,0,0|2,0,0]=4 171 B12R1.8 CSCCNCc1cccnc1 207a_100020590264_100000209961 [1,0,1,0,0,0|2,0,0]=4 172 B12R1.8 CSCCNCc1cccnc1 2230a_100020590264_100000741622 [1,0,1,0,0,0|2,0,0]=4 173 B12R1.8 CSCCNCc1cccnc1 270004a_100020590264_100000209961 [1,0,1,0,0,0|2,0,0]=4 174 B12R1.8 CSCCOCc1cccnc1 34a_100000230434_100000733263 [1,0,1,0,0,0|2,0,0]=4 175 B12R1.8 CSCCOCc1cccnc1 7a_100000230434_100000741622 [1,0,1,0,0,0|2,0,0]=4 176 B12R1.8 CSCCSCc1cccnc1 62a_100000212216_100000741622 [1,0,1,0,0,0|2,0,0]=4 177 B12R1.8 CSCCSCc1cccnc1 62a_100000741622_100000751147 [1,0,1,0,0,0|2,0,0]=4 178 B12R1.8 CSCNCCc1cccnc1 2230a_100000736294_100011218213 [1,0,1,0,0,0|2,0,0]=4 179 B12R1.8 CSCOCCc1cccnc1 34a_100011217484_100011218213 [1,0,1,0,0,0|2,0,0]=4 180 B12R1.8 CSCSCCc1cccnc1 62a_100011218213_200011713674 [1,0,1,0,0,0|2,0,0]=4 181 B12R1.8 CSCSCCc1cccnc1 62a_200011713674_100011218213 [1,0,1,0,0,0|2,0,0]=4 182 B12R1.8 [13CH3]NCCCCc1ccccc1 2230a_100015280158_200025704644 [1,0,1,0,0,0|1,0,1]=4 183 B12R1.8 [13CH3]NCCCCc1ccccc1 34a_100015280158_200025704644 [1,0,1,0,0,0|1,0,1]=4 184 B12R1.8 [13CH3]OCCCCc1ccccc1 34a_100000703073_200025704644 [1,0,1,0,0,0|2,0,0]=4 185 B12R1.8 [13CH3]OCCCCc1ccccc1 7a_100000703073_200025704644 [1,0,1,0,0,0|2,0,0]=4 186 B12R1.8 [13CH3]OCCCCc1cccnc1 34a_100012039607_200025704644 [1,0,1,0,0,0|1,0,0]=3 187 B12R1.8 [13CH3]OCCCCc1cccnc1 7a_100012039607_200025704644 [1,0,1,0,0,0|1,0,0]=3 188 B12R1.8 [13CH3]SCCCCc1ccccc1 62a_100000701786_200025704644 [1,0,1,0,0,0|2,0,0]=4 189 B12R1.8 [13CH3]SCCCCc1ccccc1 62a_200025704644_100000701786 [1,0,1,0,0,0|2,0,0]=4 190 B12R1.3 CCCC(NC)c1ccccc1 2230a_100000189686_200000210301 [1,0,1,0,0,0|1,0,1]=4 191 B12R1.3 CCCC(NC)c1ccccc1 269862a_106832991636_100000211045 [1,0,1,0,0,0|1,0,1]=4 192 B12R1.3 CCCC(NC)c1ccccc1 34a_100000189686_200000210301 [1,0,1,0,0,0|1,0,1]=4 193 B12R1.3 CCCC(NC)c1cccnc1 2230a_100011351308_200000210301 [1,0,1,0,0,0|0,0,1]=3 194 B12R1.3 CCCC(NC)c1cccnc1 269862a_106832991636_100000700227 [1,0,1,0,0,0|0,0,1]=3 195 B12R1.3 CCCC(N[13CH3])c1ccccc1 2230a_100000189686_200025704644 [1,0,1,0,0,0|1,0,1]=4 196 B12R1.3 CCCC(N[13CH3])c1ccccc1 34a_100000189686_200025704644 [1,0,1,0,0,0|1,0,1]=4 197 B12R1.3 CCCC(N[13CH3])c1cccnc1 2230a_100011351308_200025704644 [1,0,1,0,0,0|0,0,1]=3 198 B12R1.3 CCCC(OC)c1ccccc1 34a_100000747916_200000210301 [1,0,1,0,0,0|2,0,0]=4 199 B12R1.3 CCCC(OC)c1ccccc1 7a_100000747916_200000210301 [1,0,1,0,0,0|2,0,0]=4 200 B12R1.3 CCCC(O[13CH3])c1ccccc1 34a_100000747916_200025704644 [1,0,1,0,0,0|2,0,0]=4 201 B12R1.3 CCCC(O[13CH3])c1ccccc1 7a_100000747916_200025704644 [1,0,1,0,0,0|2,0,0]=4 202 B12R1.3 CCNC(CC)c1cccnc1 2230a_100000246009_100000210202 [1,0,1,0,0,0|2,0,0]=4 203 B12R1.3 CCNC(CC)c1cccnc1 269862a_100015525214_100011218761 [1,0,1,0,0,0|2,0,0]=4 204 B12R1.478 CC(C)C(N[13CH3])c1cccnc1 2230a_100015185317_200025704644 [1,0,1,0,0,0|2,0,0]=4 205 B12R1.478 CCC(c1ccccc1)N(C)C 2230a_100000737544_200000210301 [1,0,1,0,0,0|1,0,1]=4 206 B12R1.478 CCC(c1ccccc1)N(C)C 269982a_100000737544_200000210301 [1,0,1,0,0,0|1,0,1]=4 207 B12R1.478 CCC(c1ccccc1)N(C)[13CH3] 2230a_100000737544_200025704644 [1,0,1,0,0,0|1,0,1]=4 208 B12R1.478 CCC(c1ccccc1)N(C)[13CH3] 269982a_100000737544_200025704644 [1,0,1,0,0,0|1,0,1]=4 209 B12R1.478 CCC(c1cccnc1)N(C)C 2230a_200011351541_200000210301 [1,0,1,0,0,0|0,0,1]=3 210 B12R1.478 CCC(c1cccnc1)N(C)C 269982a_200011351541_200000210301 [1,0,1,0,0,0|0,0,1]=3 211 B12R1.478 CCC(c1cccnc1)N(C)[13CH3] 2230a_200011351541_200025704644 [1,0,1,0,0,0|0,0,1]=3 212 B12R1.478 CCC(c1cccnc1)N(C)[13CH3] 269982a_200011351541_200025704644 [1,0,1,0,0,0|0,0,1]=3 213 B12R1.478 CNC(c1cccnc1)C(C)C 2230a_100015185317_200000210301 [1,0,1,0,0,0|2,0,0]=4 214 B12R1.32 CCCC(=O)Cc1cccnc1 1458a_100000211992_100000733263 [1,0,1,0,0,0|1,0,1]=4 215 B12R1.32 CCCC(=O)Cc1cccnc1 1458a_100000737805_100000210303 [1,0,1,0,0,0|1,0,1]=4 216 B12R1.32 CCCC(C)Oc1cccnc1 34a_100000210849_100000766640 [1,0,1,0,0,0|2,0,0]=4 217 B12R1.32 CCCC(C)Oc1cccnc1 7a_100000210849_100000766640 [1,0,1,0,0,0|2,0,0]=4 218 B12R1.32 CCCC(C)Sc1cccnc1 62a_100000210063_100000766640 [1,0,1,0,0,0|2,0,0]=4 219 B12R1.32 CCCC(C)Sc1cccnc1 62a_100000766640_100000210063 [1,0,1,0,0,0|2,0,0]=4 220 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000184400_200000210301 [1,0,1,0,0,0|1,0,1]=4 221 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000186898_100000210303 [1,0,1,0,0,0|1,0,1]=4 222 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000747261_100015291786 [1,0,1,0,0,0|1,0,1]=4 223 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000184400_200000210301 [1,0,1,0,0,0|1,0,1]=4 224 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000186898_100000210303 [1,0,1,0,0,0|1,0,1]=4 225 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000747261_100000211182 [1,0,1,0,0,0|1,0,1]=4 226 B12R1.32 CCCN(C)Cc1ccccc1 270004a_100000747261_100015611070 [1,0,1,0,0,0|1,0,1]=4 227 B12R1.32 CCCN(C)Cc1cccnc1 2230a_100000184577_100000210303 [1,0,1,0,0,0|0,0,1]=3 228 B12R1.32 CCCN(C)Cc1cccnc1 2230a_100000747261_100000741622 [1,0,1,0,0,0|0,0,1]=3 229 B12R1.32 CCCN(C)Cc1cccnc1 2230a_100160553015_200000210301 [1,0,1,0,0,0|0,0,1]=3 230 B12R1.32 CCCN(C)Cc1cccnc1 269982a_100000184577_100000210303 [1,0,1,0,0,0|0,0,1]=3 231 B12R1.32 CCCN(C)Cc1cccnc1 269982a_100000747261_100000733263 [1,0,1,0,0,0|0,0,1]=3 232 B12R1.32 CCCN(C)Cc1cccnc1 269982a_100160553015_200000210301 [1,0,1,0,0,0|0,0,1]=3 233 B12R1.32 CCCN(C)Cc1cccnc1 270004a_100000747261_100000209961 [1,0,1,0,0,0|0,0,1]=3 234 B12R1.32 CCCN(C)Cc1cccnn1 2230a_100000747261_100016990269 [1,0,1,0,0,0|1,0,1]=4 235 B12R1.32 CCCN(C)Cc1ccnnc1 270004a_100000747261_100011934578 [1,0,1,0,0,0|1,0,1]=4 236 B12R1.32 CCCN(C)Cc1cnccn1 2230a_100000747261_100016995436 [1,0,1,0,0,0|1,0,1]=4 237 B12R1.32 CCCN(C)Cc1cnccn1 2230a_100011269079_100000210303 [1,0,1,0,0,0|1,0,1]=4 238 B12R1.32 CCCN(C)Cc1cnccn1 269982a_100000747261_100016995436 [1,0,1,0,0,0|1,0,1]=4 239 B12R1.32 CCCN(C)Cc1cnccn1 269982a_100011269079_100000210303 [1,0,1,0,0,0|1,0,1]=4 240 B12R1.32 CCCN(C)Cc1cnccn1 270004a_100000747261_100000749867 [1,0,1,0,0,0|1,0,1]=4 241 B12R1.32 CCCN(C)Cc1cncnc1 2230a_100000747261_100015196519 [1,0,1,0,0,0|1,0,1]=4 242 B12R1.32 CCCN(C)Cc1cncnc1 269982a_100000747261_100016991940 [1,0,1,0,0,0|1,0,1]=4 243 B12R1.32 CCCN(C)Cc1cncnc1 270004a_100000747261_100000749868 [1,0,1,0,0,0|1,0,1]=4 244 B12R1.32 CCCN([13CH3])Cc1ccccc1 2230a_100000184400_200025704644 [1,0,1,0,0,0|1,0,1]=4 245 B12R1.32 CCCN([13CH3])Cc1ccccc1 269982a_100000184400_200025704644 [1,0,1,0,0,0|1,0,1]=4 246 B12R1.32 CCCN([13CH3])Cc1cccnc1 2230a_100160553015_200025704644 [1,0,1,0,0,0|0,0,1]=3 247 B12R1.32 CCCN([13CH3])Cc1cccnc1 269982a_100160553015_200025704644 [1,0,1,0,0,0|0,0,1]=3 248 B12R1.32 CCNC(C)Cc1cccnc1 2230a_100011207255_100000210202 [1,0,1,0,0,0|2,0,0]=4 249 B12R1.32 CCNC(C)Cc1cccnc1 270004a_100015525214_100015187140 [1,0,1,0,0,0|2,0,0]=4 250 B12R1.32 CN(CCF)Cc1cccnc1 2230a_100000184577_100011217306 [1,0,1,0,0,0|1,0,1]=4 251 B12R1.32 CN(CCF)Cc1cccnc1 269982a_100000184577_100011217306 [1,0,1,0,0,0|1,0,1]=4 252 B12R1.32 CN(CCO)Cc1cccnc1 2230a_100000184577_100000211926 [1,0,1,0,0,0|1,0,1]=4 253 B12R1.32 CN(CCO)Cc1cccnc1 2230a_100000210263_100000741622 [1,0,1,0,0,0|1,0,1]=4 254 B12R1.32 CN(CCO)Cc1cccnc1 2230a_200000200437_200000210301 [1,0,1,0,0,0|1,0,1]=4 255 B12R1.32 CN(CCO)Cc1cccnc1 269982a_100000184577_100000211926 [1,0,1,0,0,0|1,0,1]=4 256 B12R1.32 CN(CCO)Cc1cccnc1 269982a_100000210263_100000733263 [1,0,1,0,0,0|1,0,1]=4 257 B12R1.32 CN(CCO)Cc1cccnc1 269982a_200000200437_200000210301 [1,0,1,0,0,0|1,0,1]=4 258 B12R1.32 CN(CCO)Cc1cccnc1 270004a_100000210263_100000209961 [1,0,1,0,0,0|1,0,1]=4 259 B12R1.32 COCN(C)Cc1cccnc1 2230a_100000184577_100000766300 [1,0,1,0,0,0|1,0,1]=4 260 B12R1.32 COCN(C)Cc1cccnc1 269982a_100000184577_100000766300 [1,0,1,0,0,0|1,0,1]=4 261 B12R1.32 CSCN(C)Cc1cccnc1 2230a_100000184577_100011218213 [1,0,1,0,0,0|1,0,1]=4 262 B12R1.32 CSCN(C)Cc1cccnc1 269982a_100000184577_100011218213 [1,0,1,0,0,0|1,0,1]=4 263 B12R1.32 [13CH3]N(CCO)Cc1cccnc1 2230a_200000200437_200025704644 [1,0,1,0,0,0|1,0,1]=4 264 B12R1.32 [13CH3]N(CCO)Cc1cccnc1 269982a_200000200437_200025704644 [1,0,1,0,0,0|1,0,1]=4 265 B12R2.2 C1=C(CCC1)c2cccnc2 271570a_100000089523_100000752921 [2,0,0,0,0,0|1,0,1]=4 266 B14R1.3331 C[N+](C)(C)CCCOc1cccnc1 34a_100000210849_100016990835 [0,1,1,0,0,0|2,0,0]=4 267 B14R1.3331 C[N+](C)(C)CCCOc1cccnc1 7a_100000210849_100016990835 [0,1,1,0,0,0|2,0,0]=4 268 B14R1.3331 C[N+](C)(C)CCCSc1cccnc1 62a_100000210063_100016990835 [0,1,1,0,0,0|2,0,0]=4 269 B14R1.3331 C[N+](C)(C)CCCSc1cccnc1 62a_100016990835_100000210063 [0,1,1,0,0,0|2,0,0]=4 270 B14R1.3331 C[N+](C)(C)CCNCc1cccnc1 207a_100000106457_100000209961 [0,1,1,0,0,0|2,0,0]=4 271 B14R1.3331 C[N+](C)(C)CCNCc1cccnc1 270004a_100000106457_100000209961 [0,1,1,0,0,0|2,0,0]=4 272 B14R1.3331 C[N+](C)(C)CCOCc1cccnc1 7a_200020618287_100000741622 [0,1,1,0,0,0|2,0,0]=4 273 B14R1.3331 C[N+](C)(C)CCSCc1cccnc1 62a_100000085578_100000741622 [0,1,1,0,0,0|2,0,0]=4 274 B14R1.3331 C[N+](C)(C)CCSCc1cccnc1 62a_100000741622_100000085578 [0,1,1,0,0,0|2,0,0]=4 275 B14R1.3331 C[N+](C)(C)CSCCc1cccnc1 62a_200000036245_200011713674 [0,1,1,0,0,0|2,0,0]=4 276 B14R1.3331 C[N+](C)(C)CSCCc1cccnc1 62a_200011713674_200000036245 [0,1,1,0,0,0|2,0,0]=4 277 B14R1.178 CCCCC(c1cccnc1)N(C)C 2230a_200015184046_200000210301 [0,1,1,0,0,0|1,0,1]=4 278 B14R1.178 CCCCC(c1cccnc1)N(C)C 269982a_200015184046_200000210301 [0,1,1,0,0,0|1,0,1]=4 279 B14R1.178 CCCCC(c1cccnc1)N(C)[13CH3] 2230a_200015184046_200025704644 [0,1,1,0,0,0|1,0,1]=4 280 B14R1.178 CCCCC(c1cccnc1)N(C)[13CH3] 269982a_200015184046_200025704644 [0,1,1,0,0,0|1,0,1]=4 281 B14R1.178 CCCNC(c1cccnc1)C(C)C 2230a_100015185317_100000210303 [0,1,1,0,0,0|2,0,0]=4 282 B14R1.4528 COCC[N+](C)(C)Cc1ccccc1 7a_100000138075_200000210301 [0,1,1,0,0,0|2,0,0]=4 283 B14R1.4528 C[N+](C)(CCO[13CH3])Cc1ccccc1 7a_100000138075_200025704644 [0,1,1,0,0,0|2,0,0]=4 284 B14R2.14 CCN1CCCC1c2ccccc2 2230a_100000243309_100000210202 [1,1,0,0,0,0|1,0,1]=4 285 B14R2.14 CCN1CCCC1c2ccccc2 269982a_100000243309_100000204670 [1,1,0,0,0,0|1,0,1]=4 286 B14R2.14 CCN1CCCC1c2ccccc2 34a_100000243309_100000210202 [1,1,0,0,0,0|1,0,1]=4 287 B14R2.14 CCN1CCCC1c2cccnc2 2230a_100000233489_100000210202 [1,1,0,0,0,0|0,0,1]=3 288 B14R2.14 CCN1CCCC1c2cccnc2 269982a_100000233489_100000204670 [1,1,0,0,0,0|0,0,1]=3 289 B14R2.14 CN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_200000210301 [1,1,0,0,0,0|2,0,0]=4 290 B14R2.14 CN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_200000210301 [1,1,0,0,0,0|2,0,0]=4 291 B14R2.14 FCN1CCCC1c2ccccc2 269982a_100000243309_100015361967 [1,1,0,0,0,0|1,0,1]=4 292 B14R2.14 FCN1CCCC1c2ccccc2 34a_100000243309_100015361967 [1,1,0,0,0,0|1,0,1]=4 293 B14R2.14 FCN1CCCC1c2cccnc2 269982a_100000233489_100015361967 [1,1,0,0,0,0|0,0,1]=3 294 B14R2.14 [13CH3]N[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_200025704644 [1,1,0,0,0,0|2,0,0]=4 295 B14R2.14 [13CH3]N[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_200025704644 [1,1,0,0,0,0|2,0,0]=4 296 B14R2.269 CN1CCCC1c2cccc(c2)Br 2230a_100015187783_200000210301 [1,1,0,0,0,0|1,0,1]=4 297 B14R2.269 CN1CCCC1c2cccc(c2)Br 269982a_100015187783_200000210301 [1,1,0,0,0,0|1,0,1]=4 298 B14R2.269 CN1CCCC1c2cccc(c2)Br 34a_100015187783_200000210301 [1,1,0,0,0,0|1,0,1]=4 299 B14R2.269 CN1CCCC1c2cccc(c2)Cl 2230a_100000741648_200000210301 [1,1,0,0,0,0|1,0,1]=4 300 B14R2.269 CN1CCCC1c2cccc(c2)Cl 269982a_100000741648_200000210301 [1,1,0,0,0,0|1,0,1]=4 301 B14R2.269 CN1CCCC1c2cccc(c2)Cl 34a_100000741648_200000210301 [1,1,0,0,0,0|1,0,1]=4 302 B14R2.269 CN1CCCC1c2cccc(c2)F 2230a_100000742875_200000210301 [1,1,0,0,0,0|1,0,1]=4 303 B14R2.269 CN1CCCC1c2cccc(c2)F 269982a_100000742875_200000210301 [1,1,0,0,0,0|1,0,1]=4 304 B14R2.269 CN1CCCC1c2cccc(c2)F 34a_100000742875_200000210301 [1,1,0,0,0,0|1,0,1]=4 305 B14R2.269 CN1CCCC1c2cncc(c2)Br 2230a_100012340264_200000210301 [1,1,0,0,0,0|0,0,1]=3 306 B14R2.269 CN1CCCC1c2cncc(c2)Br 269982a_100012340264_200000210301 [1,1,0,0,0,0|0,0,1]=3 307 B14R2.269 Cc1cccc(c1)C2CCCN2C 2230a_100000741861_200000210301 [1,1,0,0,0,0|1,0,1]=4 308 B14R2.269 Cc1cccc(c1)C2CCCN2C 269982a_100000741861_200000210301 [1,1,0,0,0,0|1,0,1]=4 309 B14R2.269 Cc1cccc(c1)C2CCCN2C 34a_100000741861_200000210301 [1,1,0,0,0,0|1,0,1]=4 310 B14R2.269 Cc1cccc(c1)C2CCCN2[13CH3] 2230a_100000741861_200025704644 [1,1,0,0,0,0|1,0,1]=4 311 B14R2.269 Cc1cccc(c1)C2CCCN2[13CH3] 269982a_100000741861_200025704644 [1,1,0,0,0,0|1,0,1]=4 312 B14R2.269 Cc1cccc(c1)C2CCCN2[13CH3] 34a_100000741861_200025704644 [1,1,0,0,0,0|1,0,1]=4 313 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Br 2230a_100015187783_200025704644 [1,1,0,0,0,0|1,0,1]=4 314 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Br 269982a_100015187783_200025704644 [1,1,0,0,0,0|1,0,1]=4 315 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Br 34a_100015187783_200025704644 [1,1,0,0,0,0|1,0,1]=4 316 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Cl 2230a_100000741648_200025704644 [1,1,0,0,0,0|1,0,1]=4 317 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Cl 269982a_100000741648_200025704644 [1,1,0,0,0,0|1,0,1]=4 318 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)Cl 34a_100000741648_200025704644 [1,1,0,0,0,0|1,0,1]=4 319 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)F 2230a_100000742875_200025704644 [1,1,0,0,0,0|1,0,1]=4 320 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)F 269982a_100000742875_200025704644 [1,1,0,0,0,0|1,0,1]=4 321 B14R2.269 [13CH3]N1CCCC1c2cccc(c2)F 34a_100000742875_200025704644 [1,1,0,0,0,0|1,0,1]=4 322 B14R2.269 [13CH3]N1CCCC1c2cncc(c2)Br 2230a_100012340264_200025704644 [1,1,0,0,0,0|0,0,1]=3 323 B14R2.269 [13CH3]N1CCCC1c2cncc(c2)Br 269982a_100012340264_200025704644 [1,1,0,0,0,0|0,0,1]=3 324 B14R2.296 CN1CCCC1c2ccccc2Br 2230a_100000686366_200000210301 [1,1,0,0,0,0|1,0,1]=4 325 B14R2.296 CN1CCCC1c2ccccc2Br 269982a_100000686366_200000210301 [1,1,0,0,0,0|1,0,1]=4 326 B14R2.296 CN1CCCC1c2ccccc2Br 34a_100000686366_200000210301 [1,1,0,0,0,0|1,0,1]=4 327 B14R2.296 CN1CCCC1c2ccccc2Cl 2230a_100000742539_200000210301 [1,1,0,0,0,0|1,0,1]=4 328 B14R2.296 CN1CCCC1c2ccccc2Cl 269982a_100000742539_200000210301 [1,1,0,0,0,0|1,0,1]=4 329 B14R2.296 CN1CCCC1c2ccccc2Cl 34a_100000742539_200000210301 [1,1,0,0,0,0|1,0,1]=4 330 B14R2.296 CN1CCCC1c2ccccc2F 2230a_100011206064_200000210301 [1,1,0,0,0,0|1,0,1]=4 331 B14R2.296 CN1CCCC1c2ccccc2F 269982a_100011206064_200000210301 [1,1,0,0,0,0|1,0,1]=4 332 B14R2.296 CN1CCCC1c2ccccc2F 34a_100011206064_200000210301 [1,1,0,0,0,0|1,0,1]=4 333 B14R2.296 Cc1ccccc1C2CCCN2C 2230a_100000742541_200000210301 [1,1,0,0,0,0|1,0,1]=4 334 B14R2.296 Cc1ccccc1C2CCCN2C 269982a_100000742541_200000210301 [1,1,0,0,0,0|1,0,1]=4 335 B14R2.296 Cc1ccccc1C2CCCN2C 34a_100000742541_200000210301 [1,1,0,0,0,0|1,0,1]=4 336 B14R2.296 Cc1ccccc1C2CCCN2[13CH3] 2230a_100000742541_200025704644 [1,1,0,0,0,0|1,0,1]=4 337 B14R2.296 Cc1ccccc1C2CCCN2[13CH3] 269982a_100000742541_200025704644 [1,1,0,0,0,0|1,0,1]=4 338 B14R2.296 Cc1ccccc1C2CCCN2[13CH3] 34a_100000742541_200025704644 [1,1,0,0,0,0|1,0,1]=4 339 B14R2.296 [13CH3]N1CCCC1c2ccccc2Br 2230a_100000686366_200025704644 [1,1,0,0,0,0|1,0,1]=4 340 B14R2.296 [13CH3]N1CCCC1c2ccccc2Br 269982a_100000686366_200025704644 [1,1,0,0,0,0|1,0,1]=4 341 B14R2.296 [13CH3]N1CCCC1c2ccccc2Br 34a_100000686366_200025704644 [1,1,0,0,0,0|1,0,1]=4 342 B14R2.296 [13CH3]N1CCCC1c2ccccc2Cl 2230a_100000742539_200025704644 [1,1,0,0,0,0|1,0,1]=4 343 B14R2.296 [13CH3]N1CCCC1c2ccccc2Cl 269982a_100000742539_200025704644 [1,1,0,0,0,0|1,0,1]=4 344 B14R2.296 [13CH3]N1CCCC1c2ccccc2Cl 34a_100000742539_200025704644 [1,1,0,0,0,0|1,0,1]=4 345 B14R2.296 [13CH3]N1CCCC1c2ccccc2F 2230a_100011206064_200025704644 [1,1,0,0,0,0|1,0,1]=4 346 B14R2.296 [13CH3]N1CCCC1c2ccccc2F 269982a_100011206064_200025704644 [1,1,0,0,0,0|1,0,1]=4 347 B14R2.296 [13CH3]N1CCCC1c2ccccc2F 34a_100011206064_200025704644 [1,1,0,0,0,0|1,0,1]=4 348 B14R2.926 CN1CCCC1c2ccc(cc2)Br 2230a_100000766735_200000210301 [1,1,0,0,0,0|1,0,1]=4 349 B14R2.926 CN1CCCC1c2ccc(cc2)Br 269982a_100000766735_200000210301 [1,1,0,0,0,0|1,0,1]=4 350 B14R2.926 CN1CCCC1c2ccc(cc2)Br 34a_100000766735_200000210301 [1,1,0,0,0,0|1,0,1]=4 351 B14R2.926 CN1CCCC1c2ccc(cc2)Cl 2230a_100000736974_200000210301 [1,1,0,0,0,0|1,0,1]=4 352 B14R2.926 CN1CCCC1c2ccc(cc2)Cl 269982a_100000736974_200000210301 [1,1,0,0,0,0|1,0,1]=4 353 B14R2.926 CN1CCCC1c2ccc(cc2)Cl 34a_100000736974_200000210301 [1,1,0,0,0,0|1,0,1]=4 354 B14R2.926 CN1CCCC1c2ccc(cc2)F 2230a_100000243150_200000210301 [1,1,0,0,0,0|1,0,1]=4 355 B14R2.926 CN1CCCC1c2ccc(cc2)F 269982a_100000243150_200000210301 [1,1,0,0,0,0|1,0,1]=4 356 B14R2.926 CN1CCCC1c2ccc(cc2)F 34a_100000243150_200000210301 [1,1,0,0,0,0|1,0,1]=4 357 B14R2.926 Cc1ccc(cc1)C2CCCN2C 2230a_100000736514_200000210301 [1,1,0,0,0,0|1,0,1]=4 358 B14R2.926 Cc1ccc(cc1)C2CCCN2C 269982a_100000736514_200000210301 [1,1,0,0,0,0|1,0,1]=4 359 B14R2.926 Cc1ccc(cc1)C2CCCN2C 34a_100000736514_200000210301 [1,1,0,0,0,0|1,0,1]=4 360 B14R2.926 Cc1ccc(cc1)C2CCCN2[13CH3] 2230a_100000736514_200025704644 [1,1,0,0,0,0|1,0,1]=4 361 B14R2.926 Cc1ccc(cc1)C2CCCN2[13CH3] 269982a_100000736514_200025704644 [1,1,0,0,0,0|1,0,1]=4 362 B14R2.926 Cc1ccc(cc1)C2CCCN2[13CH3] 34a_100000736514_200025704644 [1,1,0,0,0,0|1,0,1]=4 363 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)Br 2230a_100000766735_200025704644 [1,1,0,0,0,0|1,0,1]=4 364 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)Br 269982a_100000766735_200025704644 [1,1,0,0,0,0|1,0,1]=4 365 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)Br 34a_100000766735_200025704644 [1,1,0,0,0,0|1,0,1]=4 366 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)Cl 2230a_100000736974_200025704644 [1,1,0,0,0,0|1,0,1]=4 367 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)Cl 269982a_100000736974_200025704644 [1,1,0,0,0,0|1,0,1]=4 368 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)Cl 34a_100000736974_200025704644 [1,1,0,0,0,0|1,0,1]=4 369 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)F 2230a_100000243150_200025704644 [1,1,0,0,0,0|1,0,1]=4 370 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)F 269982a_100000243150_200025704644 [1,1,0,0,0,0|1,0,1]=4 371 B14R2.926 [13CH3]N1CCCC1c2ccc(cc2)F 34a_100000243150_200025704644 [1,1,0,0,0,0|1,0,1]=4 372 B14R2.24 CN1CCCCC1c2cccnc2 2230a_100000723942_200000210301 [0,0,1,1,0,0|1,0,1]=4 373 B14R2.24 CN1CCCCC1c2cccnc2 269982a_100000723942_200000210301 [0,0,1,1,0,0|1,0,1]=4 374 B14R2.24 [13CH3]N1CCCCC1c2cccnc2 2230a_100000723942_200025704644 [0,0,1,1,0,0|1,0,1]=4 375 B14R2.24 [13CH3]N1CCCCC1c2cccnc2 269982a_100000723942_200025704644 [0,0,1,1,0,0|1,0,1]=4 376 B12R2.10 CN1CCCC1c2ccco2 2230a_100011206061_200000210301 [1,0,0,0,1,0|1,0,1]=4 377 B12R2.10 CN1CCCC1c2ccco2 269982a_100011206061_200000210301 [1,0,0,0,1,0|1,0,1]=4 378 B12R2.10 CN1CCCC1c2cccs2 2230a_100000185107_200000210301 [1,0,0,0,1,0|1,0,1]=4 379 B12R2.10 CN1CCCC1c2cccs2 269982a_100000185107_200000210301 [1,0,0,0,1,0|1,0,1]=4 380 B12R2.10 CN1CCCC1c2cccs2 34a_100000185107_200000210301 [1,0,0,0,1,0|1,0,1]=4 381 B12R2.10 CN1CCCC1c2ncc[nH]2 2230a_100000696250_200000210301 [1,0,0,0,1,0|1,0,1]=4 382 B12R2.10 CN1CCCC1c2ncc[nH]2 269982a_100000696250_200000210301 [1,0,0,0,1,0|1,0,1]=4 383 B12R2.10 CN1CCCC1c2nccs2 2230a_100102564405_200000210301 [1,0,0,0,1,0|1,0,1]=4 384 B12R2.10 CN1CCCC1c2nccs2 269982a_100102564405_200000210301 [1,0,0,0,1,0|1,0,1]=4 385 B12R2.10 [13CH3]N1CCCC1c2ccco2 2230a_100011206061_200025704644 [1,0,0,0,1,0|1,0,1]=4 386 B12R2.10 [13CH3]N1CCCC1c2ccco2 269982a_100011206061_200025704644 [1,0,0,0,1,0|1,0,1]=4 387 B12R2.10 [13CH3]N1CCCC1c2cccs2 2230a_100000185107_200025704644 [1,0,0,0,1,0|1,0,1]=4 388 B12R2.10 [13CH3]N1CCCC1c2cccs2 269982a_100000185107_200025704644 [1,0,0,0,1,0|1,0,1]=4 389 B12R2.10 [13CH3]N1CCCC1c2cccs2 34a_100000185107_200025704644 [1,0,0,0,1,0|1,0,1]=4 390 B12R2.10 [13CH3]N1CCCC1c2ncc[nH]2 2230a_100000696250_200025704644 [1,0,0,0,1,0|1,0,1]=4 391 B12R2.10 [13CH3]N1CCCC1c2ncc[nH]2 269982a_100000696250_200025704644 [1,0,0,0,1,0|1,0,1]=4 392 B12R2.10 [13CH3]N1CCCC1c2nccs2 2230a_100102564405_200025704644 [1,0,0,0,1,0|1,0,1]=4 393 B12R2.10 [13CH3]N1CCCC1c2nccs2 269982a_100102564405_200025704644 [1,0,0,0,1,0|1,0,1]=4 394 B12R2.23 CN1CCC1c2ccccc2 2230a_100000739605_200000210301 [1,0,0,0,1,0|1,0,1]=4 395 B12R2.23 CN1CCC1c2ccccc2 269982a_100000739605_200000210301 [1,0,0,0,1,0|1,0,1]=4 396 B12R2.23 [13CH3]N1CCC1c2ccccc2 2230a_100000739605_200025704644 [1,0,0,0,1,0|1,0,1]=4 397 B12R2.23 [13CH3]N1CCC1c2ccccc2 269982a_100000739605_200025704644 [1,0,0,0,1,0|1,0,1]=4 398 B14R1.422 C=C(C)CCNCCc1cccnc1 2230a_100000736294_100000730704 [0,0,1,0,0,1|2,0,0]=4 399 B14R1.422 C=C(C)CCOCCc1cccnc1 34a_100011217484_100000730704 [0,0,1,0,0,1|2,0,0]=4 400 B14R1.422 C=C(C)CCSCCc1cccnc1 62a_100000730704_200011713674 [0,0,1,0,0,1|2,0,0]=4 401 B14R1.422 C=C(C)CCSCCc1cccnc1 62a_200011713674_100000730704 [0,0,1,0,0,1|2,0,0]=4 402 B14R1.422 C=C(C)CNCCCc1cccnc1 2230a_100011532358_100000748629 [0,0,1,0,0,1|2,0,0]=4 403 B14R1.422 C=C(C)CNCCCc1cccnc1 34a_100011532358_100000748629 [0,0,1,0,0,1|2,0,0]=4 404 B14R1.422 C=C(C)COCCCc1cccnc1 34a_100000211284_100000748629 [0,0,1,0,0,1|2,0,0]=4 405 B14R1.422 CC(=O)CCCCOc1cccnc1 34a_100000210849_100009817362 [0,0,1,0,0,1|1,0,1]=4 406 B14R1.422 CC(=O)CCCCOc1cccnc1 7a_100000210849_100000735457 [0,0,1,0,0,1|1,0,1]=4 407 B14R1.422 CC(=O)CCCCSc1cccnc1 62a_100000210063_100000735457 [0,0,1,0,0,1|1,0,1]=4 408 B14R1.422 CC(=O)CCCCSc1cccnc1 62a_100000735457_100000210063 [0,0,1,0,0,1|1,0,1]=4 409 B14R1.422 CC(=O)CCCOCc1cccnc1 34a_100000759063_100000733263 [0,0,1,0,0,1|1,0,1]=4 410 B14R1.422 CC(=O)CCCOCc1cccnc1 7a_100000759063_100000741622 [0,0,1,0,0,1|1,0,1]=4 411 B14R1.422 CC(=O)CCCSCc1cccnc1 62a_100000741622_100011215641 [0,0,1,0,0,1|1,0,1]=4 412 B14R1.422 CC(=O)CCCSCc1cccnc1 62a_100011215641_100000741622 [0,0,1,0,0,1|1,0,1]=4 413 B14R1.422 CC(=O)CCOCCc1cccnc1 7a_100000759926_200011713674 [0,0,1,0,0,1|1,0,1]=4 414 B14R1.422 CC(=O)CCSCCc1cccnc1 62a_100000053229_200011713674 [0,0,1,0,0,1|1,0,1]=4 415 B14R1.422 CC(=O)CCSCCc1cccnc1 62a_200011713674_100000053229 [0,0,1,0,0,1|1,0,1]=4 416 B14R1.422 CC(C)CCCCOc1cccnc1 34a_100000210849_100011216152 [0,0,1,0,0,1|2,0,0]=4 417 B14R1.422 CC(C)CCCCOc1cccnc1 7a_100000210849_100011216152 [0,0,1,0,0,1|2,0,0]=4 418 B14R1.422 CC(C)CCCCSc1cccnc1 62a_100000210063_100011216152 [0,0,1,0,0,1|2,0,0]=4 419 B14R1.422 CC(C)CCCCSc1cccnc1 62a_100011216152_100000210063 [0,0,1,0,0,1|2,0,0]=4 420 B14R1.422 CC(C)CCCNCc1cccnc1 207a_200000737386_100000209961 [0,0,1,0,0,1|2,0,0]=4 421 B14R1.422 CC(C)CCCNCc1cccnc1 2230a_200000737386_100000741622 [0,0,1,0,0,1|2,0,0]=4 422 B14R1.422 CC(C)CCCNCc1cccnc1 270004a_200000737386_100000209961 [0,0,1,0,0,1|2,0,0]=4 423 B14R1.422 CC(C)CCCNCc1cccnc1 34a_200000737386_100000733263 [0,0,1,0,0,1|2,0,0]=4 424 B14R1.422 CC(C)CCCOCc1cccnc1 34a_100000210774_100000733263 [0,0,1,0,0,1|2,0,0]=4 425 B14R1.422 CC(C)CCCOCc1cccnc1 7a_100000210774_100000741622 [0,0,1,0,0,1|2,0,0]=4 426 B14R1.422 CC(C)CCCSCc1cccnc1 62a_100000741622_100011214892 [0,0,1,0,0,1|2,0,0]=4 427 B14R1.422 CC(C)CCCSCc1cccnc1 62a_100011214892_100000741622 [0,0,1,0,0,1|2,0,0]=4 428 B14R1.422 CC(C)CCNCCc1cccnc1 2230a_100000736294_100000210312 [0,0,1,0,0,1|2,0,0]=4 429 B14R1.422 CC(C)CCNCCc1cccnc1 269862a_100000736294_100000185833 [0,0,1,0,0,1|2,0,0]=4 430 B14R1.422 CC(C)CCOCCc1cccnc1 34a_100011217484_100000210312 [0,0,1,0,0,1|2,0,0]=4 431 B14R1.422 CC(C)CCOCCc1cccnc1 7a_100000210254_200011713674 [0,0,1,0,0,1|2,0,0]=4 432 B14R1.422 CC(C)CCSCCc1cccnc1 62a_100000210312_200011713674 [0,0,1,0,0,1|2,0,0]=4 433 B14R1.422 CC(C)CCSCCc1cccnc1 62a_200011713674_100000210312 [0,0,1,0,0,1|2,0,0]=4 434 B14R1.422 CC(C)CNCCCc1cccnc1 2230a_100011532358_100000210760 [0,0,1,0,0,1|2,0,0]=4 435 B14R1.422 CC(C)CNCCCc1cccnc1 270004a_100011532358_100000210432 [0,0,1,0,0,1|2,0,0]=4 436 B14R1.422 CC(C)CNCCCc1cccnc1 34a_100011532358_100000210624 [0,0,1,0,0,1|2,0,0]=4 437 B14R1.422 CC(C)COCCCc1cccnc1 34a_100000211284_100000210624 [0,0,1,0,0,1|2,0,0]=4 438 B14R1.422 CC(C)OCCCCc1cccnc1 34a_100012039607_100000210206 [0,0,1,0,0,1|2,0,0]=4 439 B14R1.422 CC(C)OCCCCc1cccnc1 7a_100012039607_100000210206 [0,0,1,0,0,1|2,0,0]=4 440 B14R1.422 CC(O)CCCSCc1cccnc1 62a_100000741622_200000718107 [0,0,1,0,0,1|1,0,1]=4 441 B14R1.422 CC(O)CCCSCc1cccnc1 62a_200000718107_100000741622 [0,0,1,0,0,1|1,0,1]=4 442 B14R1.422 CC(O)CCNCCc1cccnc1 2230a_100000736294_100012276601 [0,0,1,0,0,1|1,0,1]=4 443 B14R1.422 CC(O)CCNCCc1cccnc1 2230a_200000755665_200011713674 [0,0,1,0,0,1|1,0,1]=4 444 B14R1.422 CC(O)CCOCCc1cccnc1 34a_100011217484_100012276601 [0,0,1,0,0,1|1,0,1]=4 445 B14R1.422 CC(O)CCSCCc1cccnc1 62a_100012276601_200011713674 [0,0,1,0,0,1|1,0,1]=4 446 B14R1.422 CC(O)CCSCCc1cccnc1 62a_200011713674_100012276601 [0,0,1,0,0,1|1,0,1]=4 447 B14R1.422 CC(O)CNCCCc1cccnc1 2230a_100011532358_100011218427 [0,0,1,0,0,1|1,0,1]=4 448 B14R1.422 CC(O)CNCCCc1cccnc1 34a_100011532358_100011218427 [0,0,1,0,0,1|1,0,1]=4 449 B14R1.422 CC(O)COCCCc1cccnc1 34a_100000211284_100011218427 [0,0,1,0,0,1|1,0,1]=4 450 B14R1.422 CN(C)CCCCSc1cccnc1 62a_100000210063_100000690147 [0,0,1,0,0,1|1,0,1]=4 451 B14R1.422 CN(C)CCCNCc1cccnc1 207a_102531767803_100000209961 [0,0,1,0,0,1|1,0,1]=4 452 B14R1.422 CN(C)CCCNCc1cccnc1 270004a_102531767803_100000209961 [0,0,1,0,0,1|1,0,1]=4 453 B14R1.422 CN(C)CCCSCc1cccnc1 62a_100000741622_100000757444 [0,0,1,0,0,1|1,0,1]=4 454 B14R1.422 CN(C)CCSCCc1cccnc1 62a_200011713674_100000755713 [0,0,1,0,0,1|1,0,1]=4 455 B14R1.422 CS(=O)CCCNCc1cccnc1 207a_200000753449_100000209961 [0,0,1,0,0,1|1,0,1]=4 456 B14R1.422 CS(=O)CCCNCc1cccnc1 2230a_200000753449_100000741622 [0,0,1,0,0,1|1,0,1]=4 457 B14R1.422 CS(=O)CCCNCc1cccnc1 270004a_200000753449_100000209961 [0,0,1,0,0,1|1,0,1]=4 458 B14R1.422 C[C@@H](O)CNCCCc1cccnc1 2230a_100011532358_100009817552 [0,0,1,0,0,1|1,0,1]=4 459 B14R1.422 C[C@@H](O)CNCCCc1cccnc1 34a_100011532358_100009817552 [0,0,1,0,0,1|1,0,1]=4 460 B14R1.422 C[C@@H](O)COCCCc1cccnc1 34a_100000211284_100009817552 [0,0,1,0,0,1|1,0,1]=4 461 B14R1.422 O=C([O-])CNCCCc1cccnc1 34a_100011532358_100020667443 [0,0,1,0,0,1|2,0,0]=4 462 B14R1.422 O=C([O-])COCCCc1cccnc1 34a_100000211284_100020667443 [0,0,1,0,0,1|2,0,0]=4 463 B14R1.422 O=[N+]([O-])CCCOCc1cccnc1 34a_200000037920_100000733263 [0,0,1,0,0,1|1,0,1]=4 464 B14R1.422 O=[N+]([O-])CNCCCc1cccnc1 34a_100011532358_100000761209 [0,0,1,0,0,1|1,0,1]=4 465 B14R1.422 O=[N+]([O-])COCCCc1cccnc1 34a_100000211284_100000761209 [0,0,1,0,0,1|1,0,1]=4 466 B14R1.515 CCCC(NC(=O)C)c1cccnc1 11a_100011351308_100015343762 [0,0,1,0,0,1|1,0,1]=4 467 B14R1.515 CCCC(NC(=O)C)c1cccnc1 1626a_100011351308_100015343762 [0,0,1,0,0,1|1,0,1]=4 468 B14R1.515 CCCC(NC(=O)C)c1cccnc1 240690a_100011351308_100015343762 [0,0,1,0,0,1|1,0,1]=4 469 B14R1.515 CCCC(NC(=O)C)c1cccnc1 527a_100011351308_100103153847 [0,0,1,0,0,1|1,0,1]=4 470 B14R1.515 CCCC(NC(C)C)c1cccnc1 2230a_100011351308_100000210206 [0,0,1,0,0,1|2,0,0]=4 471 B14R1.6829 CCCC(C)(C)OCc1cccnc1 7a_100000748436_100000741622 [0,0,1,0,0,1|2,0,0]=4 472 B14R1.6829 C[N+](C)(CCO)COc1cccnc1 7a_100000210849_200010270792 [0,0,1,0,0,1|2,0,0]=4 473 B14R1.6829 C[N+](C)(CCO)CSc1cccnc1 62a_100000210063_200010270792 [0,0,1,0,0,1|2,0,0]=4 474 B14R1.6829 C[N+](C)(CCO)CSc1cccnc1 62a_200010270792_100000210063 [0,0,1,0,0,1|2,0,0]=4 475 B14R2.30 CN1CCCC1Cc2ccccc2 2230a_100159249835_200000210301 [1,0,0,0,0,1|1,0,1]=4 476 B14R2.30 CN1CCCC1Cc2ccccc2 269982a_100159249835_200000210301 [1,0,0,0,0,1|1,0,1]=4 477 B14R2.30 CN1CCCC1Cc2ccccc2 34a_100159249835_200000210301 [1,0,0,0,0,1|1,0,1]=4 478 B14R2.30 C[C@@H]1CCCN1Cc2cccnc2 2230a_100015189458_100000741622 [1,0,0,0,0,1|2,0,0]=4 479 B14R2.30 C[C@@H]1CCCN1Cc2cccnc2 269982a_100015189458_100000733263 [1,0,0,0,0,1|2,0,0]=4 480 B14R2.30 C[C@@H]1CCCN1Cc2cccnc2 270004a_100015189458_100000209961 [1,0,0,0,0,1|2,0,0]=4 481 B14R2.30 C[C@@H]1CCCN1Cc2cccnc2 34a_100015189458_100000733263 [1,0,0,0,0,1|2,0,0]=4 482 B14R2.30 C[C@H]1CCCN1Cc2cccnc2 2230a_100020605311_100000741622 [1,0,0,0,0,1|2,0,0]=4 483 B14R2.30 C[C@H]1CCCN1Cc2cccnc2 269982a_100020605311_100000733263 [1,0,0,0,0,1|2,0,0]=4 484 B14R2.30 C[C@H]1CCCN1Cc2cccnc2 270004a_100020605311_100000209961 [1,0,0,0,0,1|2,0,0]=4 485 B14R2.30 O=C1CCCC1Oc2cccnc2 34a_100000210849_100000709159 [1,0,0,0,0,1|1,0,1]=4 486 B14R2.30 O=C1CCCC1Oc2cccnc2 7a_100000210849_100000211823 [1,0,0,0,0,1|1,0,1]=4 487 B14R2.30 O=C1CCCC1Sc2cccnc2 62a_100000210063_100000211823 [1,0,0,0,0,1|1,0,1]=4 488 B14R2.30 O=C1CCCC1Sc2cccnc2 62a_100000211823_100000210063 [1,0,0,0,0,1|1,0,1]=4 489 B14R2.30 O[C@@H]1CCC[C@H]1Sc2cccnc2 62a_100000210063_200016002552 [1,0,0,0,0,1|1,0,1]=4 490 B14R2.30 O[C@@H]1CCC[C@H]1Sc2cccnc2 62a_200016002552_100000210063 [1,0,0,0,0,1|1,0,1]=4 491 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 2230a_100159249835_200025704644 [1,0,0,0,0,1|1,0,1]=4 492 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 269982a_100159249835_200025704644 [1,0,0,0,0,1|1,0,1]=4 493 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 34a_100159249835_200025704644 [1,0,0,0,0,1|1,0,1]=4 494 B16R2.13396 CC1(CCCC1NCc2cccnc2)C 269862a_100000210453_100000065263 [0,0,0,0,0,2|2,0,0]=4 495 B16R2.13396 CC1(CCCC1OCc2cccnc2)C 34a_100000726220_100000733263 [0,0,0,0,0,2|2,0,0]=4 496 B16R2.13396 CC1(CCCC1OCc2cccnc2)C 7a_100000726220_100000741622 [0,0,0,0,0,2|2,0,0]=4 497 B16R2.13396 C[C@]1(CCC[C@H]1NCc2cccnc2)O 207a_100015977457_100000209961 [0,0,0,0,0,2|1,0,1]=4 498 B16R2.13396 C[C@]1(CCC[C@H]1NCc2cccnc2)O 2230a_100015977457_100000741622 [0,0,0,0,0,2|1,0,1]=4 499 B16R2.13396 C[C@]1(CCC[C@H]1NCc2cccnc2)O 270004a_100015977457_100000209961 [0,0,0,0,0,2|1,0,1]=4 500 B16R2.13396 C[C@]1(CCC[C@H]1NCc2cccnc2)O 34a_100015977457_100000733263 [0,0,0,0,0,2|1,0,1]=4