0 B18R2.7079 C=C(C)c1ccc(cc1)OCCc2cn[nH]c2 7a_100009880102_100000743252 [0,0,0,0,0,0|4,0,0]=4 1 B18R2.7079 C=C(C)c1ccc(cc1)OCCn2cccc2 7a_100009880102_200000035178 [0,0,0,0,0,0|3,0,0]=3 2 B18R2.7079 C=C(C)c1ccc(cc1)OCCn2cccn2 271570a_100000694244_200011487139 [0,0,0,0,0,0|4,0,0]=4 3 B18R2.7079 C=C(C)c1ccc(cc1)OCCn2cccn2 34a_100009880102_100015204718 [0,0,0,0,0,0|4,0,0]=4 4 B18R2.7079 C=C(C)c1ccc(cc1)OCCn2cccn2 7a_100009880102_100000685285 [0,0,0,0,0,0|4,0,0]=4 5 B18R2.7079 C=C(C)c1ccc(cc1)OCCn2ccnc2 271570a_100000694244_100015186965 [0,0,0,0,0,0|2,0,0]=2 6 B18R2.7079 C=C(C)c1ccc(cc1)OCCn2ccnc2 7a_100009880102_100000702546 [0,0,0,0,0,0|2,0,0]=2 7 B18R2.7079 C=C(C)c1ccc(cc1)OCCn2cncn2 34a_100009880102_200000749826 [0,0,0,0,0,0|3,0,0]=3 8 B18R2.7079 C=C(C)c1ccc(cc1)OCCn2cncn2 7a_100009880102_100000731791 [0,0,0,0,0,0|3,0,0]=3 9 B18R2.7079 C=C(C)c1ccc(cc1)SCCn2cccc2 62a_100000185454_200000035178 [0,0,0,0,0,0|3,1,0]=4 10 B18R2.7079 C=C(C)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000185454 [0,0,0,0,0,0|3,1,0]=4 11 B18R2.7079 C=C(C)c1ccc(cc1)SCCn2ccnc2 62a_100000185454_100000702546 [0,0,0,0,0,0|2,1,0]=3 12 B18R2.7079 C=C(C)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000185454 [0,0,0,0,0,0|2,1,0]=3 13 B18R2.7079 C=C(C)c1ccc(cc1)SCCn2cncn2 62a_100000185454_100000731791 [0,0,0,0,0,0|3,1,0]=4 14 B18R2.7079 C=C(C)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000185454 [0,0,0,0,0,0|3,1,0]=4 15 B18R2.7079 CC(=O)c1ccc(cc1)COCn2cncn2 7a_100000082505_200020645497 [0,0,0,0,0,0|4,0,0]=4 16 B18R2.7079 CC(=O)c1ccc(cc1)CSCn2cncn2 62a_100000756337_200020645497 [0,0,0,0,0,0|4,0,0]=4 17 B18R2.7079 CC(=O)c1ccc(cc1)CSCn2cncn2 62a_200020645497_100000756337 [0,0,0,0,0,0|4,0,0]=4 18 B18R2.7079 CC(=O)c1ccc(cc1)OCCc2c[nH]cn2 7a_100000185113_100020628418 [0,0,0,0,0,0|3,0,1]=4 19 B18R2.7079 CC(=O)c1ccc(cc1)OCCc2cccs2 34a_100000185113_100000748579 [0,0,0,0,0,0|4,0,0]=4 20 B18R2.7079 CC(=O)c1ccc(cc1)OCCc2cccs2 7a_100000185113_100000748579 [0,0,0,0,0,0|4,0,0]=4 21 B18R2.7079 CC(=O)c1ccc(cc1)OCCc2cn[nH]c2 7a_100000185113_100000743252 [0,0,0,0,0,0|3,0,0]=3 22 B18R2.7079 CC(=O)c1ccc(cc1)OCCn2cccc2 7a_100000185113_200000035178 [0,0,0,0,0,0|2,0,0]=2 23 B18R2.7079 CC(=O)c1ccc(cc1)OCCn2cccn2 34a_100000185113_100015204718 [0,0,0,0,0,0|3,0,0]=3 24 B18R2.7079 CC(=O)c1ccc(cc1)OCCn2cccn2 7a_100000185113_100000685285 [0,0,0,0,0,0|3,0,0]=3 25 B18R2.7079 CC(=O)c1ccc(cc1)OCCn2ccnc2 7a_100000185113_100000702546 [0,0,0,0,0,0|1,0,0]=1 26 B18R2.7079 CC(=O)c1ccc(cc1)OCCn2cncn2 34a_100000185113_200000749826 [0,0,0,0,0,0|2,0,0]=2 27 B18R2.7079 CC(=O)c1ccc(cc1)OCCn2cncn2 7a_100000185113_100000731791 [0,0,0,0,0,0|2,0,0]=2 28 B18R2.7079 CC(=O)c1ccc(cc1)SCCc2cn[nH]c2 62a_100000185465_100000743252 [0,0,0,0,0,0|3,1,0]=4 29 B18R2.7079 CC(=O)c1ccc(cc1)SCCc2cn[nH]c2 62a_100000743252_100000185465 [0,0,0,0,0,0|3,1,0]=4 30 B18R2.7079 CC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000185465_200000035178 [0,0,0,0,0,0|2,1,0]=3 31 B18R2.7079 CC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000185465 [0,0,0,0,0,0|2,1,0]=3 32 B18R2.7079 CC(=O)c1ccc(cc1)SCCn2cccn2 62a_100000185465_100000685285 [0,0,0,0,0,0|3,1,0]=4 33 B18R2.7079 CC(=O)c1ccc(cc1)SCCn2cccn2 62a_100015204718_100000185465 [0,0,0,0,0,0|3,1,0]=4 34 B18R2.7079 CC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000185465_100000702546 [0,0,0,0,0,0|1,1,0]=2 35 B18R2.7079 CC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000185465 [0,0,0,0,0,0|1,1,0]=2 36 B18R2.7079 CC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000185465_100000731791 [0,0,0,0,0,0|2,1,0]=3 37 B18R2.7079 CC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000185465 [0,0,0,0,0,0|2,1,0]=3 38 B18R2.7079 CC(=O)c1ccc(cn1)OCCc2cn[nH]c2 7a_100012001710_100000743252 [0,0,0,0,0,0|4,0,0]=4 39 B18R2.7079 CC(=O)c1ccc(cn1)OCCn2cccc2 7a_100012001710_200000035178 [0,0,0,0,0,0|3,0,0]=3 40 B18R2.7079 CC(=O)c1ccc(cn1)OCCn2cccn2 34a_100012001710_100015204718 [0,0,0,0,0,0|4,0,0]=4 41 B18R2.7079 CC(=O)c1ccc(cn1)OCCn2cccn2 7a_100012001710_100000685285 [0,0,0,0,0,0|4,0,0]=4 42 B18R2.7079 CC(=O)c1ccc(cn1)OCCn2ccnc2 7a_100012001710_100000702546 [0,0,0,0,0,0|2,0,0]=2 43 B18R2.7079 CC(=O)c1ccc(cn1)OCCn2cncn2 34a_100012001710_200000749826 [0,0,0,0,0,0|3,0,0]=3 44 B18R2.7079 CC(=O)c1ccc(cn1)OCCn2cncn2 7a_100012001710_100000731791 [0,0,0,0,0,0|3,0,0]=3 45 B18R2.7079 CC(=O)c1ccc(cn1)SCCn2cccc2 62a_100000686046_200000035178 [0,0,0,0,0,0|3,1,0]=4 46 B18R2.7079 CC(=O)c1ccc(cn1)SCCn2cccc2 62a_200009811947_100000686046 [0,0,0,0,0,0|3,1,0]=4 47 B18R2.7079 CC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100000686046_100000702546 [0,0,0,0,0,0|2,1,0]=3 48 B18R2.7079 CC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_100000686046 [0,0,0,0,0,0|2,1,0]=3 49 B18R2.7079 CC(=O)c1ccc(cn1)SCCn2cncn2 62a_100000686046_100000731791 [0,0,0,0,0,0|3,1,0]=4 50 B18R2.7079 CC(=O)c1ccc(cn1)SCCn2cncn2 62a_100000731791_100000686046 [0,0,0,0,0,0|3,1,0]=4 51 B18R2.7079 CC(=O)c1ccc(nc1)NCCn2cccc2 27a_100011368172_100000690552 [0,0,0,0,0,0|4,0,0]=4 52 B18R2.7079 CC(=O)c1ccc(nc1)NCCn2ccnc2 27a_100000230061_100000690552 [0,0,0,0,0,0|3,0,0]=3 53 B18R2.7079 CC(=O)c1ccc(nc1)NCCn2cncn2 27a_200000738561_100000690552 [0,0,0,0,0,0|4,0,0]=4 54 B18R2.7079 CC(=O)c1ccc(nc1)SCCn2cccc2 62a_100000684857_200000035178 [0,0,0,0,0,0|3,1,0]=4 55 B18R2.7079 CC(=O)c1ccc(nc1)SCCn2cccc2 62a_200009811947_100000684857 [0,0,0,0,0,0|3,1,0]=4 56 B18R2.7079 CC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000684857_100000702546 [0,0,0,0,0,0|2,1,0]=3 57 B18R2.7079 CC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000684857 [0,0,0,0,0,0|2,1,0]=3 58 B18R2.7079 CC(=O)c1ccc(nc1)SCCn2cncn2 62a_100000684857_100000731791 [0,0,0,0,0,0|3,1,0]=4 59 B18R2.7079 CC(=O)c1ccc(nc1)SCCn2cncn2 62a_100000731791_100000684857 [0,0,0,0,0,0|3,1,0]=4 60 B18R2.7079 CC(=O)c1cnc(cn1)NCCn2ccnc2 27a_100000230061_100009883172 [0,0,0,0,0,0|4,0,0]=4 61 B18R2.7079 CC(=O)c1cnc(cn1)SCCn2ccnc2 62a_100000702546_100009883172 [0,0,0,0,0,0|3,1,0]=4 62 B18R2.7079 CC(=O)c1cnc(cn1)SCCn2ccnc2 62a_100009883172_100000702546 [0,0,0,0,0,0|3,1,0]=4 63 B18R2.7079 CC(=O)c1cnc(nc1)NCCn2ccnc2 27a_100000230061_100000099681 [0,0,0,0,0,0|4,0,0]=4 64 B18R2.7079 CC(=O)c1cnc(nc1)SCCn2ccnc2 62a_100000099681_100000702546 [0,0,0,0,0,0|3,1,0]=4 65 B18R2.7079 CC(=O)c1cnc(nc1)SCCn2ccnc2 62a_100000702546_100000099681 [0,0,0,0,0,0|3,1,0]=4 66 B18R2.7079 CC(=O)c1ncc(cn1)SCCn2ccnc2 62a_100000702546_100010077182 [0,0,0,0,0,0|3,1,0]=4 67 B18R2.7079 CC(=O)c1ncc(cn1)SCCn2ccnc2 62a_100010077182_100000702546 [0,0,0,0,0,0|3,1,0]=4 68 B18R2.7079 CC(C)c1ccc(cc1)NCCn2ccnc2 7a_100000210773_100000702546 [0,0,0,0,0,0|3,0,1]=4 69 B18R2.7079 CC(C)c1ccc(cc1)OCCn2cccc2 7a_100000181308_200000035178 [0,0,0,0,0,0|3,0,1]=4 70 B18R2.7079 CC(C)c1ccc(cc1)OCCn2ccnc2 7a_100000181308_100000702546 [0,0,0,0,0,0|2,0,1]=3 71 B18R2.7079 CC(C)c1ccc(cc1)OCCn2cncn2 34a_100000181308_200000749826 [0,0,0,0,0,0|3,0,1]=4 72 B18R2.7079 CC(C)c1ccc(cc1)OCCn2cncn2 7a_100000181308_100000731791 [0,0,0,0,0,0|3,0,1]=4 73 B18R2.7079 CC(C)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000750031 [0,0,0,0,0,0|2,1,1]=4 74 B18R2.7079 CC(C)c1ccc(cc1)SCCn2ccnc2 62a_100000750031_100000702546 [0,0,0,0,0,0|2,1,1]=4 75 B18R2.7079 CC(O)c1ccc(cc1)NCCn2cccc2 2230a_100011216399_200009811947 [0,0,0,0,0,0|3,0,1]=4 76 B18R2.7079 CC(O)c1ccc(cc1)NCCn2cncn2 2230a_100011216399_100000731791 [0,0,0,0,0,0|3,0,1]=4 77 B18R2.7079 CC(O)c1ccc(cc1)NCCn2cncn2 34a_100011216399_200000749826 [0,0,0,0,0,0|3,0,1]=4 78 B18R2.7079 CC(O)c1ccc(cc1)OCCc2cn[nH]c2 7a_100000754508_100000743252 [0,0,0,0,0,0|3,0,1]=4 79 B18R2.7079 CC(O)c1ccc(cc1)OCCn2cccc2 7a_100000754508_200000035178 [0,0,0,0,0,0|2,0,1]=3 80 B18R2.7079 CC(O)c1ccc(cc1)OCCn2cccn2 34a_100000754508_100015204718 [0,0,0,0,0,0|3,0,1]=4 81 B18R2.7079 CC(O)c1ccc(cc1)OCCn2cccn2 7a_100000754508_100000685285 [0,0,0,0,0,0|3,0,1]=4 82 B18R2.7079 CC(O)c1ccc(cc1)OCCn2ccnc2 7a_100000754508_100000702546 [0,0,0,0,0,0|1,0,1]=2 83 B18R2.7079 CC(O)c1ccc(cc1)OCCn2cncn2 34a_100000754508_200000749826 [0,0,0,0,0,0|2,0,1]=3 84 B18R2.7079 CC(O)c1ccc(cc1)OCCn2cncn2 7a_100000754508_100000731791 [0,0,0,0,0,0|2,0,1]=3 85 B18R2.7079 CC(O)c1ccc(cc1)SCCn2cccc2 62a_100000745893_200000035178 [0,0,0,0,0,0|2,1,1]=4 86 B18R2.7079 CC(O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000745893 [0,0,0,0,0,0|2,1,1]=4 87 B18R2.7079 CC(O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000745893 [0,0,0,0,0,0|1,1,1]=3 88 B18R2.7079 CC(O)c1ccc(cc1)SCCn2ccnc2 62a_100000745893_100000702546 [0,0,0,0,0,0|1,1,1]=3 89 B18R2.7079 CC(O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000745893 [0,0,0,0,0,0|2,1,1]=4 90 B18R2.7079 CC(O)c1ccc(cc1)SCCn2cncn2 62a_100000745893_100000731791 [0,0,0,0,0,0|2,1,1]=4 91 B18R2.7079 CC(O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_100012353650 [0,0,0,0,0,0|2,1,1]=4 92 B18R2.7079 CC(O)c1ccc(cn1)SCCn2ccnc2 62a_100012353650_100000702546 [0,0,0,0,0,0|2,1,1]=4 93 B18R2.7079 CC(O)c1ccc(nc1)SCCn2ccnc2 62a_100000702546_200010274204 [0,0,0,0,0,0|2,1,1]=4 94 B18R2.7079 CC(O)c1ccc(nc1)SCCn2ccnc2 62a_200010274204_100000702546 [0,0,0,0,0,0|2,1,1]=4 95 B18R2.7079 CN(C)c1ccc(cc1)OCCn2cncn2 34a_100000718910_200000749826 [0,0,0,0,0,0|4,0,0]=4 96 B18R2.7079 CN(C)c1ccc(cc1)SCCn2ccnc2 62a_100000210421_100000702546 [0,0,0,0,0,0|3,1,0]=4 97 B18R2.7079 CN(C)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000210421 [0,0,0,0,0,0|3,1,0]=4 98 B18R2.7079 CS(=O)c1ccc(cc1)OCCc2cn[nH]c2 7a_200000064373_100000743252 [0,0,0,0,0,0|4,0,0]=4 99 B18R2.7079 CS(=O)c1ccc(cc1)OCCn2cccc2 7a_200000064373_200000035178 [0,0,0,0,0,0|3,0,0]=3 100 B18R2.7079 CS(=O)c1ccc(cc1)OCCn2cccn2 34a_200000064373_100015204718 [0,0,0,0,0,0|4,0,0]=4 101 B18R2.7079 CS(=O)c1ccc(cc1)OCCn2cccn2 7a_200000064373_100000685285 [0,0,0,0,0,0|4,0,0]=4 102 B18R2.7079 CS(=O)c1ccc(cc1)OCCn2ccnc2 7a_200000064373_100000702546 [0,0,0,0,0,0|2,0,0]=2 103 B18R2.7079 CS(=O)c1ccc(cc1)OCCn2cncn2 34a_200000064373_200000749826 [0,0,0,0,0,0|3,0,0]=3 104 B18R2.7079 CS(=O)c1ccc(cc1)OCCn2cncn2 7a_200000064373_100000731791 [0,0,0,0,0,0|3,0,0]=3 105 B18R2.7079 CS(=O)c1ccc(cc1)SCCn2cccc2 62a_100009816266_200000035178 [0,0,0,0,0,0|3,1,0]=4 106 B18R2.7079 CS(=O)c1ccc(cc1)SCCn2ccnc2 62a_100009816266_100000702546 [0,0,0,0,0,0|2,1,0]=3 107 B18R2.7079 CS(=O)c1ccc(cc1)SCCn2cncn2 62a_100009816266_100000731791 [0,0,0,0,0,0|3,1,0]=4 108 B18R2.7079 C[C@@H](N)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000720352 [0,0,0,0,0,0|2,1,1]=4 109 B18R2.7079 C[C@@H](N)c1ccc(cc1)SCCn2ccnc2 62a_100000720352_100000702546 [0,0,0,0,0,0|2,1,1]=4 110 B18R2.7079 C[C@H](N)c1ccc(cc1)OCCn2cncn2 34a_100161106496_200000749826 [0,0,0,0,0,0|3,0,1]=4 111 B18R2.7079 C[C@H](N)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000753911 [0,0,0,0,0,0|2,1,1]=4 112 B18R2.7079 C[C@H](N)c1ccc(cc1)SCCn2ccnc2 62a_100000753911_100000702546 [0,0,0,0,0,0|2,1,1]=4 113 B18R2.7079 C[S+](C)c1ccc(cc1)OCCn2cccc2 7a_100010188728_200000035178 [0,0,0,0,0,0|4,0,0]=4 114 B18R2.7079 C[S+](C)c1ccc(cc1)OCCn2ccnc2 7a_100010188728_100000702546 [0,0,0,0,0,0|3,0,0]=3 115 B18R2.7079 C[S+](C)c1ccc(cc1)OCCn2cncn2 34a_100010188728_200000749826 [0,0,0,0,0,0|4,0,0]=4 116 B18R2.7079 C[S+](C)c1ccc(cc1)OCCn2cncn2 7a_100010188728_100000731791 [0,0,0,0,0,0|4,0,0]=4 117 B18R2.7079 FC(F)c1ccc(cc1)NCCn2ccnc2 7a_100020620101_100000702546 [0,0,0,0,0,0|3,0,1]=4 118 B18R2.7079 FC(F)c1ccc(cc1)SCCn2ccnc2 62a_100000687661_100000702546 [0,0,0,0,0,0|2,1,1]=4 119 B18R2.7079 FC(F)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000687661 [0,0,0,0,0,0|2,1,1]=4 120 B18R2.7079 NC(=O)c1ccc(cc1)COCn2cncn2 34a_100000162016_200020645497 [0,0,0,0,0,0|4,0,0]=4 121 B18R2.7079 NC(=O)c1ccc(cc1)COCn2cncn2 7a_100000162016_200020645497 [0,0,0,0,0,0|4,0,0]=4 122 B18R2.7079 NC(=O)c1ccc(cc1)CSCn2cncn2 62a_100000231043_200020645497 [0,0,0,0,0,0|4,0,0]=4 123 B18R2.7079 NC(=O)c1ccc(cc1)CSCn2cncn2 62a_200020645497_100000231043 [0,0,0,0,0,0|4,0,0]=4 124 B18R2.7079 NC(=O)c1ccc(cc1)NCCc2ccsc2 27a_100000692642_100000162191 [0,0,0,0,0,0|4,0,0]=4 125 B18R2.7079 NC(=O)c1ccc(cc1)NCCc2cn[nH]c2 27a_100000732747_100000162191 [0,0,0,0,0,0|4,0,0]=4 126 B18R2.7079 NC(=O)c1ccc(cc1)NCCc2cncs2 27a_100016991637_100000162191 [0,0,0,0,0,0|4,0,0]=4 127 B18R2.7079 NC(=O)c1ccc(cc1)NCCn2cccc2 27a_100011368172_100000162191 [0,0,0,0,0,0|3,0,0]=3 128 B18R2.7079 NC(=O)c1ccc(cc1)NCCn2cccn2 27a_100011200920_100000162191 [0,0,0,0,0,0|4,0,0]=4 129 B18R2.7079 NC(=O)c1ccc(cc1)NCCn2cccn2 34a_100000210537_100015204718 [0,0,0,0,0,0|4,0,0]=4 130 B18R2.7079 NC(=O)c1ccc(cc1)NCCn2ccnc2 27a_100000230061_100000162191 [0,0,0,0,0,0|2,0,0]=2 131 B18R2.7079 NC(=O)c1ccc(cc1)NCCn2cncn2 27a_200000738561_100000162191 [0,0,0,0,0,0|3,0,0]=3 132 B18R2.7079 NC(=O)c1ccc(cc1)NCCn2cncn2 34a_100000210537_200000749826 [0,0,0,0,0,0|3,0,0]=3 133 B18R2.7079 NC(=O)c1ccc(cc1)OCCc2c[nH]cn2 7a_100000746352_100020628418 [0,0,0,0,0,0|3,0,1]=4 134 B18R2.7079 NC(=O)c1ccc(cc1)OCCc2cccs2 34a_100000746352_100000748579 [0,0,0,0,0,0|4,0,0]=4 135 B18R2.7079 NC(=O)c1ccc(cc1)OCCc2cccs2 7a_100000746352_100000748579 [0,0,0,0,0,0|4,0,0]=4 136 B18R2.7079 NC(=O)c1ccc(cc1)OCCc2cn[nH]c2 7a_100000746352_100000743252 [0,0,0,0,0,0|3,0,0]=3 137 B18R2.7079 NC(=O)c1ccc(cc1)OCCn2cccc2 7a_100000746352_200000035178 [0,0,0,0,0,0|2,0,0]=2 138 B18R2.7079 NC(=O)c1ccc(cc1)OCCn2cccn2 34a_100000746352_100015204718 [0,0,0,0,0,0|3,0,0]=3 139 B18R2.7079 NC(=O)c1ccc(cc1)OCCn2cccn2 7a_100000746352_100000685285 [0,0,0,0,0,0|3,0,0]=3 140 B18R2.7079 NC(=O)c1ccc(cc1)OCCn2ccnc2 7a_100000746352_100000702546 [0,0,0,0,0,0|1,0,0]=1 141 B18R2.7079 NC(=O)c1ccc(cc1)OCCn2cncn2 34a_100000746352_200000749826 [0,0,0,0,0,0|2,0,0]=2 142 B18R2.7079 NC(=O)c1ccc(cc1)OCCn2cncn2 7a_100000746352_100000731791 [0,0,0,0,0,0|2,0,0]=2 143 B18R2.7079 NC(=O)c1ccc(cc1)SCCc2cn[nH]c2 62a_100000162191_100000743252 [0,0,0,0,0,0|3,1,0]=4 144 B18R2.7079 NC(=O)c1ccc(cc1)SCCc2cn[nH]c2 62a_100000743252_100000162191 [0,0,0,0,0,0|3,1,0]=4 145 B18R2.7079 NC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000162191_200000035178 [0,0,0,0,0,0|2,1,0]=3 146 B18R2.7079 NC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000162191 [0,0,0,0,0,0|2,1,0]=3 147 B18R2.7079 NC(=O)c1ccc(cc1)SCCn2cccn2 62a_100000162191_100000685285 [0,0,0,0,0,0|3,1,0]=4 148 B18R2.7079 NC(=O)c1ccc(cc1)SCCn2cccn2 62a_100015204718_100000162191 [0,0,0,0,0,0|3,1,0]=4 149 B18R2.7079 NC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000162191_100000702546 [0,0,0,0,0,0|1,1,0]=2 150 B18R2.7079 NC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000162191 [0,0,0,0,0,0|1,1,0]=2 151 B18R2.7079 NC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000162191_100000731791 [0,0,0,0,0,0|2,1,0]=3 152 B18R2.7079 NC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000162191 [0,0,0,0,0,0|2,1,0]=3 153 B18R2.7079 NC(=O)c1ccc(cn1)SCCn2cccc2 62a_100011219284_200000035178 [0,0,0,0,0,0|3,1,0]=4 154 B18R2.7079 NC(=O)c1ccc(cn1)SCCn2cccc2 62a_200009811947_100011219284 [0,0,0,0,0,0|3,1,0]=4 155 B18R2.7079 NC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_100011219284 [0,0,0,0,0,0|2,1,0]=3 156 B18R2.7079 NC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100011219284_100000702546 [0,0,0,0,0,0|2,1,0]=3 157 B18R2.7079 NC(=O)c1ccc(cn1)SCCn2cncn2 62a_100000731791_100011219284 [0,0,0,0,0,0|3,1,0]=4 158 B18R2.7079 NC(=O)c1ccc(cn1)SCCn2cncn2 62a_100011219284_100000731791 [0,0,0,0,0,0|3,1,0]=4 159 B18R2.7079 NC(=O)c1ccc(nc1)NCCn2cccc2 27a_100011368172_100000162237 [0,0,0,0,0,0|4,0,0]=4 160 B18R2.7079 NC(=O)c1ccc(nc1)NCCn2ccnc2 27a_100000230061_100000162237 [0,0,0,0,0,0|3,0,0]=3 161 B18R2.7079 NC(=O)c1ccc(nc1)NCCn2cncn2 27a_200000738561_100000162237 [0,0,0,0,0,0|4,0,0]=4 162 B18R2.7079 NC(=O)c1ccc(nc1)SCCn2cccc2 62a_100000162237_200000035178 [0,0,0,0,0,0|3,1,0]=4 163 B18R2.7079 NC(=O)c1ccc(nc1)SCCn2cccc2 62a_200009811947_100000162237 [0,0,0,0,0,0|3,1,0]=4 164 B18R2.7079 NC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000162237_100000702546 [0,0,0,0,0,0|2,1,0]=3 165 B18R2.7079 NC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000162237 [0,0,0,0,0,0|2,1,0]=3 166 B18R2.7079 NC(=O)c1ccc(nc1)SCCn2cncn2 62a_100000162237_100000731791 [0,0,0,0,0,0|3,1,0]=4 167 B18R2.7079 NC(=O)c1ccc(nc1)SCCn2cncn2 62a_100000731791_100000162237 [0,0,0,0,0,0|3,1,0]=4 168 B18R2.7079 NC(=O)c1ccc(nn1)NCCn2ccnc2 27a_100000230061_100000761398 [0,0,0,0,0,0|4,0,0]=4 169 B18R2.7079 NC(=O)c1ccc(nn1)SCCn2ccnc2 62a_100000702546_100000761398 [0,0,0,0,0,0|3,1,0]=4 170 B18R2.7079 NC(=O)c1ccc(nn1)SCCn2ccnc2 62a_100000761398_100000702546 [0,0,0,0,0,0|3,1,0]=4 171 B18R2.7079 NC(=O)c1cnc(cn1)NCCn2ccnc2 27a_100000230061_100000738300 [0,0,0,0,0,0|4,0,0]=4 172 B18R2.7079 NC(=O)c1cnc(cn1)SCCn2ccnc2 62a_100000702546_100000738300 [0,0,0,0,0,0|3,1,0]=4 173 B18R2.7079 NC(=O)c1cnc(cn1)SCCn2ccnc2 62a_100000738300_100000702546 [0,0,0,0,0,0|3,1,0]=4 174 B18R2.7079 NC(=O)c1ncc(cn1)SCCn2ccnc2 62a_100000702546_100009996756 [0,0,0,0,0,0|3,1,0]=4 175 B18R2.7079 NC(=O)c1ncc(cn1)SCCn2ccnc2 62a_100009996756_100000702546 [0,0,0,0,0,0|3,1,0]=4 176 B18R2.7079 O=C(O)c1ccc(cc1)CNCc2ccn[nH]2 269956a_100000181780_100000728653 [0,0,0,0,0,0|4,0,0]=4 177 B18R2.7079 O=C(O)c1ccc(cc1)CNCc2ccsc2 269956a_100000181780_100011261437 [0,0,0,0,0,0|4,0,0]=4 178 B18R2.7079 O=C(O)c1ccc(cc1)CNCc2cncs2 269956a_100000181780_100015185245 [0,0,0,0,0,0|4,0,0]=4 179 B18R2.7079 O=C(O)c1ccc(cc1)CNCn2cncn2 269956a_100000181780_200020645497 [0,0,0,0,0,0|3,0,0]=3 180 B18R2.7079 O=C(O)c1ccc(cn1)CNCn2cncn2 269956a_100000762669_200020645497 [0,0,0,0,0,0|4,0,0]=4 181 B18R2.7079 O=[N+]([O-])c1ccc(cc1)NCCn2cccc2 2230a_100015195142_200009811947 [0,0,0,0,0,0|3,0,1]=4 182 B18R2.7079 O=[N+]([O-])c1ccc(cc1)NCCn2cncn2 2230a_100015195142_100000731791 [0,0,0,0,0,0|3,0,1]=4 183 B18R2.7079 O=[N+]([O-])c1ccc(cc1)NCCn2cncn2 34a_100015195142_200000749826 [0,0,0,0,0,0|3,0,1]=4 184 B18R2.7079 O=[N+]([O-])c1ccc(cc1)OCCc2cn[nH]c2 7a_100000185810_100000743252 [0,0,0,0,0,0|3,0,1]=4 185 B18R2.7079 O=[N+]([O-])c1ccc(cc1)OCCn2cccc2 7a_100000185810_200000035178 [0,0,0,0,0,0|2,0,1]=3 186 B18R2.7079 O=[N+]([O-])c1ccc(cc1)OCCn2cccn2 34a_100000185810_100015204718 [0,0,0,0,0,0|3,0,1]=4 187 B18R2.7079 O=[N+]([O-])c1ccc(cc1)OCCn2cccn2 7a_100000185810_100000685285 [0,0,0,0,0,0|3,0,1]=4 188 B18R2.7079 O=[N+]([O-])c1ccc(cc1)OCCn2ccnc2 7a_100000185810_100000702546 [0,0,0,0,0,0|1,0,1]=2 189 B18R2.7079 O=[N+]([O-])c1ccc(cc1)OCCn2cncn2 34a_100000185810_200000749826 [0,0,0,0,0,0|2,0,1]=3 190 B18R2.7079 O=[N+]([O-])c1ccc(cc1)OCCn2cncn2 7a_100000185810_100000731791 [0,0,0,0,0,0|2,0,1]=3 191 B18R2.7079 O=[N+]([O-])c1ccc(cn1)OCCn2cccc2 7a_100000060138_200000035178 [0,0,0,0,0,0|3,0,1]=4 192 B18R2.7079 O=[N+]([O-])c1ccc(cn1)OCCn2ccnc2 7a_100000060138_100000702546 [0,0,0,0,0,0|2,0,1]=3 193 B18R2.7079 O=[N+]([O-])c1ccc(cn1)OCCn2cncn2 7a_100000060138_100000731791 [0,0,0,0,0,0|3,0,1]=4 194 B18R2.7079 OB(O)c1ccc(cc1)SCCn2cccc2 62a_100000754493_200000035178 [0,0,0,0,0,0|2,1,1]=4 195 B18R2.7079 OB(O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000754493 [0,0,0,0,0,0|2,1,1]=4 196 B18R2.7079 OB(O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000754493 [0,0,0,0,0,0|1,1,1]=3 197 B18R2.7079 OB(O)c1ccc(cc1)SCCn2ccnc2 62a_100000754493_100000702546 [0,0,0,0,0,0|1,1,1]=3 198 B18R2.7079 OB(O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000754493 [0,0,0,0,0,0|2,1,1]=4 199 B18R2.7079 OB(O)c1ccc(cc1)SCCn2cncn2 62a_100000754493_100000731791 [0,0,0,0,0,0|2,1,1]=4 200 B18R2.7079 OB(O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_200010198023 [0,0,0,0,0,0|2,1,1]=4 201 B18R2.7079 OB(O)c1ccc(cn1)SCCn2ccnc2 62a_200010198023_100000702546 [0,0,0,0,0,0|2,1,1]=4 202 B18R2.7079 OB(O)c1ccc(nc1)SCCn2ccnc2 62a_100000688115_100000702546 [0,0,0,0,0,0|2,1,1]=4 203 B18R2.7079 OB(O)c1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000688115 [0,0,0,0,0,0|2,1,1]=4 204 B17R2.53 C=Cc1ccc(cc1)NCCn2cncn2 34a_100011218248_200000749826 [1,0,0,0,0,0|3,0,0]=4 205 B17R2.53 C=Cc1ccc(cc1)OCCc2cn[nH]c2 7a_100000189437_100000743252 [1,0,0,0,0,0|3,0,0]=4 206 B17R2.53 C=Cc1ccc(cc1)OCCn2cccc2 7a_100000189437_200000035178 [1,0,0,0,0,0|2,0,0]=3 207 B17R2.53 C=Cc1ccc(cc1)OCCn2cccn2 271570a_100011290941_200011487139 [1,0,0,0,0,0|3,0,0]=4 208 B17R2.53 C=Cc1ccc(cc1)OCCn2cccn2 34a_100000189437_100015204718 [1,0,0,0,0,0|3,0,0]=4 209 B17R2.53 C=Cc1ccc(cc1)OCCn2cccn2 7a_100000189437_100000685285 [1,0,0,0,0,0|3,0,0]=4 210 B17R2.53 C=Cc1ccc(cc1)OCCn2ccnc2 271570a_100011290941_100015186965 [1,0,0,0,0,0|1,0,0]=2 211 B17R2.53 C=Cc1ccc(cc1)OCCn2ccnc2 7a_100000189437_100000702546 [1,0,0,0,0,0|1,0,0]=2 212 B17R2.53 C=Cc1ccc(cc1)OCCn2cncn2 34a_100000189437_200000749826 [1,0,0,0,0,0|2,0,0]=3 213 B17R2.53 C=Cc1ccc(cc1)OCCn2cncn2 7a_100000189437_100000731791 [1,0,0,0,0,0|2,0,0]=3 214 B17R2.53 C=Cc1ccc(cc1)SCCn2cccc2 62a_100000748128_200000035178 [1,0,0,0,0,0|2,1,0]=4 215 B17R2.53 C=Cc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000748128 [1,0,0,0,0,0|2,1,0]=4 216 B17R2.53 C=Cc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000748128 [1,0,0,0,0,0|1,1,0]=3 217 B17R2.53 C=Cc1ccc(cc1)SCCn2ccnc2 62a_100000748128_100000702546 [1,0,0,0,0,0|1,1,0]=3 218 B17R2.53 C=Cc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000748128 [1,0,0,0,0,0|2,1,0]=4 219 B17R2.53 C=Cc1ccc(cc1)SCCn2cncn2 62a_100000748128_100000731791 [1,0,0,0,0,0|2,1,0]=4 220 B17R2.53 C=Cc1ccc(nc1)SCCn2ccnc2 62a_100000702546_103436540071 [1,0,0,0,0,0|2,1,0]=4 221 B17R2.53 C=Cc1ccc(nc1)SCCn2ccnc2 62a_103436540071_100000702546 [1,0,0,0,0,0|2,1,0]=4 222 B17R2.53 CCc1ccc(cc1)OCCn2cccc2 7a_100000211359_200000035178 [1,0,0,0,0,0|2,0,1]=4 223 B17R2.53 CCc1ccc(cc1)OCCn2ccnc2 7a_100000211359_100000702546 [1,0,0,0,0,0|1,0,1]=3 224 B17R2.53 CCc1ccc(cc1)OCCn2cncn2 34a_100000211359_200000749826 [1,0,0,0,0,0|2,0,1]=4 225 B17R2.53 CCc1ccc(cc1)OCCn2cncn2 7a_100000211359_100000731791 [1,0,0,0,0,0|2,0,1]=4 226 B17R2.53 CCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100011215824 [1,0,0,0,0,0|1,1,1]=4 227 B17R2.53 CCc1ccc(cc1)SCCn2ccnc2 62a_100011215824_100000702546 [1,0,0,0,0,0|1,1,1]=4 228 B17R2.53 CNc1ccc(cc1)OCCn2cncn2 34a_100000182112_200000749826 [1,0,0,0,0,0|3,0,0]=4 229 B17R2.53 CNc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000743151 [1,0,0,0,0,0|2,1,0]=4 230 B17R2.53 CNc1ccc(cc1)SCCn2ccnc2 62a_100000743151_100000702546 [1,0,0,0,0,0|2,1,0]=4 231 B17R2.53 COc1ccc(cc1)OCCn2cncn2 34a_100000210503_200000749826 [1,0,0,0,0,0|3,0,0]=4 232 B17R2.53 COc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000171711 [1,0,0,0,0,0|2,1,0]=4 233 B17R2.53 CSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_200000210301 [1,0,0,0,0,0|2,0,0]=3 234 B17R2.53 CSc1ccc(cc1)OCCn2ccnc2 62a_200000210301_100015186965 [1,0,0,0,0,0|2,0,0]=3 235 B17R2.53 CSc1ccc(cc1)OCCn2cncn2 34a_100000211864_200000749826 [1,0,0,0,0,0|3,0,0]=4 236 B17R2.53 CSc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100011263217 [1,0,0,0,0,0|2,1,0]=4 237 B17R2.53 CSc1ccc(cc1)SCCn2ccnc2 62a_100011263217_100000702546 [1,0,0,0,0,0|2,1,0]=4 238 B17R2.53 FCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100010268989 [1,0,0,0,0,0|1,1,1]=4 239 B17R2.53 FCc1ccc(cc1)SCCn2ccnc2 62a_100010268989_100000702546 [1,0,0,0,0,0|1,1,1]=4 240 B17R2.53 N#Cc1ccc(cc1)OCCn2cccc2 7a_100000210344_200000035178 [1,0,0,0,0,0|2,0,1]=4 241 B17R2.53 N#Cc1ccc(cc1)OCCn2ccnc2 7a_100000210344_100000702546 [1,0,0,0,0,0|1,0,1]=3 242 B17R2.53 N#Cc1ccc(cc1)OCCn2cncn2 34a_100000210344_200000749826 [1,0,0,0,0,0|2,0,1]=4 243 B17R2.53 N#Cc1ccc(cc1)OCCn2cncn2 7a_100000210344_100000731791 [1,0,0,0,0,0|2,0,1]=4 244 B17R2.53 N#Cc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000184291 [1,0,0,0,0,0|1,1,1]=4 245 B17R2.53 N#Cc1ccc(cn1)OCCn2ccnc2 7a_100011934750_100000702546 [1,0,0,0,0,0|2,0,1]=4 246 B17R2.53 NCc1ccc(cc1)OCCn2cncn2 34a_100000185549_200000749826 [1,0,0,0,0,0|2,0,1]=4 247 B17R2.53 NCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100016989417 [1,0,0,0,0,0|1,1,1]=4 248 B17R2.53 NCc1ccc(cc1)SCCn2ccnc2 62a_100016989417_100000702546 [1,0,0,0,0,0|1,1,1]=4 249 B17R2.53 NNc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100016988836 [1,0,0,0,0,0|2,1,0]=4 250 B17R2.53 NNc1ccc(cc1)SCCn2ccnc2 62a_100016988836_100000702546 [1,0,0,0,0,0|2,1,0]=4 251 B17R2.53 O=Cc1ccc(cc1)CSCn2cncn2 62a_100009816848_200020645497 [1,0,0,0,0,0|3,0,0]=4 252 B17R2.53 O=Cc1ccc(cc1)CSCn2cncn2 62a_200020645497_100009816848 [1,0,0,0,0,0|3,0,0]=4 253 B17R2.53 O=Cc1ccc(cc1)OCCN2CC=CC2 269982a_100015195280_100000040479 [1,0,0,0,0,0|1,0,2]=4 254 B17R2.53 O=Cc1ccc(cc1)SCCc2cn[nH]c2 62a_100000188517_100000743252 [1,0,0,0,0,0|2,1,0]=4 255 B17R2.53 O=Cc1ccc(cc1)SCCc2cn[nH]c2 62a_100000743252_100000188517 [1,0,0,0,0,0|2,1,0]=4 256 B17R2.53 O=Cc1ccc(cc1)SCCn2cccc2 62a_100000188517_200000035178 [1,0,0,0,0,0|1,1,0]=3 257 B17R2.53 O=Cc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000188517 [1,0,0,0,0,0|1,1,0]=3 258 B17R2.53 O=Cc1ccc(cc1)SCCn2cccn2 62a_100000188517_100000685285 [1,0,0,0,0,0|2,1,0]=4 259 B17R2.53 O=Cc1ccc(cc1)SCCn2cccn2 62a_100015204718_100000188517 [1,0,0,0,0,0|2,1,0]=4 260 B17R2.53 O=Cc1ccc(cc1)SCCn2ccnc2 62a_100000188517_100000702546 [1,0,0,0,0,0|0,1,0]=2 261 B17R2.53 O=Cc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000188517 [1,0,0,0,0,0|0,1,0]=2 262 B17R2.53 O=Cc1ccc(cc1)SCCn2cncn2 62a_100000188517_100000731791 [1,0,0,0,0,0|1,1,0]=3 263 B17R2.53 O=Cc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000188517 [1,0,0,0,0,0|1,1,0]=3 264 B17R2.53 O=Cc1ccc(cn1)SCCn2cccc2 62a_100000754260_200000035178 [1,0,0,0,0,0|2,1,0]=4 265 B17R2.53 O=Cc1ccc(cn1)SCCn2cccc2 62a_200009811947_100000754260 [1,0,0,0,0,0|2,1,0]=4 266 B17R2.53 O=Cc1ccc(cn1)SCCn2ccnc2 62a_100000702546_100000754260 [1,0,0,0,0,0|1,1,0]=3 267 B17R2.53 O=Cc1ccc(cn1)SCCn2ccnc2 62a_100000754260_100000702546 [1,0,0,0,0,0|1,1,0]=3 268 B17R2.53 O=Cc1ccc(cn1)SCCn2cncn2 62a_100000731791_100000754260 [1,0,0,0,0,0|2,1,0]=4 269 B17R2.53 O=Cc1ccc(cn1)SCCn2cncn2 62a_100000754260_100000731791 [1,0,0,0,0,0|2,1,0]=4 270 B17R2.53 O=Cc1ccc(nc1)SCCn2cccc2 62a_100000766901_200000035178 [1,0,0,0,0,0|2,1,0]=4 271 B17R2.53 O=Cc1ccc(nc1)SCCn2cccc2 62a_200009811947_100000766901 [1,0,0,0,0,0|2,1,0]=4 272 B17R2.53 O=Cc1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000766901 [1,0,0,0,0,0|1,1,0]=3 273 B17R2.53 O=Cc1ccc(nc1)SCCn2ccnc2 62a_100000766901_100000702546 [1,0,0,0,0,0|1,1,0]=3 274 B17R2.53 O=Cc1ccc(nc1)SCCn2cncn2 62a_100000731791_100000766901 [1,0,0,0,0,0|2,1,0]=4 275 B17R2.53 O=Cc1ccc(nc1)SCCn2cncn2 62a_100000766901_100000731791 [1,0,0,0,0,0|2,1,0]=4 276 B17R2.53 O=Cc1ccc(nn1)SCCn2ccnc2 62a_100000044651_100000702546 [1,0,0,0,0,0|2,1,0]=4 277 B17R2.53 O=Cc1ccc(nn1)SCCn2ccnc2 62a_100000702546_100000044651 [1,0,0,0,0,0|2,1,0]=4 278 B17R2.53 O=Cc1cnc(cn1)NCCn2ccnc2 27a_100000230061_100012001714 [1,0,0,0,0,0|3,0,0]=4 279 B17R2.53 O=Cc1cnc(cn1)SCCn2ccnc2 62a_100000702546_100012001714 [1,0,0,0,0,0|2,1,0]=4 280 B17R2.53 O=Cc1cnc(cn1)SCCn2ccnc2 62a_100012001714_100000702546 [1,0,0,0,0,0|2,1,0]=4 281 B17R2.53 O=Cc1cnc(nc1)NCCn2ccnc2 27a_100000230061_100000070856 [1,0,0,0,0,0|3,0,0]=4 282 B17R2.53 O=Cc1cnc(nc1)SCCn2ccnc2 62a_100000070856_100000702546 [1,0,0,0,0,0|2,1,0]=4 283 B17R2.53 O=Cc1cnc(nc1)SCCn2ccnc2 62a_100000702546_100000070856 [1,0,0,0,0,0|2,1,0]=4 284 B17R2.53 OCc1ccc(cc1)NCCn2cccc2 2230a_100011215238_200009811947 [1,0,0,0,0,0|2,0,1]=4 285 B17R2.53 OCc1ccc(cc1)NCCn2cncn2 2230a_100011215238_100000731791 [1,0,0,0,0,0|2,0,1]=4 286 B17R2.53 OCc1ccc(cc1)NCCn2cncn2 34a_100011215238_200000749826 [1,0,0,0,0,0|2,0,1]=4 287 B17R2.53 OCc1ccc(cc1)OCCn2cccn2 34a_100000211755_100015204718 [1,0,0,0,0,0|2,0,1]=4 288 B17R2.53 OCc1ccc(cc1)OCCn2cncn2 34a_100000211755_200000749826 [1,0,0,0,0,0|1,0,1]=3 289 B17R2.53 OCc1ccc(cc1)SCCn2cccc2 62a_100000690907_200000035178 [1,0,0,0,0,0|1,1,1]=4 290 B17R2.53 OCc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000690907 [1,0,0,0,0,0|1,1,1]=4 291 B17R2.53 OCc1ccc(cc1)SCCn2ccnc2 62a_100000690907_100000702546 [1,0,0,0,0,0|0,1,1]=3 292 B17R2.53 OCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000690907 [1,0,0,0,0,0|0,1,1]=3 293 B17R2.53 OCc1ccc(cc1)SCCn2cncn2 62a_100000690907_100000731791 [1,0,0,0,0,0|1,1,1]=4 294 B17R2.53 OCc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000690907 [1,0,0,0,0,0|1,1,1]=4 295 B17R2.53 OCc1ccc(cn1)OCCn2cncn2 34a_103436540053_200000749826 [1,0,0,0,0,0|2,0,1]=4 296 B17R2.53 OCc1ccc(cn1)SCCn2ccnc2 62a_100000702546_100000754261 [1,0,0,0,0,0|1,1,1]=4 297 B17R2.53 OCc1ccc(cn1)SCCn2ccnc2 62a_100000754261_100000702546 [1,0,0,0,0,0|1,1,1]=4 298 B17R2.53 OCc1ccc(nc1)SCCn2ccnc2 62a_100000702546_100009816760 [1,0,0,0,0,0|1,1,1]=4 299 B17R2.53 OCc1ccc(nc1)SCCn2ccnc2 62a_100009816760_100000702546 [1,0,0,0,0,0|1,1,1]=4 300 B17R2.53 [13CH3]Sc1ccc(cc1)OCCn2ccnc2 62a_100015186965_200025704644 [1,0,0,0,0,0|2,0,0]=3 301 B17R2.53 [13CH3]Sc1ccc(cc1)OCCn2ccnc2 62a_200025704644_100015186965 [1,0,0,0,0,0|2,0,0]=3 302 B19R2.8739 C=C(C)c1ccc(cc1)OCC(C)n2cncn2 34a_100009880102_200015185000 [0,1,0,0,0,0|3,0,0]=4 303 B19R2.8739 C=C(C)c1ccc(cc1)OCC(C)n2cncn2 7a_100009880102_200015185000 [0,1,0,0,0,0|3,0,0]=4 304 B19R2.8739 CC(=O)c1ccc(cc1)OCC(C)n2cncn2 34a_100000185113_200015185000 [0,1,0,0,0,0|2,0,0]=3 305 B19R2.8739 CC(=O)c1ccc(cc1)OCC(C)n2cncn2 7a_100000185113_200015185000 [0,1,0,0,0,0|2,0,0]=3 306 B19R2.8739 CC(=O)c1ccc(cc1)SCC(C)n2cncn2 62a_100000185465_200015185000 [0,1,0,0,0,0|2,1,0]=4 307 B19R2.8739 CC(=O)c1ccc(cc1)SCC(C)n2cncn2 62a_200015185000_100000185465 [0,1,0,0,0,0|2,1,0]=4 308 B19R2.8739 CC(=O)c1ccc(cn1)OCC(C)n2cncn2 34a_100012001710_200015185000 [0,1,0,0,0,0|3,0,0]=4 309 B19R2.8739 CC(=O)c1ccc(cn1)OCC(C)n2cncn2 7a_100012001710_200015185000 [0,1,0,0,0,0|3,0,0]=4 310 B19R2.8739 CC(CNc1ccc(cc1)C(=O)N)n2cncn2 34a_100000210537_200015185000 [0,1,0,0,0,0|3,0,0]=4 311 B19R2.8739 CC(COc1ccc(cc1)C(=O)N)n2cncn2 34a_100000746352_200015185000 [0,1,0,0,0,0|2,0,0]=3 312 B19R2.8739 CC(COc1ccc(cc1)C(=O)N)n2cncn2 7a_100000746352_200015185000 [0,1,0,0,0,0|2,0,0]=3 313 B19R2.8739 CC(COc1ccc(cc1)S(=O)C)n2cncn2 34a_200000064373_200015185000 [0,1,0,0,0,0|3,0,0]=4 314 B19R2.8739 CC(COc1ccc(cc1)S(=O)C)n2cncn2 7a_200000064373_200015185000 [0,1,0,0,0,0|3,0,0]=4 315 B19R2.8739 CC(COc1ccc(cc1)[N+](=O)[O-])n2cncn2 34a_100000185810_200015185000 [0,1,0,0,0,0|2,0,1]=4 316 B19R2.8739 CC(COc1ccc(cc1)[N+](=O)[O-])n2cncn2 7a_100000185810_200015185000 [0,1,0,0,0,0|2,0,1]=4 317 B19R2.8739 CC(CSc1ccc(cc1)C(=O)N)n2cncn2 62a_100000162191_200015185000 [0,1,0,0,0,0|2,1,0]=4 318 B19R2.8739 CC(CSc1ccc(cc1)C(=O)N)n2cncn2 62a_200015185000_100000162191 [0,1,0,0,0,0|2,1,0]=4 319 B19R2.8739 CC(O)c1ccc(cc1)OCC(C)n2cncn2 34a_100000754508_200015185000 [0,1,0,0,0,0|2,0,1]=4 320 B19R2.8739 CC(O)c1ccc(cc1)OCC(C)n2cncn2 7a_100000754508_200015185000 [0,1,0,0,0,0|2,0,1]=4 321 B19R2.8744 CC(=O)c1ccc(cc1)CC(=O)Cn2ccnc2 1458a_100000739072_100000756337 [0,1,0,0,0,0|2,0,1]=4 322 B19R2.8744 CC(Cn1cncn1)Nc2ccc(cc2)C(=O)N 27a_100011201177_100000162191 [0,1,0,0,0,0|3,0,0]=4 323 B19R2.8744 NC(=O)c1ccc(cc1)CC(=O)Cn2ccnc2 1458a_100000739072_100000231043 [0,1,0,0,0,0|2,0,1]=4 324 B19R2.8744 NC(=O)c1ccc(cc1)NC(=O)Cn2ccnc2 11a_100000210537_100000739072 [0,1,0,0,0,0|2,0,1]=4 325 B19R2.8744 NC(=O)c1ccc(cc1)NC(=O)Cn2ccnc2 1626a_100000210537_100000739072 [0,1,0,0,0,0|2,0,1]=4 326 B19R2.8744 NC(=O)c1ccc(cc1)NC(=O)Cn2ccnc2 22a_100000210537_100000739072 [0,1,0,0,0,0|2,0,1]=4 327 B19R2.8746 C=C(C)c1ccc(cc1)C(=O)CCn2ccnc2 1458a_200009908186_100000702546 [0,1,0,0,0,0|3,0,0]=4 328 B19R2.8746 CC(O)c1ccc(cc1)C(=O)CCn2ccnc2 1458a_100000076921_100000702546 [0,1,0,0,0,0|2,0,1]=4 329 B19R2.8746 CN(CCn1ccnc1)c2ccc(cc2)[N+](=O)[O-] 269982a_100000156523_100000702546 [0,1,0,0,0,0|2,0,1]=4 330 B19R2.8746 CS(=O)c1ccc(cc1)C(=O)CCn2ccnc2 1458a_200000217594_100000702546 [0,1,0,0,0,0|3,0,0]=4 331 B19R2.8746 C[C@H](NCn1cncn1)c2ccc(cc2)C(=O)O 269956a_100020638929_200020645497 [0,1,0,0,0,0|3,0,0]=4 332 B19R2.8746 NC(=O)c1ccc(cc1)C(=O)CCn2cccc2 1458a_100000230133_200000035178 [0,1,0,0,0,0|3,0,0]=4 333 B19R2.8746 NC(=O)c1ccc(cc1)C(=O)CCn2ccnc2 1458a_100000230133_100000702546 [0,1,0,0,0,0|2,0,0]=3 334 B19R2.8746 NC(=O)c1ccc(cc1)C(=O)CCn2cncn2 1458a_100000230133_100000731791 [0,1,0,0,0,0|3,0,0]=4 335 B19R2.8746 O=C(CCn1ccnc1)c2ccc(cc2)[N+](=O)[O-] 1458a_100000185811_100000702546 [0,1,0,0,0,0|2,0,1]=4 336 B19R2.12562 CC(=NO)c1ccc(cc1)OCCn2cccn2 34a_100000164205_100015204718 [0,1,0,0,0,0|3,0,0]=4 337 B19R2.12562 CC(=NO)c1ccc(cc1)OCCn2cncn2 34a_100000164205_200000749826 [0,1,0,0,0,0|2,0,0]=3 338 B19R2.12562 CCC(=O)c1ccc(cc1)OCCc2cn[nH]c2 7a_100000212119_100000743252 [0,1,0,0,0,0|3,0,0]=4 339 B19R2.12562 CCC(=O)c1ccc(cc1)OCCn2cccc2 7a_100000212119_200000035178 [0,1,0,0,0,0|2,0,0]=3 340 B19R2.12562 CCC(=O)c1ccc(cc1)OCCn2cccn2 34a_100000212119_100015204718 [0,1,0,0,0,0|3,0,0]=4 341 B19R2.12562 CCC(=O)c1ccc(cc1)OCCn2cccn2 7a_100000212119_100000685285 [0,1,0,0,0,0|3,0,0]=4 342 B19R2.12562 CCC(=O)c1ccc(cc1)OCCn2ccnc2 7a_100000212119_100000702546 [0,1,0,0,0,0|1,0,0]=2 343 B19R2.12562 CCC(=O)c1ccc(cc1)OCCn2cncn2 34a_100000212119_200000749826 [0,1,0,0,0,0|2,0,0]=3 344 B19R2.12562 CCC(=O)c1ccc(cc1)OCCn2cncn2 7a_100000212119_100000731791 [0,1,0,0,0,0|2,0,0]=3 345 B19R2.12562 CCC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000211647_200000035178 [0,1,0,0,0,0|2,1,0]=4 346 B19R2.12562 CCC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000211647 [0,1,0,0,0,0|2,1,0]=4 347 B19R2.12562 CCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000211647_100000702546 [0,1,0,0,0,0|1,1,0]=3 348 B19R2.12562 CCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000211647 [0,1,0,0,0,0|1,1,0]=3 349 B19R2.12562 CCC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000211647_100000731791 [0,1,0,0,0,0|2,1,0]=4 350 B19R2.12562 CCC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000211647 [0,1,0,0,0,0|2,1,0]=4 351 B19R2.12562 CCC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_100012351654 [0,1,0,0,0,0|2,1,0]=4 352 B19R2.12562 CCC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100012351654_100000702546 [0,1,0,0,0,0|2,1,0]=4 353 B19R2.12562 CCC(C)c1ccc(cc1)OCCn2ccnc2 7a_100000211540_100000702546 [0,1,0,0,0,0|2,0,1]=4 354 B19R2.12562 CCC(O)c1ccc(cc1)SCCn2ccnc2 62a_100000246506_100000702546 [0,1,0,0,0,0|1,1,1]=4 355 B19R2.12562 CCC(O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000246506 [0,1,0,0,0,0|1,1,1]=4 356 B19R2.12562 CNC(=O)c1ccc(cc1)NCCn2cccc2 2230a_100000184841_200009811947 [0,1,0,0,0,0|3,0,0]=4 357 B19R2.12562 CNC(=O)c1ccc(cc1)NCCn2cccc2 27a_100011368172_100000155074 [0,1,0,0,0,0|3,0,0]=4 358 B19R2.12562 CNC(=O)c1ccc(cc1)NCCn2ccnc2 27a_100000230061_100000155074 [0,1,0,0,0,0|2,0,0]=3 359 B19R2.12562 CNC(=O)c1ccc(cc1)NCCn2cncn2 2230a_100000184841_100000731791 [0,1,0,0,0,0|3,0,0]=4 360 B19R2.12562 CNC(=O)c1ccc(cc1)NCCn2cncn2 27a_200000738561_100000155074 [0,1,0,0,0,0|3,0,0]=4 361 B19R2.12562 CNC(=O)c1ccc(cc1)NCCn2cncn2 34a_100000184841_200000749826 [0,1,0,0,0,0|3,0,0]=4 362 B19R2.12562 CNC(=O)c1ccc(cc1)OCCc2cn[nH]c2 7a_100000192141_100000743252 [0,1,0,0,0,0|3,0,0]=4 363 B19R2.12562 CNC(=O)c1ccc(cc1)OCCn2cccc2 7a_100000192141_200000035178 [0,1,0,0,0,0|2,0,0]=3 364 B19R2.12562 CNC(=O)c1ccc(cc1)OCCn2cccn2 34a_100000192141_100015204718 [0,1,0,0,0,0|3,0,0]=4 365 B19R2.12562 CNC(=O)c1ccc(cc1)OCCn2cccn2 7a_100000192141_100000685285 [0,1,0,0,0,0|3,0,0]=4 366 B19R2.12562 CNC(=O)c1ccc(cc1)OCCn2ccnc2 7a_100000192141_100000702546 [0,1,0,0,0,0|1,0,0]=2 367 B19R2.12562 CNC(=O)c1ccc(cc1)OCCn2cncn2 34a_100000192141_200000749826 [0,1,0,0,0,0|2,0,0]=3 368 B19R2.12562 CNC(=O)c1ccc(cc1)OCCn2cncn2 7a_100000192141_100000731791 [0,1,0,0,0,0|2,0,0]=3 369 B19R2.12562 CNC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000155074_200000035178 [0,1,0,0,0,0|2,1,0]=4 370 B19R2.12562 CNC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000155074 [0,1,0,0,0,0|2,1,0]=4 371 B19R2.12562 CNC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000155074_100000702546 [0,1,0,0,0,0|1,1,0]=3 372 B19R2.12562 CNC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000155074 [0,1,0,0,0,0|1,1,0]=3 373 B19R2.12562 CNC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000155074_100000731791 [0,1,0,0,0,0|2,1,0]=4 374 B19R2.12562 CNC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000155074 [0,1,0,0,0,0|2,1,0]=4 375 B19R2.12562 CNC(=O)c1ccc(cn1)NCCn2ccnc2 27a_100000230061_100011781262 [0,1,0,0,0,0|3,0,0]=4 376 B19R2.12562 CNC(=O)c1ccc(cn1)OCCn2cccc2 7a_100009861314_200000035178 [0,1,0,0,0,0|3,0,0]=4 377 B19R2.12562 CNC(=O)c1ccc(cn1)OCCn2ccnc2 7a_100009861314_100000702546 [0,1,0,0,0,0|2,0,0]=3 378 B19R2.12562 CNC(=O)c1ccc(cn1)OCCn2cncn2 34a_100009861314_200000749826 [0,1,0,0,0,0|3,0,0]=4 379 B19R2.12562 CNC(=O)c1ccc(cn1)OCCn2cncn2 7a_100009861314_100000731791 [0,1,0,0,0,0|3,0,0]=4 380 B19R2.12562 CNC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_100011781262 [0,1,0,0,0,0|2,1,0]=4 381 B19R2.12562 CNC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100011781262_100000702546 [0,1,0,0,0,0|2,1,0]=4 382 B19R2.12562 CNC(=O)c1ccc(nc1)NCCn2ccnc2 27a_100000230061_100000159860 [0,1,0,0,0,0|3,0,0]=4 383 B19R2.12562 CNC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000159860_100000702546 [0,1,0,0,0,0|2,1,0]=4 384 B19R2.12562 CNC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000159860 [0,1,0,0,0,0|2,1,0]=4 385 B19R2.12562 COC(=O)c1ccc(cc1)COCn2cncn2 34a_100000151488_200020645497 [0,1,0,0,0,0|3,0,0]=4 386 B19R2.12562 COC(=O)c1ccc(cc1)COCn2cncn2 7a_100000151488_200020645497 [0,1,0,0,0,0|3,0,0]=4 387 B19R2.12562 COC(=O)c1ccc(cc1)CSCn2cncn2 62a_100000735637_200020645497 [0,1,0,0,0,0|3,0,0]=4 388 B19R2.12562 COC(=O)c1ccc(cc1)CSCn2cncn2 62a_200020645497_100000187170 [0,1,0,0,0,0|3,0,0]=4 389 B19R2.12562 COC(=O)c1ccc(cc1)OCCN2CC=CC2 269982a_100015195280_100000742590 [0,1,0,0,0,0|1,0,2]=4 390 B19R2.12562 COC(=O)c1ccc(cc1)OCCc2c[nH]cn2 7a_100000150123_100020628418 [0,1,0,0,0,0|2,0,1]=4 391 B19R2.12562 COC(=O)c1ccc(cc1)OCCc2cccs2 34a_100000150123_100000748579 [0,1,0,0,0,0|3,0,0]=4 392 B19R2.12562 COC(=O)c1ccc(cc1)OCCc2cccs2 7a_100000150123_100000748579 [0,1,0,0,0,0|3,0,0]=4 393 B19R2.12562 COC(=O)c1ccc(cc1)OCCc2cn[nH]c2 7a_100000150123_100000743252 [0,1,0,0,0,0|2,0,0]=3 394 B19R2.12562 COC(=O)c1ccc(cc1)OCCn2cccc2 7a_100000150123_200000035178 [0,1,0,0,0,0|1,0,0]=2 395 B19R2.12562 COC(=O)c1ccc(cc1)OCCn2cccn2 34a_100000150123_100015204718 [0,1,0,0,0,0|2,0,0]=3 396 B19R2.12562 COC(=O)c1ccc(cc1)OCCn2cccn2 7a_100000150123_100000685285 [0,1,0,0,0,0|2,0,0]=3 397 B19R2.12562 COC(=O)c1ccc(cc1)OCCn2ccnc2 7a_100000150123_100000702546 [0,1,0,0,0,0|0,0,0]=1 398 B19R2.12562 COC(=O)c1ccc(cc1)OCCn2cncn2 34a_100000150123_200000749826 [0,1,0,0,0,0|1,0,0]=2 399 B19R2.12562 COC(=O)c1ccc(cc1)OCCn2cncn2 7a_100000150123_100000731791 [0,1,0,0,0,0|1,0,0]=2 400 B19R2.12562 COC(=O)c1ccc(cc1)SCCc2cn[nH]c2 62a_100000150774_100000743252 [0,1,0,0,0,0|2,1,0]=4 401 B19R2.12562 COC(=O)c1ccc(cc1)SCCc2cn[nH]c2 62a_100000743252_100000150774 [0,1,0,0,0,0|2,1,0]=4 402 B19R2.12562 COC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000150774_200000035178 [0,1,0,0,0,0|1,1,0]=3 403 B19R2.12562 COC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000150774 [0,1,0,0,0,0|1,1,0]=3 404 B19R2.12562 COC(=O)c1ccc(cc1)SCCn2cccn2 62a_100000150774_100000685285 [0,1,0,0,0,0|2,1,0]=4 405 B19R2.12562 COC(=O)c1ccc(cc1)SCCn2cccn2 62a_100015204718_100000150774 [0,1,0,0,0,0|2,1,0]=4 406 B19R2.12562 COC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000150774_100000702546 [0,1,0,0,0,0|0,1,0]=2 407 B19R2.12562 COC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000150774 [0,1,0,0,0,0|0,1,0]=2 408 B19R2.12562 COC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000150774_100000731791 [0,1,0,0,0,0|1,1,0]=3 409 B19R2.12562 COC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000150774 [0,1,0,0,0,0|1,1,0]=3 410 B19R2.12562 COC(=O)c1ccc(cn1)OCCc2cn[nH]c2 7a_100011997255_100000743252 [0,1,0,0,0,0|3,0,0]=4 411 B19R2.12562 COC(=O)c1ccc(cn1)OCCn2cccc2 7a_100011997255_200000035178 [0,1,0,0,0,0|2,0,0]=3 412 B19R2.12562 COC(=O)c1ccc(cn1)OCCn2cccn2 34a_100011997255_100015204718 [0,1,0,0,0,0|3,0,0]=4 413 B19R2.12562 COC(=O)c1ccc(cn1)OCCn2cccn2 7a_100011997255_100000685285 [0,1,0,0,0,0|3,0,0]=4 414 B19R2.12562 COC(=O)c1ccc(cn1)OCCn2ccnc2 7a_100011997255_100000702546 [0,1,0,0,0,0|1,0,0]=2 415 B19R2.12562 COC(=O)c1ccc(cn1)OCCn2cncn2 34a_100011997255_200000749826 [0,1,0,0,0,0|2,0,0]=3 416 B19R2.12562 COC(=O)c1ccc(cn1)OCCn2cncn2 7a_100011997255_100000731791 [0,1,0,0,0,0|2,0,0]=3 417 B19R2.12562 COC(=O)c1ccc(cn1)SCCn2cccc2 62a_100102712061_200000035178 [0,1,0,0,0,0|2,1,0]=4 418 B19R2.12562 COC(=O)c1ccc(cn1)SCCn2cccc2 62a_200009811947_100102712061 [0,1,0,0,0,0|2,1,0]=4 419 B19R2.12562 COC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_100102712061 [0,1,0,0,0,0|1,1,0]=3 420 B19R2.12562 COC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100102712061_100000702546 [0,1,0,0,0,0|1,1,0]=3 421 B19R2.12562 COC(=O)c1ccc(cn1)SCCn2cncn2 62a_100000731791_100102712061 [0,1,0,0,0,0|2,1,0]=4 422 B19R2.12562 COC(=O)c1ccc(cn1)SCCn2cncn2 62a_100102712061_100000731791 [0,1,0,0,0,0|2,1,0]=4 423 B19R2.12562 COC(=O)c1ccc(nc1)NCCn2cccc2 27a_100011368172_100000733799 [0,1,0,0,0,0|3,0,0]=4 424 B19R2.12562 COC(=O)c1ccc(nc1)NCCn2ccnc2 27a_100000230061_100000733799 [0,1,0,0,0,0|2,0,0]=3 425 B19R2.12562 COC(=O)c1ccc(nc1)NCCn2cncn2 27a_200000738561_100000733799 [0,1,0,0,0,0|3,0,0]=4 426 B19R2.12562 COC(=O)c1ccc(nc1)SCCn2cccc2 62a_100000733799_200000035178 [0,1,0,0,0,0|2,1,0]=4 427 B19R2.12562 COC(=O)c1ccc(nc1)SCCn2cccc2 62a_200009811947_100000733799 [0,1,0,0,0,0|2,1,0]=4 428 B19R2.12562 COC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000733799 [0,1,0,0,0,0|1,1,0]=3 429 B19R2.12562 COC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000733799_100000702546 [0,1,0,0,0,0|1,1,0]=3 430 B19R2.12562 COC(=O)c1ccc(nc1)SCCn2cncn2 62a_100000731791_100000733799 [0,1,0,0,0,0|2,1,0]=4 431 B19R2.12562 COC(=O)c1ccc(nc1)SCCn2cncn2 62a_100000733799_100000731791 [0,1,0,0,0,0|2,1,0]=4 432 B19R2.12562 COC(=O)c1ccc(nn1)NCCn2ccnc2 27a_100000230061_100000738951 [0,1,0,0,0,0|3,0,0]=4 433 B19R2.12562 COC(=O)c1ccc(nn1)SCCn2ccnc2 62a_100000702546_100000738951 [0,1,0,0,0,0|2,1,0]=4 434 B19R2.12562 COC(=O)c1ccc(nn1)SCCn2ccnc2 62a_100000738951_100000702546 [0,1,0,0,0,0|2,1,0]=4 435 B19R2.12562 COC(=O)c1cnc(cn1)NCCn2ccnc2 27a_100000230061_100010219404 [0,1,0,0,0,0|3,0,0]=4 436 B19R2.12562 COC(=O)c1cnc(cn1)SCCn2ccnc2 62a_100000702546_100010219404 [0,1,0,0,0,0|2,1,0]=4 437 B19R2.12562 COC(=O)c1cnc(cn1)SCCn2ccnc2 62a_100010219404_100000702546 [0,1,0,0,0,0|2,1,0]=4 438 B19R2.12562 COC(=O)c1cnc(nc1)NCCn2ccnc2 27a_100000230061_100000729365 [0,1,0,0,0,0|3,0,0]=4 439 B19R2.12562 COC(=O)c1cnc(nc1)SCCn2ccnc2 62a_100000702546_100000729365 [0,1,0,0,0,0|2,1,0]=4 440 B19R2.12562 COC(=O)c1cnc(nc1)SCCn2ccnc2 62a_100000729365_100000702546 [0,1,0,0,0,0|2,1,0]=4 441 B19R2.12562 COC(=O)c1ncc(cn1)SCCn2ccnc2 62a_100000690087_100000702546 [0,1,0,0,0,0|2,1,0]=4 442 B19R2.12562 COC(=O)c1ncc(cn1)SCCn2ccnc2 62a_100000702546_100000690087 [0,1,0,0,0,0|2,1,0]=4 443 B19R2.12562 COC(C)c1ccc(cc1)OCCn2cccc2 7a_200010658654_200000035178 [0,1,0,0,0,0|2,0,1]=4 444 B19R2.12562 COC(C)c1ccc(cc1)OCCn2ccnc2 7a_200010658654_100000702546 [0,1,0,0,0,0|1,0,1]=3 445 B19R2.12562 COC(C)c1ccc(cc1)OCCn2cncn2 34a_200010658654_200000749826 [0,1,0,0,0,0|2,0,1]=4 446 B19R2.12562 COC(C)c1ccc(cc1)OCCn2cncn2 7a_200010658654_100000731791 [0,1,0,0,0,0|2,0,1]=4 447 B19R2.12562 COC(C)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100010254937 [0,1,0,0,0,0|1,1,1]=4 448 B19R2.12562 COC(C)c1ccc(cc1)SCCn2ccnc2 62a_100010254937_100000702546 [0,1,0,0,0,0|1,1,1]=4 449 B19R2.12562 N#CC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100009994572 [0,1,0,0,0,0|2,1,0]=4 450 B19R2.12562 N#CC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100009994572 [0,1,0,0,0,0|1,1,0]=3 451 B19R2.12562 N#CC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100009994572 [0,1,0,0,0,0|2,1,0]=4 452 B19R2.12562 NC(=NO)c1ccc(cc1)OCCn2cccn2 34a_100000231063_100015204718 [0,1,0,0,0,0|3,0,0]=4 453 B19R2.12562 NC(=NO)c1ccc(cc1)OCCn2cncn2 34a_100000231063_200000749826 [0,1,0,0,0,0|2,0,0]=3 454 B19R2.12562 NC(CO)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000734186 [0,1,0,0,0,0|1,1,1]=4 455 B19R2.12562 NC(CO)c1ccc(cc1)SCCn2ccnc2 62a_100000734186_100000702546 [0,1,0,0,0,0|1,1,1]=4 456 B19R2.12562 NCC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000017248_200000035178 [0,1,0,0,0,0|2,1,0]=4 457 B19R2.12562 NCC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000017248 [0,1,0,0,0,0|2,1,0]=4 458 B19R2.12562 NCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000017248_100000702546 [0,1,0,0,0,0|1,1,0]=3 459 B19R2.12562 NCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000017248 [0,1,0,0,0,0|1,1,0]=3 460 B19R2.12562 NCC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000017248_100000731791 [0,1,0,0,0,0|2,1,0]=4 461 B19R2.12562 NCC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000017248 [0,1,0,0,0,0|2,1,0]=4 462 B19R2.12562 NCC(O)c1ccc(cc1)OCCn2cncn2 34a_100000067596_200000749826 [0,1,0,0,0,0|2,0,1]=4 463 B19R2.12562 NCC(O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100020626992 [0,1,0,0,0,0|1,1,1]=4 464 B19R2.12562 NCC(O)c1ccc(cc1)SCCn2ccnc2 62a_100020626992_100000702546 [0,1,0,0,0,0|1,1,1]=4 465 B19R2.12562 NNC(=O)c1ccc(cc1)NCCn2cccc2 27a_100011368172_100000183614 [0,1,0,0,0,0|3,0,0]=4 466 B19R2.12562 NNC(=O)c1ccc(cc1)NCCn2ccnc2 27a_100000230061_100000183614 [0,1,0,0,0,0|2,0,0]=3 467 B19R2.12562 NNC(=O)c1ccc(cc1)NCCn2cncn2 27a_200000738561_100000183614 [0,1,0,0,0,0|3,0,0]=4 468 B19R2.12562 NNC(=O)c1ccc(cc1)OCCn2cccn2 34a_100000185078_100015204718 [0,1,0,0,0,0|3,0,0]=4 469 B19R2.12562 NNC(=O)c1ccc(cc1)OCCn2cncn2 34a_100000185078_200000749826 [0,1,0,0,0,0|2,0,0]=3 470 B19R2.12562 NNC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000183614_200000035178 [0,1,0,0,0,0|2,1,0]=4 471 B19R2.12562 NNC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000183614 [0,1,0,0,0,0|2,1,0]=4 472 B19R2.12562 NNC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000183614_100000702546 [0,1,0,0,0,0|1,1,0]=3 473 B19R2.12562 NNC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000183614 [0,1,0,0,0,0|1,1,0]=3 474 B19R2.12562 NNC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000183614_100000731791 [0,1,0,0,0,0|2,1,0]=4 475 B19R2.12562 NNC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000183614 [0,1,0,0,0,0|2,1,0]=4 476 B19R2.12562 NNC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_100011781063 [0,1,0,0,0,0|2,1,0]=4 477 B19R2.12562 NNC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100011781063_100000702546 [0,1,0,0,0,0|2,1,0]=4 478 B19R2.12562 NNC(=O)c1ccc(nc1)NCCn2ccnc2 27a_100000230061_100000189807 [0,1,0,0,0,0|3,0,0]=4 479 B19R2.12562 NNC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000189807_100000702546 [0,1,0,0,0,0|2,1,0]=4 480 B19R2.12562 NNC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000189807 [0,1,0,0,0,0|2,1,0]=4 481 B19R2.12562 O=C(CBr)c1ccc(cc1)OCCc2cn[nH]c2 7a_100009814261_100000743252 [0,1,0,0,0,0|3,0,0]=4 482 B19R2.12562 O=C(CBr)c1ccc(cc1)OCCn2cccc2 7a_100009814261_200000035178 [0,1,0,0,0,0|2,0,0]=3 483 B19R2.12562 O=C(CBr)c1ccc(cc1)OCCn2cccn2 7a_100009814261_100000685285 [0,1,0,0,0,0|3,0,0]=4 484 B19R2.12562 O=C(CBr)c1ccc(cc1)OCCn2ccnc2 7a_100009814261_100000702546 [0,1,0,0,0,0|1,0,0]=2 485 B19R2.12562 O=C(CBr)c1ccc(cc1)OCCn2cncn2 7a_100009814261_100000731791 [0,1,0,0,0,0|2,0,0]=3 486 B19R2.12562 O=C(CCl)c1ccc(cc1)OCCc2cn[nH]c2 7a_100000018856_100000743252 [0,1,0,0,0,0|3,0,0]=4 487 B19R2.12562 O=C(CCl)c1ccc(cc1)OCCn2cccc2 7a_100000018856_200000035178 [0,1,0,0,0,0|2,0,0]=3 488 B19R2.12562 O=C(CCl)c1ccc(cc1)OCCn2cccn2 7a_100000018856_100000685285 [0,1,0,0,0,0|3,0,0]=4 489 B19R2.12562 O=C(CCl)c1ccc(cc1)OCCn2ccnc2 7a_100000018856_100000702546 [0,1,0,0,0,0|1,0,0]=2 490 B19R2.12562 O=C(CCl)c1ccc(cc1)OCCn2cncn2 7a_100000018856_100000731791 [0,1,0,0,0,0|2,0,0]=3 491 B19R2.12562 O=C(CF)c1ccc(cc1)OCCc2cn[nH]c2 7a_200010654591_100000743252 [0,1,0,0,0,0|3,0,0]=4 492 B19R2.12562 O=C(CF)c1ccc(cc1)OCCn2cccc2 7a_200010654591_200000035178 [0,1,0,0,0,0|2,0,0]=3 493 B19R2.12562 O=C(CF)c1ccc(cc1)OCCn2cccn2 34a_200010654591_100015204718 [0,1,0,0,0,0|3,0,0]=4 494 B19R2.12562 O=C(CF)c1ccc(cc1)OCCn2cccn2 7a_200010654591_100000685285 [0,1,0,0,0,0|3,0,0]=4 495 B19R2.12562 O=C(CF)c1ccc(cc1)OCCn2ccnc2 7a_200010654591_100000702546 [0,1,0,0,0,0|1,0,0]=2 496 B19R2.12562 O=C(CF)c1ccc(cc1)OCCn2cncn2 34a_200010654591_200000749826 [0,1,0,0,0,0|2,0,0]=3 497 B19R2.12562 O=C(CF)c1ccc(cc1)OCCn2cncn2 7a_200010654591_100000731791 [0,1,0,0,0,0|2,0,0]=3 498 B19R2.12562 O=C(CO)c1ccc(cc1)SCCc2cn[nH]c2 62a_100000743252_100011219529 [0,1,0,0,0,0|2,1,0]=4 499 B19R2.12562 O=C(CO)c1ccc(cc1)SCCc2cn[nH]c2 62a_100011219529_100000743252 [0,1,0,0,0,0|2,1,0]=4 500 B19R2.12562 O=C(CO)c1ccc(cc1)SCCn2cccc2 62a_100011219529_200000035178 [0,1,0,0,0,0|1,1,0]=3 501 B19R2.12562 O=C(CO)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100011219529 [0,1,0,0,0,0|1,1,0]=3 502 B19R2.12562 O=C(CO)c1ccc(cc1)SCCn2cccn2 62a_100011219529_100000685285 [0,1,0,0,0,0|2,1,0]=4 503 B19R2.12562 O=C(CO)c1ccc(cc1)SCCn2cccn2 62a_100015204718_100011219529 [0,1,0,0,0,0|2,1,0]=4 504 B19R2.12562 O=C(CO)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100011219529 [0,1,0,0,0,0|0,1,0]=2 505 B19R2.12562 O=C(CO)c1ccc(cc1)SCCn2ccnc2 62a_100011219529_100000702546 [0,1,0,0,0,0|0,1,0]=2 506 B19R2.12562 O=C(CO)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100011219529 [0,1,0,0,0,0|1,1,0]=3 507 B19R2.12562 O=C(CO)c1ccc(cc1)SCCn2cncn2 62a_100011219529_100000731791 [0,1,0,0,0,0|1,1,0]=3 508 B19R2.12562 O=CC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000725942_200000035178 [0,1,0,0,0,0|1,1,1]=4 509 B19R2.12562 O=CC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000725942 [0,1,0,0,0,0|1,1,1]=4 510 B19R2.12562 O=CC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000725942 [0,1,0,0,0,0|0,1,1]=3 511 B19R2.12562 O=CC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000725942_100000702546 [0,1,0,0,0,0|0,1,1]=3 512 B19R2.12562 O=CC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000725942_100000731791 [0,1,0,0,0,0|1,1,1]=4 513 B19R2.12562 O=CC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000725942 [0,1,0,0,0,0|1,1,1]=4 514 B19R2.12562 OCC(O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_200012355997 [0,1,0,0,0,0|0,1,2]=4 515 B19R2.12562 OCC(O)c1ccc(cc1)SCCn2ccnc2 62a_200012355997_100000702546 [0,1,0,0,0,0|0,1,2]=4 516 B19R2.20584 CC(C)(C)c1ccc(cc1)OCCn2ccnc2 7a_100000185729_100000702546 [0,1,0,0,0,0|2,0,1]=4 517 B19R2.20584 CC(C)(O)c1ccc(cc1)OCCn2cccc2 7a_100000695648_200000035178 [0,1,0,0,0,0|2,0,1]=4 518 B19R2.20584 CC(C)(O)c1ccc(cc1)OCCn2ccnc2 7a_100000695648_100000702546 [0,1,0,0,0,0|1,0,1]=3 519 B19R2.20584 CC(C)(O)c1ccc(cc1)OCCn2cncn2 34a_100000695648_200000749826 [0,1,0,0,0,0|2,0,1]=4 520 B19R2.20584 CC(C)(O)c1ccc(cc1)OCCn2cncn2 7a_100000695648_100000731791 [0,1,0,0,0,0|2,0,1]=4 521 B19R2.20584 CC(C)(O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000753367 [0,1,0,0,0,0|1,1,1]=4 522 B19R2.20584 CC(C)(O)c1ccc(cc1)SCCn2ccnc2 62a_100000753367_100000702546 [0,1,0,0,0,0|1,1,1]=4 523 B19R2.20584 CS(=O)(=O)c1ccc(cc1)NCCn2ccnc2 7a_100000195502_100000702546 [0,1,0,0,0,0|2,0,1]=4 524 B19R2.20584 CS(=O)(=O)c1ccc(cc1)OCCn2cccc2 7a_100000230201_200000035178 [0,1,0,0,0,0|2,0,1]=4 525 B19R2.20584 CS(=O)(=O)c1ccc(cc1)OCCn2ccnc2 7a_100000230201_100000702546 [0,1,0,0,0,0|1,0,1]=3 526 B19R2.20584 CS(=O)(=O)c1ccc(cc1)OCCn2cncn2 34a_100000230201_200000749826 [0,1,0,0,0,0|2,0,1]=4 527 B19R2.20584 CS(=O)(=O)c1ccc(cc1)OCCn2cncn2 7a_100000230201_100000731791 [0,1,0,0,0,0|2,0,1]=4 528 B19R2.20584 CS(=O)(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000765142 [0,1,0,0,0,0|1,1,1]=4 529 B19R2.20584 CS(=O)(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000765142_100000702546 [0,1,0,0,0,0|1,1,1]=4 530 B19R2.20584 FC(F)(F)c1ccc(cc1)OCCn2ccnc2 7a_100000181324_100000702546 [0,1,0,0,0,0|2,0,1]=4 531 B19R2.20584 NS(=O)(=O)c1ccc(cc1)OCCn2cccc2 7a_100000738502_200000035178 [0,1,0,0,0,0|2,0,1]=4 532 B19R2.20584 NS(=O)(=O)c1ccc(cc1)OCCn2ccnc2 7a_100000738502_100000702546 [0,1,0,0,0,0|1,0,1]=3 533 B19R2.20584 NS(=O)(=O)c1ccc(cc1)OCCn2cncn2 34a_100000738502_200000749826 [0,1,0,0,0,0|2,0,1]=4 534 B19R2.20584 NS(=O)(=O)c1ccc(cc1)OCCn2cncn2 7a_100000738502_100000731791 [0,1,0,0,0,0|2,0,1]=4 535 B19R2.20584 NS(=O)(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000701559_100000702546 [0,1,0,0,0,0|1,1,1]=4 536 B19R2.20584 NS(=O)(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000164505 [0,1,0,0,0,0|1,1,1]=4 537 B19R2.20584 O=S(=O)([O-])c1ccc(cc1)OCCn2cccc2 7a_100000698548_200000035178 [0,1,0,0,0,0|2,0,1]=4 538 B19R2.20584 O=S(=O)([O-])c1ccc(cc1)OCCn2ccnc2 7a_100000698548_100000702546 [0,1,0,0,0,0|1,0,1]=3 539 B19R2.20584 O=S(=O)([O-])c1ccc(cc1)OCCn2cncn2 7a_100000698548_100000731791 [0,1,0,0,0,0|2,0,1]=4 540 B19R2.44319 CC(=O)c1cc(c(cn1)SCCn2ccnc2)C 62a_100000702546_100011011822 [0,1,0,0,0,0|2,1,0]=4 541 B19R2.44319 CC(=O)c1cc(c(cn1)SCCn2ccnc2)C 62a_100011011822_100000702546 [0,1,0,0,0,0|2,1,0]=4 542 B19R2.44319 CC(=O)c1ccc(c(c1)Br)OCCc2cn[nH]c2 7a_100011772453_100000743252 [0,1,0,0,0,0|3,0,0]=4 543 B19R2.44319 CC(=O)c1ccc(c(c1)Br)OCCn2cccc2 7a_100011772453_200000035178 [0,1,0,0,0,0|2,0,0]=3 544 B19R2.44319 CC(=O)c1ccc(c(c1)Br)OCCn2cccn2 34a_100011772453_100015204718 [0,1,0,0,0,0|3,0,0]=4 545 B19R2.44319 CC(=O)c1ccc(c(c1)Br)OCCn2cccn2 7a_100011772453_100000685285 [0,1,0,0,0,0|3,0,0]=4 546 B19R2.44319 CC(=O)c1ccc(c(c1)Br)OCCn2ccnc2 7a_100011772453_100000702546 [0,1,0,0,0,0|1,0,0]=2 547 B19R2.44319 CC(=O)c1ccc(c(c1)Br)OCCn2cncn2 34a_100011772453_200000749826 [0,1,0,0,0,0|2,0,0]=3 548 B19R2.44319 CC(=O)c1ccc(c(c1)Br)OCCn2cncn2 7a_100011772453_100000731791 [0,1,0,0,0,0|2,0,0]=3 549 B19R2.44319 CC(=O)c1ccc(c(c1)Br)SCCn2cccc2 62a_100010146554_200000035178 [0,1,0,0,0,0|2,1,0]=4 550 B19R2.44319 CC(=O)c1ccc(c(c1)Br)SCCn2cccc2 62a_200009811947_100010146554 [0,1,0,0,0,0|2,1,0]=4 551 B19R2.44319 CC(=O)c1ccc(c(c1)Br)SCCn2ccnc2 62a_100000702546_100010146554 [0,1,0,0,0,0|1,1,0]=3 552 B19R2.44319 CC(=O)c1ccc(c(c1)Br)SCCn2ccnc2 62a_100010146554_100000702546 [0,1,0,0,0,0|1,1,0]=3 553 B19R2.44319 CC(=O)c1ccc(c(c1)Br)SCCn2cncn2 62a_100000731791_100010146554 [0,1,0,0,0,0|2,1,0]=4 554 B19R2.44319 CC(=O)c1ccc(c(c1)Br)SCCn2cncn2 62a_100010146554_100000731791 [0,1,0,0,0,0|2,1,0]=4 555 B19R2.44319 CC(=O)c1ccc(c(c1)C)OCCc2cn[nH]c2 7a_100000188726_100000743252 [0,1,0,0,0,0|3,0,0]=4 556 B19R2.44319 CC(=O)c1ccc(c(c1)C)OCCn2cccc2 7a_100000188726_200000035178 [0,1,0,0,0,0|2,0,0]=3 557 B19R2.44319 CC(=O)c1ccc(c(c1)C)OCCn2cccn2 34a_100000188726_100015204718 [0,1,0,0,0,0|3,0,0]=4 558 B19R2.44319 CC(=O)c1ccc(c(c1)C)OCCn2cccn2 7a_100000188726_100000685285 [0,1,0,0,0,0|3,0,0]=4 559 B19R2.44319 CC(=O)c1ccc(c(c1)C)OCCn2ccnc2 7a_100000188726_100000702546 [0,1,0,0,0,0|1,0,0]=2 560 B19R2.44319 CC(=O)c1ccc(c(c1)C)OCCn2cncn2 34a_100000188726_200000749826 [0,1,0,0,0,0|2,0,0]=3 561 B19R2.44319 CC(=O)c1ccc(c(c1)C)OCCn2cncn2 7a_100000188726_100000731791 [0,1,0,0,0,0|2,0,0]=3 562 B19R2.44319 CC(=O)c1ccc(c(c1)C)SCCn2cccc2 62a_100000697869_200000035178 [0,1,0,0,0,0|2,1,0]=4 563 B19R2.44319 CC(=O)c1ccc(c(c1)C)SCCn2cccc2 62a_200009811947_100000697869 [0,1,0,0,0,0|2,1,0]=4 564 B19R2.44319 CC(=O)c1ccc(c(c1)C)SCCn2ccnc2 62a_100000697869_100000702546 [0,1,0,0,0,0|1,1,0]=3 565 B19R2.44319 CC(=O)c1ccc(c(c1)C)SCCn2ccnc2 62a_100000702546_100000697869 [0,1,0,0,0,0|1,1,0]=3 566 B19R2.44319 CC(=O)c1ccc(c(c1)C)SCCn2cncn2 62a_100000697869_100000731791 [0,1,0,0,0,0|2,1,0]=4 567 B19R2.44319 CC(=O)c1ccc(c(c1)C)SCCn2cncn2 62a_100000731791_100000697869 [0,1,0,0,0,0|2,1,0]=4 568 B19R2.44319 CC(=O)c1ccc(c(c1)Cl)OCCc2cn[nH]c2 7a_100000188625_100000743252 [0,1,0,0,0,0|3,0,0]=4 569 B19R2.44319 CC(=O)c1ccc(c(c1)Cl)OCCn2cccc2 7a_100000188625_200000035178 [0,1,0,0,0,0|2,0,0]=3 570 B19R2.44319 CC(=O)c1ccc(c(c1)Cl)OCCn2cccn2 34a_100000188625_100015204718 [0,1,0,0,0,0|3,0,0]=4 571 B19R2.44319 CC(=O)c1ccc(c(c1)Cl)OCCn2cccn2 7a_100000188625_100000685285 [0,1,0,0,0,0|3,0,0]=4 572 B19R2.44319 CC(=O)c1ccc(c(c1)Cl)OCCn2ccnc2 7a_100000188625_100000702546 [0,1,0,0,0,0|1,0,0]=2 573 B19R2.44319 CC(=O)c1ccc(c(c1)Cl)OCCn2cncn2 34a_100000188625_200000749826 [0,1,0,0,0,0|2,0,0]=3 574 B19R2.44319 CC(=O)c1ccc(c(c1)Cl)OCCn2cncn2 7a_100000188625_100000731791 [0,1,0,0,0,0|2,0,0]=3 575 B19R2.44319 CC(=O)c1ccc(c(c1)F)OCCc2cn[nH]c2 7a_100000751691_100000743252 [0,1,0,0,0,0|3,0,0]=4 576 B19R2.44319 CC(=O)c1ccc(c(c1)F)OCCn2cccc2 7a_100000751691_200000035178 [0,1,0,0,0,0|2,0,0]=3 577 B19R2.44319 CC(=O)c1ccc(c(c1)F)OCCn2cccn2 34a_100000751691_100015204718 [0,1,0,0,0,0|3,0,0]=4 578 B19R2.44319 CC(=O)c1ccc(c(c1)F)OCCn2cccn2 7a_100000751691_100000685285 [0,1,0,0,0,0|3,0,0]=4 579 B19R2.44319 CC(=O)c1ccc(c(c1)F)OCCn2ccnc2 7a_100000751691_100000702546 [0,1,0,0,0,0|1,0,0]=2 580 B19R2.44319 CC(=O)c1ccc(c(c1)F)OCCn2cncn2 34a_100000751691_200000749826 [0,1,0,0,0,0|2,0,0]=3 581 B19R2.44319 CC(=O)c1ccc(c(c1)F)OCCn2cncn2 7a_100000751691_100000731791 [0,1,0,0,0,0|2,0,0]=3 582 B19R2.44319 CC(=O)c1ccc(c(c1)F)SCCn2cccc2 62a_100000690002_200000035178 [0,1,0,0,0,0|2,1,0]=4 583 B19R2.44319 CC(=O)c1ccc(c(c1)F)SCCn2cccc2 62a_200009811947_100000690002 [0,1,0,0,0,0|2,1,0]=4 584 B19R2.44319 CC(=O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100000690002_100000702546 [0,1,0,0,0,0|1,1,0]=3 585 B19R2.44319 CC(=O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100000702546_100000690002 [0,1,0,0,0,0|1,1,0]=3 586 B19R2.44319 CC(=O)c1ccc(c(c1)F)SCCn2cncn2 62a_100000690002_100000731791 [0,1,0,0,0,0|2,1,0]=4 587 B19R2.44319 CC(=O)c1ccc(c(c1)F)SCCn2cncn2 62a_100000731791_100000690002 [0,1,0,0,0,0|2,1,0]=4 588 B19R2.44319 CC(=O)c1ccc(c(c1)N)OCCc2cn[nH]c2 7a_100000117292_100000743252 [0,1,0,0,0,0|3,0,0]=4 589 B19R2.44319 CC(=O)c1ccc(c(c1)N)OCCn2cccc2 7a_100000117292_200000035178 [0,1,0,0,0,0|2,0,0]=3 590 B19R2.44319 CC(=O)c1ccc(c(c1)N)OCCn2cccn2 34a_100000117292_100015204718 [0,1,0,0,0,0|3,0,0]=4 591 B19R2.44319 CC(=O)c1ccc(c(c1)N)OCCn2cccn2 7a_100000117292_100000685285 [0,1,0,0,0,0|3,0,0]=4 592 B19R2.44319 CC(=O)c1ccc(c(c1)N)OCCn2ccnc2 7a_100000117292_100000702546 [0,1,0,0,0,0|1,0,0]=2 593 B19R2.44319 CC(=O)c1ccc(c(c1)N)OCCn2cncn2 34a_100000117292_200000749826 [0,1,0,0,0,0|2,0,0]=3 594 B19R2.44319 CC(=O)c1ccc(c(c1)N)OCCn2cncn2 7a_100000117292_100000731791 [0,1,0,0,0,0|2,0,0]=3 595 B19R2.44319 CC(=O)c1ccc(c(c1)N)SCCn2cccc2 62a_100009816534_200000035178 [0,1,0,0,0,0|2,1,0]=4 596 B19R2.44319 CC(=O)c1ccc(c(c1)N)SCCn2ccnc2 62a_100009816534_100000702546 [0,1,0,0,0,0|1,1,0]=3 597 B19R2.44319 CC(=O)c1ccc(c(c1)N)SCCn2cncn2 62a_100009816534_100000731791 [0,1,0,0,0,0|2,1,0]=4 598 B19R2.44319 CC(=O)c1cnc(c(c1)C)NCCn2ccnc2 27a_100000230061_100009864263 [0,1,0,0,0,0|3,0,0]=4 599 B19R2.44319 CC(=O)c1cnc(c(c1)C)SCCn2ccnc2 62a_100000702546_100009864263 [0,1,0,0,0,0|2,1,0]=4 600 B19R2.44319 CC(=O)c1cnc(c(c1)C)SCCn2ccnc2 62a_100009864263_100000702546 [0,1,0,0,0,0|2,1,0]=4 601 B19R2.44319 CC(C)c1ccc(c(c1)Cl)OCCn2ccnc2 7a_100012182850_100000702546 [0,1,0,0,0,0|2,0,1]=4 602 B19R2.44319 CC(C)c1ccc(c(c1)N)OCCn2ccnc2 7a_200000187366_100000702546 [0,1,0,0,0,0|2,0,1]=4 603 B19R2.44319 Cc1cc(ccc1NCCn2cccc2)C(=O)N 27a_100011368172_100011218126 [0,1,0,0,0,0|3,0,0]=4 604 B19R2.44319 Cc1cc(ccc1NCCn2cccc2)C(=O)N 7a_100000746439_200000035178 [0,1,0,0,0,0|3,0,0]=4 605 B19R2.44319 Cc1cc(ccc1NCCn2ccnc2)C(=O)N 27a_100000230061_100011218126 [0,1,0,0,0,0|2,0,0]=3 606 B19R2.44319 Cc1cc(ccc1NCCn2ccnc2)C(=O)N 7a_100000746439_100000702546 [0,1,0,0,0,0|2,0,0]=3 607 B19R2.44319 Cc1cc(ccc1NCCn2ccnc2)[N+](=O)[O-] 7a_100000184110_100000702546 [0,1,0,0,0,0|2,0,1]=4 608 B19R2.44319 Cc1cc(ccc1NCCn2cncn2)C(=O)N 27a_200000738561_100011218126 [0,1,0,0,0,0|3,0,0]=4 609 B19R2.44319 Cc1cc(ccc1NCCn2cncn2)C(=O)N 34a_100000746439_200000749826 [0,1,0,0,0,0|3,0,0]=4 610 B19R2.44319 Cc1cc(ccc1NCCn2cncn2)C(=O)N 7a_100000746439_100000731791 [0,1,0,0,0,0|3,0,0]=4 611 B19R2.44319 Cc1cc(ccc1OCCn2cccc2)[N+](=O)[O-] 7a_100000744956_200000035178 [0,1,0,0,0,0|2,0,1]=4 612 B19R2.44319 Cc1cc(ccc1OCCn2ccnc2)C(C)C 7a_200012180908_100000702546 [0,1,0,0,0,0|2,0,1]=4 613 B19R2.44319 Cc1cc(ccc1OCCn2ccnc2)[N+](=O)[O-] 7a_100000744956_100000702546 [0,1,0,0,0,0|1,0,1]=3 614 B19R2.44319 Cc1cc(ccc1OCCn2cncn2)[N+](=O)[O-] 34a_100000744956_200000749826 [0,1,0,0,0,0|2,0,1]=4 615 B19R2.44319 Cc1cc(ccc1OCCn2cncn2)[N+](=O)[O-] 7a_100000744956_100000731791 [0,1,0,0,0,0|2,0,1]=4 616 B19R2.44319 Cc1cc(ccc1SCCn2cccc2)C(=O)N 62a_100011218126_200000035178 [0,1,0,0,0,0|2,1,0]=4 617 B19R2.44319 Cc1cc(ccc1SCCn2cccc2)C(=O)N 62a_200009811947_100011218126 [0,1,0,0,0,0|2,1,0]=4 618 B19R2.44319 Cc1cc(ccc1SCCn2ccnc2)B(O)O 62a_100000702546_100010089846 [0,1,0,0,0,0|1,1,1]=4 619 B19R2.44319 Cc1cc(ccc1SCCn2ccnc2)B(O)O 62a_100010089846_100000702546 [0,1,0,0,0,0|1,1,1]=4 620 B19R2.44319 Cc1cc(ccc1SCCn2ccnc2)C(=O)N 62a_100000702546_100011218126 [0,1,0,0,0,0|1,1,0]=3 621 B19R2.44319 Cc1cc(ccc1SCCn2ccnc2)C(=O)N 62a_100011218126_100000702546 [0,1,0,0,0,0|1,1,0]=3 622 B19R2.44319 Cc1cc(ccc1SCCn2cncn2)C(=O)N 62a_100000731791_100011218126 [0,1,0,0,0,0|2,1,0]=4 623 B19R2.44319 Cc1cc(ccc1SCCn2cncn2)C(=O)N 62a_100011218126_100000731791 [0,1,0,0,0,0|2,1,0]=4 624 B19R2.44319 Cc1cc(ncc1OCCn2ccnc2)[N+](=O)[O-] 7a_100015695027_100000702546 [0,1,0,0,0,0|2,0,1]=4 625 B19R2.44319 Cc1nc(ccc1OCCn2ccnc2)[N+](=O)[O-] 7a_100009862445_100000702546 [0,1,0,0,0,0|2,0,1]=4 626 B19R2.44319 NC(=O)c1ccc(c(c1)Br)NCCn2cccc2 27a_100011368172_100009814583 [0,1,0,0,0,0|3,0,0]=4 627 B19R2.44319 NC(=O)c1ccc(c(c1)Br)NCCn2ccnc2 27a_100000230061_100009814583 [0,1,0,0,0,0|2,0,0]=3 628 B19R2.44319 NC(=O)c1ccc(c(c1)Br)NCCn2cncn2 27a_200000738561_100009814583 [0,1,0,0,0,0|3,0,0]=4 629 B19R2.44319 NC(=O)c1ccc(c(c1)Br)SCCn2cccc2 62a_100009814583_200000035178 [0,1,0,0,0,0|2,1,0]=4 630 B19R2.44319 NC(=O)c1ccc(c(c1)Br)SCCn2cccc2 62a_200009811947_100009814583 [0,1,0,0,0,0|2,1,0]=4 631 B19R2.44319 NC(=O)c1ccc(c(c1)Br)SCCn2ccnc2 62a_100000702546_100009814583 [0,1,0,0,0,0|1,1,0]=3 632 B19R2.44319 NC(=O)c1ccc(c(c1)Br)SCCn2ccnc2 62a_100009814583_100000702546 [0,1,0,0,0,0|1,1,0]=3 633 B19R2.44319 NC(=O)c1ccc(c(c1)Br)SCCn2cncn2 62a_100000731791_100009814583 [0,1,0,0,0,0|2,1,0]=4 634 B19R2.44319 NC(=O)c1ccc(c(c1)Br)SCCn2cncn2 62a_100009814583_100000731791 [0,1,0,0,0,0|2,1,0]=4 635 B19R2.44319 NC(=O)c1ccc(c(c1)Cl)OCCc2cn[nH]c2 7a_200000192832_100000743252 [0,1,0,0,0,0|3,0,0]=4 636 B19R2.44319 NC(=O)c1ccc(c(c1)Cl)OCCn2cccc2 7a_200000192832_200000035178 [0,1,0,0,0,0|2,0,0]=3 637 B19R2.44319 NC(=O)c1ccc(c(c1)Cl)OCCn2cccn2 34a_200000192832_100015204718 [0,1,0,0,0,0|3,0,0]=4 638 B19R2.44319 NC(=O)c1ccc(c(c1)Cl)OCCn2cccn2 7a_200000192832_100000685285 [0,1,0,0,0,0|3,0,0]=4 639 B19R2.44319 NC(=O)c1ccc(c(c1)Cl)OCCn2ccnc2 7a_200000192832_100000702546 [0,1,0,0,0,0|1,0,0]=2 640 B19R2.44319 NC(=O)c1ccc(c(c1)Cl)OCCn2cncn2 34a_200000192832_200000749826 [0,1,0,0,0,0|2,0,0]=3 641 B19R2.44319 NC(=O)c1ccc(c(c1)Cl)OCCn2cncn2 7a_200000192832_100000731791 [0,1,0,0,0,0|2,0,0]=3 642 B19R2.44319 NC(=O)c1ccc(c(c1)F)NCCn2cccc2 27a_100011368172_100000686215 [0,1,0,0,0,0|3,0,0]=4 643 B19R2.44319 NC(=O)c1ccc(c(c1)F)NCCn2ccnc2 27a_100000230061_100000686215 [0,1,0,0,0,0|2,0,0]=3 644 B19R2.44319 NC(=O)c1ccc(c(c1)F)NCCn2cncn2 27a_200000738561_100000686215 [0,1,0,0,0,0|3,0,0]=4 645 B19R2.44319 NC(=O)c1ccc(c(c1)F)SCCn2cccc2 62a_100000686215_200000035178 [0,1,0,0,0,0|2,1,0]=4 646 B19R2.44319 NC(=O)c1ccc(c(c1)F)SCCn2cccc2 62a_200009811947_100000686215 [0,1,0,0,0,0|2,1,0]=4 647 B19R2.44319 NC(=O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100000686215_100000702546 [0,1,0,0,0,0|1,1,0]=3 648 B19R2.44319 NC(=O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100000702546_100000686215 [0,1,0,0,0,0|1,1,0]=3 649 B19R2.44319 NC(=O)c1ccc(c(c1)F)SCCn2cncn2 62a_100000686215_100000731791 [0,1,0,0,0,0|2,1,0]=4 650 B19R2.44319 NC(=O)c1ccc(c(c1)F)SCCn2cncn2 62a_100000731791_100000686215 [0,1,0,0,0,0|2,1,0]=4 651 B19R2.44319 NC(=O)c1ccc(c(c1)O)SCCn2cccc2 62a_100012344895_200000035178 [0,1,0,0,0,0|2,1,0]=4 652 B19R2.44319 NC(=O)c1ccc(c(c1)O)SCCn2cccc2 62a_200009811947_100012344895 [0,1,0,0,0,0|2,1,0]=4 653 B19R2.44319 NC(=O)c1ccc(c(c1)O)SCCn2ccnc2 62a_100000702546_100012344895 [0,1,0,0,0,0|1,1,0]=3 654 B19R2.44319 NC(=O)c1ccc(c(c1)O)SCCn2ccnc2 62a_100012344895_100000702546 [0,1,0,0,0,0|1,1,0]=3 655 B19R2.44319 NC(=O)c1ccc(c(c1)O)SCCn2cncn2 62a_100000731791_100012344895 [0,1,0,0,0,0|2,1,0]=4 656 B19R2.44319 NC(=O)c1ccc(c(c1)O)SCCn2cncn2 62a_100012344895_100000731791 [0,1,0,0,0,0|2,1,0]=4 657 B19R2.44319 Nc1cc(ccc1OCCn2cccc2)[N+](=O)[O-] 7a_100000181223_200000035178 [0,1,0,0,0,0|2,0,1]=4 658 B19R2.44319 Nc1cc(ccc1OCCn2ccnc2)[N+](=O)[O-] 7a_100000181223_100000702546 [0,1,0,0,0,0|1,0,1]=3 659 B19R2.44319 Nc1cc(ccc1OCCn2cncn2)[N+](=O)[O-] 34a_100000181223_200000749826 [0,1,0,0,0,0|2,0,1]=4 660 B19R2.44319 Nc1cc(ccc1OCCn2cncn2)[N+](=O)[O-] 7a_100000181223_100000731791 [0,1,0,0,0,0|2,0,1]=4 661 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)Br)OCCn2cccc2 7a_100000756651_200000035178 [0,1,0,0,0,0|2,0,1]=4 662 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)Br)OCCn2ccnc2 7a_100000756651_100000702546 [0,1,0,0,0,0|1,0,1]=3 663 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)Br)OCCn2cncn2 34a_100000756651_200000749826 [0,1,0,0,0,0|2,0,1]=4 664 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)Br)OCCn2cncn2 7a_100000756651_100000731791 [0,1,0,0,0,0|2,0,1]=4 665 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)Cl)OCCn2cccc2 7a_100000206008_200000035178 [0,1,0,0,0,0|2,0,1]=4 666 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)Cl)OCCn2ccnc2 7a_100000206008_100000702546 [0,1,0,0,0,0|1,0,1]=3 667 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)Cl)OCCn2cncn2 34a_100000206008_200000749826 [0,1,0,0,0,0|2,0,1]=4 668 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)Cl)OCCn2cncn2 7a_100000206008_100000731791 [0,1,0,0,0,0|2,0,1]=4 669 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)F)OCCn2cccc2 7a_100000739697_200000035178 [0,1,0,0,0,0|2,0,1]=4 670 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)F)OCCn2ccnc2 7a_100000739697_100000702546 [0,1,0,0,0,0|1,0,1]=3 671 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)F)OCCn2cncn2 34a_100000739697_200000749826 [0,1,0,0,0,0|2,0,1]=4 672 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)F)OCCn2cncn2 7a_100000739697_100000731791 [0,1,0,0,0,0|2,0,1]=4 673 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)I)OCCn2cccc2 7a_100012047213_200000035178 [0,1,0,0,0,0|2,0,1]=4 674 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)I)OCCn2ccnc2 7a_100012047213_100000702546 [0,1,0,0,0,0|1,0,1]=3 675 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)I)OCCn2cncn2 34a_100012047213_200000749826 [0,1,0,0,0,0|2,0,1]=4 676 B19R2.44319 O=[N+]([O-])c1ccc(c(c1)I)OCCn2cncn2 7a_100012047213_100000731791 [0,1,0,0,0,0|2,0,1]=4 677 B19R2.44319 OB(O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100000702546_100009813512 [0,1,0,0,0,0|1,1,1]=4 678 B19R2.44319 OB(O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100009813512_100000702546 [0,1,0,0,0,0|1,1,1]=4 679 B19R2.44370 CC(=O)c1ccc(cc1Br)OCCc2cn[nH]c2 7a_100012340537_100000743252 [0,1,0,0,0,0|3,0,0]=4 680 B19R2.44370 CC(=O)c1ccc(cc1Br)OCCn2cccc2 7a_100012340537_200000035178 [0,1,0,0,0,0|2,0,0]=3 681 B19R2.44370 CC(=O)c1ccc(cc1Br)OCCn2cccn2 34a_100012340537_100015204718 [0,1,0,0,0,0|3,0,0]=4 682 B19R2.44370 CC(=O)c1ccc(cc1Br)OCCn2cccn2 7a_100012340537_100000685285 [0,1,0,0,0,0|3,0,0]=4 683 B19R2.44370 CC(=O)c1ccc(cc1Br)OCCn2ccnc2 7a_100012340537_100000702546 [0,1,0,0,0,0|1,0,0]=2 684 B19R2.44370 CC(=O)c1ccc(cc1Br)OCCn2cncn2 34a_100012340537_200000749826 [0,1,0,0,0,0|2,0,0]=3 685 B19R2.44370 CC(=O)c1ccc(cc1Br)OCCn2cncn2 7a_100012340537_100000731791 [0,1,0,0,0,0|2,0,0]=3 686 B19R2.44370 CC(=O)c1ccc(cc1C)OCCc2cn[nH]c2 7a_100000702595_100000743252 [0,1,0,0,0,0|3,0,0]=4 687 B19R2.44370 CC(=O)c1ccc(cc1C)OCCn2cccc2 7a_100000702595_200000035178 [0,1,0,0,0,0|2,0,0]=3 688 B19R2.44370 CC(=O)c1ccc(cc1C)OCCn2cccn2 34a_100000702595_100015204718 [0,1,0,0,0,0|3,0,0]=4 689 B19R2.44370 CC(=O)c1ccc(cc1C)OCCn2cccn2 7a_100000702595_100000685285 [0,1,0,0,0,0|3,0,0]=4 690 B19R2.44370 CC(=O)c1ccc(cc1C)OCCn2ccnc2 7a_100000702595_100000702546 [0,1,0,0,0,0|1,0,0]=2 691 B19R2.44370 CC(=O)c1ccc(cc1C)OCCn2cncn2 34a_100000702595_200000749826 [0,1,0,0,0,0|2,0,0]=3 692 B19R2.44370 CC(=O)c1ccc(cc1C)OCCn2cncn2 7a_100000702595_100000731791 [0,1,0,0,0,0|2,0,0]=3 693 B19R2.44370 CC(=O)c1ccc(cc1C)SCCn2cccc2 62a_100012360112_200000035178 [0,1,0,0,0,0|2,1,0]=4 694 B19R2.44370 CC(=O)c1ccc(cc1C)SCCn2cccc2 62a_200009811947_100012360112 [0,1,0,0,0,0|2,1,0]=4 695 B19R2.44370 CC(=O)c1ccc(cc1C)SCCn2ccnc2 62a_100000702546_100012360112 [0,1,0,0,0,0|1,1,0]=3 696 B19R2.44370 CC(=O)c1ccc(cc1C)SCCn2ccnc2 62a_100012360112_100000702546 [0,1,0,0,0,0|1,1,0]=3 697 B19R2.44370 CC(=O)c1ccc(cc1C)SCCn2cncn2 62a_100000731791_100012360112 [0,1,0,0,0,0|2,1,0]=4 698 B19R2.44370 CC(=O)c1ccc(cc1C)SCCn2cncn2 62a_100012360112_100000731791 [0,1,0,0,0,0|2,1,0]=4 699 B19R2.44370 CC(=O)c1ccc(cc1Cl)OCCc2cn[nH]c2 7a_100011933989_100000743252 [0,1,0,0,0,0|3,0,0]=4 700 B19R2.44370 CC(=O)c1ccc(cc1Cl)OCCn2cccc2 7a_100011933989_200000035178 [0,1,0,0,0,0|2,0,0]=3 701 B19R2.44370 CC(=O)c1ccc(cc1Cl)OCCn2cccn2 34a_100011933989_100015204718 [0,1,0,0,0,0|3,0,0]=4 702 B19R2.44370 CC(=O)c1ccc(cc1Cl)OCCn2cccn2 7a_100011933989_100000685285 [0,1,0,0,0,0|3,0,0]=4 703 B19R2.44370 CC(=O)c1ccc(cc1Cl)OCCn2ccnc2 7a_100011933989_100000702546 [0,1,0,0,0,0|1,0,0]=2 704 B19R2.44370 CC(=O)c1ccc(cc1Cl)OCCn2cncn2 34a_100011933989_200000749826 [0,1,0,0,0,0|2,0,0]=3 705 B19R2.44370 CC(=O)c1ccc(cc1Cl)OCCn2cncn2 7a_100011933989_100000731791 [0,1,0,0,0,0|2,0,0]=3 706 B19R2.44370 CC(=O)c1ccc(cc1F)NCCn2cccc2 27a_100011368172_100000690205 [0,1,0,0,0,0|3,0,0]=4 707 B19R2.44370 CC(=O)c1ccc(cc1F)NCCn2ccnc2 27a_100000230061_100000690205 [0,1,0,0,0,0|2,0,0]=3 708 B19R2.44370 CC(=O)c1ccc(cc1F)NCCn2cncn2 27a_200000738561_100000690205 [0,1,0,0,0,0|3,0,0]=4 709 B19R2.44370 CC(=O)c1ccc(cc1F)OCCc2cn[nH]c2 7a_100000752407_100000743252 [0,1,0,0,0,0|3,0,0]=4 710 B19R2.44370 CC(=O)c1ccc(cc1F)OCCn2cccc2 7a_100000752407_200000035178 [0,1,0,0,0,0|2,0,0]=3 711 B19R2.44370 CC(=O)c1ccc(cc1F)OCCn2cccn2 34a_100000752407_100015204718 [0,1,0,0,0,0|3,0,0]=4 712 B19R2.44370 CC(=O)c1ccc(cc1F)OCCn2cccn2 7a_100000752407_100000685285 [0,1,0,0,0,0|3,0,0]=4 713 B19R2.44370 CC(=O)c1ccc(cc1F)OCCn2ccnc2 7a_100000752407_100000702546 [0,1,0,0,0,0|1,0,0]=2 714 B19R2.44370 CC(=O)c1ccc(cc1F)OCCn2cncn2 34a_100000752407_200000749826 [0,1,0,0,0,0|2,0,0]=3 715 B19R2.44370 CC(=O)c1ccc(cc1F)OCCn2cncn2 7a_100000752407_100000731791 [0,1,0,0,0,0|2,0,0]=3 716 B19R2.44370 CC(=O)c1ccc(cc1F)SCCn2cccc2 62a_100000690205_200000035178 [0,1,0,0,0,0|2,1,0]=4 717 B19R2.44370 CC(=O)c1ccc(cc1F)SCCn2ccnc2 62a_100000690205_100000702546 [0,1,0,0,0,0|1,1,0]=3 718 B19R2.44370 CC(=O)c1ccc(cc1F)SCCn2cncn2 62a_100000690205_100000731791 [0,1,0,0,0,0|2,1,0]=4 719 B19R2.44370 CC(=O)c1ccc(cc1N)SCCn2cccc2 62a_100011590516_200000035178 [0,1,0,0,0,0|2,1,0]=4 720 B19R2.44370 CC(=O)c1ccc(cc1N)SCCn2ccnc2 62a_100011590516_100000702546 [0,1,0,0,0,0|1,1,0]=3 721 B19R2.44370 CC(=O)c1ccc(cc1N)SCCn2cncn2 62a_100011590516_100000731791 [0,1,0,0,0,0|2,1,0]=4 722 B19R2.44370 CC(=O)c1ncc(cc1F)SCCn2ccnc2 62a_100000696590_100000702546 [0,1,0,0,0,0|2,1,0]=4 723 B19R2.44370 CC(=O)c1ncc(cc1F)SCCn2ccnc2 62a_100000702546_100000696590 [0,1,0,0,0,0|2,1,0]=4 724 B19R2.44370 Cc1cc(ccc1B(O)O)SCCn2ccnc2 62a_100000702546_100010074995 [0,1,0,0,0,0|1,1,1]=4 725 B19R2.44370 Cc1cc(ccc1B(O)O)SCCn2ccnc2 62a_100010074995_100000702546 [0,1,0,0,0,0|1,1,1]=4 726 B19R2.44370 Cc1cc(ccc1C(=O)N)NCCn2cccc2 27a_100011368172_100011327924 [0,1,0,0,0,0|3,0,0]=4 727 B19R2.44370 Cc1cc(ccc1C(=O)N)NCCn2cccc2 7a_200000751758_200000035178 [0,1,0,0,0,0|3,0,0]=4 728 B19R2.44370 Cc1cc(ccc1C(=O)N)NCCn2ccnc2 27a_100000230061_100011327924 [0,1,0,0,0,0|2,0,0]=3 729 B19R2.44370 Cc1cc(ccc1C(=O)N)NCCn2ccnc2 7a_200000751758_100000702546 [0,1,0,0,0,0|2,0,0]=3 730 B19R2.44370 Cc1cc(ccc1C(=O)N)NCCn2cncn2 27a_200000738561_100011327924 [0,1,0,0,0,0|3,0,0]=4 731 B19R2.44370 Cc1cc(ccc1C(=O)N)NCCn2cncn2 34a_200000751758_200000749826 [0,1,0,0,0,0|3,0,0]=4 732 B19R2.44370 Cc1cc(ccc1C(=O)N)NCCn2cncn2 7a_200000751758_100000731791 [0,1,0,0,0,0|3,0,0]=4 733 B19R2.44370 Cc1cc(ccc1C(=O)N)SCCn2cccc2 62a_100011327924_200000035178 [0,1,0,0,0,0|2,1,0]=4 734 B19R2.44370 Cc1cc(ccc1C(=O)N)SCCn2cccc2 62a_200009811947_100011327924 [0,1,0,0,0,0|2,1,0]=4 735 B19R2.44370 Cc1cc(ccc1C(=O)N)SCCn2ccnc2 62a_100000702546_100011327924 [0,1,0,0,0,0|1,1,0]=3 736 B19R2.44370 Cc1cc(ccc1C(=O)N)SCCn2ccnc2 62a_100011327924_100000702546 [0,1,0,0,0,0|1,1,0]=3 737 B19R2.44370 Cc1cc(ccc1C(=O)N)SCCn2cncn2 62a_100000731791_100011327924 [0,1,0,0,0,0|2,1,0]=4 738 B19R2.44370 Cc1cc(ccc1C(=O)N)SCCn2cncn2 62a_100011327924_100000731791 [0,1,0,0,0,0|2,1,0]=4 739 B19R2.44370 Cc1cc(ccc1C(C)C)OCCn2ccnc2 7a_100000210824_100000702546 [0,1,0,0,0,0|2,0,1]=4 740 B19R2.44370 Cc1cc(ccc1[N+](=O)[O-])NCCn2ccnc2 7a_100000745639_100000702546 [0,1,0,0,0,0|2,0,1]=4 741 B19R2.44370 Cc1cc(ccc1[N+](=O)[O-])OCCn2cccc2 7a_100000195451_200000035178 [0,1,0,0,0,0|2,0,1]=4 742 B19R2.44370 Cc1cc(ccc1[N+](=O)[O-])OCCn2ccnc2 7a_100000195451_100000702546 [0,1,0,0,0,0|1,0,1]=3 743 B19R2.44370 Cc1cc(ccc1[N+](=O)[O-])OCCn2cncn2 34a_100000195451_200000749826 [0,1,0,0,0,0|2,0,1]=4 744 B19R2.44370 Cc1cc(ccc1[N+](=O)[O-])OCCn2cncn2 7a_100000195451_100000731791 [0,1,0,0,0,0|2,0,1]=4 745 B19R2.44370 Cc1cc(ncc1C(=O)N)NCCn2ccnc2 27a_100000230061_200134614278 [0,1,0,0,0,0|3,0,0]=4 746 B19R2.44370 Cc1cc(ncc1C(=O)N)SCCn2ccnc2 62a_100000702546_200134614278 [0,1,0,0,0,0|2,1,0]=4 747 B19R2.44370 Cc1cc(ncc1C(=O)N)SCCn2ccnc2 62a_200134614278_100000702546 [0,1,0,0,0,0|2,1,0]=4 748 B19R2.44370 NC(=O)c1ccc(cc1Br)NCCn2cccc2 27a_100011368172_200010146565 [0,1,0,0,0,0|3,0,0]=4 749 B19R2.44370 NC(=O)c1ccc(cc1Br)NCCn2ccnc2 27a_100000230061_200010146565 [0,1,0,0,0,0|2,0,0]=3 750 B19R2.44370 NC(=O)c1ccc(cc1Br)NCCn2cncn2 27a_200000738561_200010146565 [0,1,0,0,0,0|3,0,0]=4 751 B19R2.44370 NC(=O)c1ccc(cc1Br)SCCn2cccc2 62a_200010146565_200000035178 [0,1,0,0,0,0|2,1,0]=4 752 B19R2.44370 NC(=O)c1ccc(cc1Br)SCCn2ccnc2 62a_200010146565_100000702546 [0,1,0,0,0,0|1,1,0]=3 753 B19R2.44370 NC(=O)c1ccc(cc1Br)SCCn2cncn2 62a_200010146565_100000731791 [0,1,0,0,0,0|2,1,0]=4 754 B19R2.44370 NC(=O)c1ccc(cc1Cl)NCCn2cccc2 7a_100000737725_200000035178 [0,1,0,0,0,0|3,0,0]=4 755 B19R2.44370 NC(=O)c1ccc(cc1Cl)NCCn2ccnc2 7a_100000737725_100000702546 [0,1,0,0,0,0|2,0,0]=3 756 B19R2.44370 NC(=O)c1ccc(cc1Cl)NCCn2cncn2 34a_100000737725_200000749826 [0,1,0,0,0,0|3,0,0]=4 757 B19R2.44370 NC(=O)c1ccc(cc1Cl)NCCn2cncn2 7a_100000737725_100000731791 [0,1,0,0,0,0|3,0,0]=4 758 B19R2.44370 NC(=O)c1ccc(cc1Cl)OCCc2cn[nH]c2 7a_100011997949_100000743252 [0,1,0,0,0,0|3,0,0]=4 759 B19R2.44370 NC(=O)c1ccc(cc1Cl)OCCn2cccc2 7a_100011997949_200000035178 [0,1,0,0,0,0|2,0,0]=3 760 B19R2.44370 NC(=O)c1ccc(cc1Cl)OCCn2cccn2 34a_100011997949_100015204718 [0,1,0,0,0,0|3,0,0]=4 761 B19R2.44370 NC(=O)c1ccc(cc1Cl)OCCn2cccn2 7a_100011997949_100000685285 [0,1,0,0,0,0|3,0,0]=4 762 B19R2.44370 NC(=O)c1ccc(cc1Cl)OCCn2ccnc2 7a_100011997949_100000702546 [0,1,0,0,0,0|1,0,0]=2 763 B19R2.44370 NC(=O)c1ccc(cc1Cl)OCCn2cncn2 34a_100011997949_200000749826 [0,1,0,0,0,0|2,0,0]=3 764 B19R2.44370 NC(=O)c1ccc(cc1Cl)OCCn2cncn2 7a_100011997949_100000731791 [0,1,0,0,0,0|2,0,0]=3 765 B19R2.44370 NC(=O)c1ccc(cc1F)NCCn2cccc2 27a_100011368172_100000216903 [0,1,0,0,0,0|3,0,0]=4 766 B19R2.44370 NC(=O)c1ccc(cc1F)NCCn2cccc2 7a_100000749959_200000035178 [0,1,0,0,0,0|3,0,0]=4 767 B19R2.44370 NC(=O)c1ccc(cc1F)NCCn2ccnc2 27a_100000230061_100000216903 [0,1,0,0,0,0|2,0,0]=3 768 B19R2.44370 NC(=O)c1ccc(cc1F)NCCn2ccnc2 7a_100000749959_100000702546 [0,1,0,0,0,0|2,0,0]=3 769 B19R2.44370 NC(=O)c1ccc(cc1F)NCCn2cncn2 27a_200000738561_100000216903 [0,1,0,0,0,0|3,0,0]=4 770 B19R2.44370 NC(=O)c1ccc(cc1F)NCCn2cncn2 34a_100000749959_200000749826 [0,1,0,0,0,0|3,0,0]=4 771 B19R2.44370 NC(=O)c1ccc(cc1F)NCCn2cncn2 7a_100000749959_100000731791 [0,1,0,0,0,0|3,0,0]=4 772 B19R2.44370 NC(=O)c1ccc(cc1F)OCCc2cn[nH]c2 7a_200012186767_100000743252 [0,1,0,0,0,0|3,0,0]=4 773 B19R2.44370 NC(=O)c1ccc(cc1F)OCCn2cccc2 7a_200012186767_200000035178 [0,1,0,0,0,0|2,0,0]=3 774 B19R2.44370 NC(=O)c1ccc(cc1F)OCCn2cccn2 34a_200012186767_100015204718 [0,1,0,0,0,0|3,0,0]=4 775 B19R2.44370 NC(=O)c1ccc(cc1F)OCCn2cccn2 7a_200012186767_100000685285 [0,1,0,0,0,0|3,0,0]=4 776 B19R2.44370 NC(=O)c1ccc(cc1F)OCCn2ccnc2 7a_200012186767_100000702546 [0,1,0,0,0,0|1,0,0]=2 777 B19R2.44370 NC(=O)c1ccc(cc1F)OCCn2cncn2 34a_200012186767_200000749826 [0,1,0,0,0,0|2,0,0]=3 778 B19R2.44370 NC(=O)c1ccc(cc1F)OCCn2cncn2 7a_200012186767_100000731791 [0,1,0,0,0,0|2,0,0]=3 779 B19R2.44370 NC(=O)c1ccc(cc1F)SCCn2cccc2 62a_100000216903_200000035178 [0,1,0,0,0,0|2,1,0]=4 780 B19R2.44370 NC(=O)c1ccc(cc1F)SCCn2ccnc2 62a_100000216903_100000702546 [0,1,0,0,0,0|1,1,0]=3 781 B19R2.44370 NC(=O)c1ccc(cc1F)SCCn2cncn2 62a_100000216903_100000731791 [0,1,0,0,0,0|2,1,0]=4 782 B19R2.44370 NC(=O)c1ccc(cc1N)OCCc2cn[nH]c2 7a_100012186684_100000743252 [0,1,0,0,0,0|3,0,0]=4 783 B19R2.44370 NC(=O)c1ccc(cc1N)OCCn2cccc2 7a_100012186684_200000035178 [0,1,0,0,0,0|2,0,0]=3 784 B19R2.44370 NC(=O)c1ccc(cc1N)OCCn2cccn2 34a_100012186684_100015204718 [0,1,0,0,0,0|3,0,0]=4 785 B19R2.44370 NC(=O)c1ccc(cc1N)OCCn2cccn2 7a_100012186684_100000685285 [0,1,0,0,0,0|3,0,0]=4 786 B19R2.44370 NC(=O)c1ccc(cc1N)OCCn2ccnc2 7a_100012186684_100000702546 [0,1,0,0,0,0|1,0,0]=2 787 B19R2.44370 NC(=O)c1ccc(cc1N)OCCn2cncn2 34a_100012186684_200000749826 [0,1,0,0,0,0|2,0,0]=3 788 B19R2.44370 NC(=O)c1ccc(cc1N)OCCn2cncn2 7a_100012186684_100000731791 [0,1,0,0,0,0|2,0,0]=3 789 B19R2.44370 NC(=O)c1ccc(cc1N)SCCn2cccc2 62a_100012349972_200000035178 [0,1,0,0,0,0|2,1,0]=4 790 B19R2.44370 NC(=O)c1ccc(cc1N)SCCn2ccnc2 62a_100012349972_100000702546 [0,1,0,0,0,0|1,1,0]=3 791 B19R2.44370 NC(=O)c1ccc(cc1N)SCCn2cncn2 62a_100012349972_100000731791 [0,1,0,0,0,0|2,1,0]=4 792 B19R2.44370 NC(=O)c1ccc(cc1O)NCCn2cccc2 7a_100000223280_200000035178 [0,1,0,0,0,0|3,0,0]=4 793 B19R2.44370 NC(=O)c1ccc(cc1O)NCCn2ccnc2 7a_100000223280_100000702546 [0,1,0,0,0,0|2,0,0]=3 794 B19R2.44370 NC(=O)c1ccc(cc1O)NCCn2cncn2 34a_100000223280_200000749826 [0,1,0,0,0,0|3,0,0]=4 795 B19R2.44370 NC(=O)c1ccc(cc1O)NCCn2cncn2 7a_100000223280_100000731791 [0,1,0,0,0,0|3,0,0]=4 796 B19R2.44370 NC(=O)c1ccc(cc1O)SCCn2cccc2 62a_100011550861_200000035178 [0,1,0,0,0,0|2,1,0]=4 797 B19R2.44370 NC(=O)c1ccc(cc1O)SCCn2ccnc2 62a_100011550861_100000702546 [0,1,0,0,0,0|1,1,0]=3 798 B19R2.44370 NC(=O)c1ccc(cc1O)SCCn2cncn2 62a_100011550861_100000731791 [0,1,0,0,0,0|2,1,0]=4 799 B19R2.44370 NC(=O)c1ccc(nc1N)NCCn2ccnc2 27a_100000230061_100009875182 [0,1,0,0,0,0|3,0,0]=4 800 B19R2.44370 NC(=O)c1ccc(nc1N)SCCn2ccnc2 62a_100009875182_100000702546 [0,1,0,0,0,0|2,1,0]=4 801 B19R2.44370 NC(=O)c1ncc(cc1F)NCCn2ccnc2 27a_100000230061_200010161073 [0,1,0,0,0,0|3,0,0]=4 802 B19R2.44370 NC(=O)c1ncc(cc1F)SCCn2ccnc2 62a_100000702546_200010161073 [0,1,0,0,0,0|2,1,0]=4 803 B19R2.44370 NC(=O)c1ncc(cc1F)SCCn2ccnc2 62a_200010161073_100000702546 [0,1,0,0,0,0|2,1,0]=4 804 B19R2.44370 NC(=O)c1ncc(cc1N)SCCn2ccnc2 62a_100000702546_100010235749 [0,1,0,0,0,0|2,1,0]=4 805 B19R2.44370 NC(=O)c1ncc(cc1N)SCCn2ccnc2 62a_100010235749_100000702546 [0,1,0,0,0,0|2,1,0]=4 806 B19R2.44370 Nc1cc(ccc1[N+](=O)[O-])OCCn2cccc2 7a_100000729835_200000035178 [0,1,0,0,0,0|2,0,1]=4 807 B19R2.44370 Nc1cc(ccc1[N+](=O)[O-])OCCn2ccnc2 7a_100000729835_100000702546 [0,1,0,0,0,0|1,0,1]=3 808 B19R2.44370 Nc1cc(ccc1[N+](=O)[O-])OCCn2cncn2 7a_100000729835_100000731791 [0,1,0,0,0,0|2,0,1]=4 809 B19R2.44370 O=[N+]([O-])c1ccc(cc1Br)NCCn2ccnc2 7a_100000693983_100000702546 [0,1,0,0,0,0|2,0,1]=4 810 B19R2.44370 O=[N+]([O-])c1ccc(cc1Br)OCCn2cccc2 7a_100012356988_200000035178 [0,1,0,0,0,0|2,0,1]=4 811 B19R2.44370 O=[N+]([O-])c1ccc(cc1Br)OCCn2ccnc2 7a_100012356988_100000702546 [0,1,0,0,0,0|1,0,1]=3 812 B19R2.44370 O=[N+]([O-])c1ccc(cc1Br)OCCn2cncn2 34a_100012356988_200000749826 [0,1,0,0,0,0|2,0,1]=4 813 B19R2.44370 O=[N+]([O-])c1ccc(cc1Br)OCCn2cncn2 7a_100012356988_100000731791 [0,1,0,0,0,0|2,0,1]=4 814 B19R2.44370 O=[N+]([O-])c1ccc(cc1Cl)OCCn2cccc2 7a_100000746235_200000035178 [0,1,0,0,0,0|2,0,1]=4 815 B19R2.44370 O=[N+]([O-])c1ccc(cc1Cl)OCCn2ccnc2 7a_100000746235_100000702546 [0,1,0,0,0,0|1,0,1]=3 816 B19R2.44370 O=[N+]([O-])c1ccc(cc1Cl)OCCn2cncn2 34a_100000746235_200000749826 [0,1,0,0,0,0|2,0,1]=4 817 B19R2.44370 O=[N+]([O-])c1ccc(cc1Cl)OCCn2cncn2 7a_100000746235_100000731791 [0,1,0,0,0,0|2,0,1]=4 818 B19R2.44370 O=[N+]([O-])c1ccc(cc1F)NCCn2ccnc2 7a_100000741728_100000702546 [0,1,0,0,0,0|2,0,1]=4 819 B19R2.44370 O=[N+]([O-])c1ccc(cc1F)OCCn2cccc2 7a_100000745333_200000035178 [0,1,0,0,0,0|2,0,1]=4 820 B19R2.44370 O=[N+]([O-])c1ccc(cc1F)OCCn2ccnc2 7a_100000745333_100000702546 [0,1,0,0,0,0|1,0,1]=3 821 B19R2.44370 O=[N+]([O-])c1ccc(cc1F)OCCn2cncn2 7a_100000745333_100000731791 [0,1,0,0,0,0|2,0,1]=4 822 B19R2.44370 O=[N+]([O-])c1ccc(cc1I)OCCn2cccc2 7a_100010243554_200000035178 [0,1,0,0,0,0|2,0,1]=4 823 B19R2.44370 O=[N+]([O-])c1ccc(cc1I)OCCn2ccnc2 7a_100010243554_100000702546 [0,1,0,0,0,0|1,0,1]=3 824 B19R2.44370 O=[N+]([O-])c1ccc(cc1I)OCCn2cncn2 7a_100010243554_100000731791 [0,1,0,0,0,0|2,0,1]=4 825 B19R2.44370 OB(O)c1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100009813958 [0,1,0,0,0,0|1,1,1]=4 826 B19R2.44370 OB(O)c1ccc(cc1F)SCCn2ccnc2 62a_100009813958_100000702546 [0,1,0,0,0,0|1,1,1]=4 827 B19R2.44370 OB(O)c1ccc(cc1O)SCCn2ccnc2 62a_100000702546_100010158982 [0,1,0,0,0,0|1,1,1]=4 828 B19R2.45003 CC(=O)c1ccc(cc1)OCCn2cc(cn2)Cl 7a_100000185113_100011353933 [0,1,0,0,0,0|3,0,0]=4 829 B19R2.45003 CC(=O)c1ccc(cc1)OCCn2ccc(n2)C 7a_100000185113_200011934056 [0,1,0,0,0,0|3,0,0]=4 830 B19R2.45003 Cc1ccn(n1)CCOc2ccc(cc2)C(=O)N 7a_100000746352_200011934056 [0,1,0,0,0,0|3,0,0]=4 831 B19R2.45003 Cc1cn(nn1)CCOc2ccc(cc2)B(O)O 274090a_100009816937_200000242740 [0,1,0,0,0,0|2,0,1]=4 832 B19R2.45003 Cc1cn(nn1)CCOc2ccc(cc2)[N+](=O)[O-] 274090a_100000742347_200000242740 [0,1,0,0,0,0|2,0,1]=4 833 B19R2.45003 NC(=O)c1ccc(cc1)OCCn2cc(cn2)Cl 7a_100000746352_100011353933 [0,1,0,0,0,0|3,0,0]=4 834 B19R2.51570 C=C(C)c1ccc(cc1)OCCn2ccnc2C 7a_100009880102_100000742477 [0,1,0,0,0,0|2,0,0]=3 835 B19R2.51570 C=C(C)c1ccc(cc1)SCCn2ccnc2C 62a_100000185454_100000742477 [0,1,0,0,0,0|2,1,0]=4 836 B19R2.51570 C=C(C)c1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000185454 [0,1,0,0,0,0|2,1,0]=4 837 B19R2.51570 CC(=O)c1ccc(cc1)OCCc2scnc2C 34a_100000185113_100000057103 [0,1,0,0,0,0|3,0,0]=4 838 B19R2.51570 CC(=O)c1ccc(cc1)OCCc2scnc2C 7a_100000185113_100000057103 [0,1,0,0,0,0|3,0,0]=4 839 B19R2.51570 CC(=O)c1ccc(cc1)OCCn2ccnc2C 7a_100000185113_100000742477 [0,1,0,0,0,0|1,0,0]=2 840 B19R2.51570 CC(=O)c1ccc(cc1)OCCn2nccc2C 7a_100000185113_100011934269 [0,1,0,0,0,0|3,0,0]=4 841 B19R2.51570 CC(=O)c1ccc(cc1)SCCn2ccnc2C 62a_100000185465_100000742477 [0,1,0,0,0,0|1,1,0]=3 842 B19R2.51570 CC(=O)c1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000185465 [0,1,0,0,0,0|1,1,0]=3 843 B19R2.51570 CC(=O)c1ccc(cn1)OCCn2ccnc2C 7a_100012001710_100000742477 [0,1,0,0,0,0|2,0,0]=3 844 B19R2.51570 CC(=O)c1ccc(cn1)SCCn2ccnc2C 62a_100000686046_100000742477 [0,1,0,0,0,0|2,1,0]=4 845 B19R2.51570 CC(=O)c1ccc(cn1)SCCn2ccnc2C 62a_100000742477_100000686046 [0,1,0,0,0,0|2,1,0]=4 846 B19R2.51570 CC(=O)c1ccc(nc1)NCCn2ccnc2C 27a_100015184736_100000690552 [0,1,0,0,0,0|3,0,0]=4 847 B19R2.51570 CC(=O)c1ccc(nc1)SCCn2ccnc2C 62a_100000684857_100000742477 [0,1,0,0,0,0|2,1,0]=4 848 B19R2.51570 CC(=O)c1ccc(nc1)SCCn2ccnc2C 62a_100000742477_100000684857 [0,1,0,0,0,0|2,1,0]=4 849 B19R2.51570 Cc1ccnn1CCOc2ccc(cc2)C(=O)N 7a_100000746352_100011934269 [0,1,0,0,0,0|3,0,0]=4 850 B19R2.51570 Cc1nccn1CCNc2ccc(cc2)C(=O)N 27a_100015184736_100000162191 [0,1,0,0,0,0|2,0,0]=3 851 B19R2.51570 Cc1nccn1CCNc2ccc(cc2)C(C)O 2230a_100011216399_100000742477 [0,1,0,0,0,0|2,0,1]=4 852 B19R2.51570 Cc1nccn1CCNc2ccc(cc2)[N+](=O)[O-] 2230a_100015195142_100000742477 [0,1,0,0,0,0|2,0,1]=4 853 B19R2.51570 Cc1nccn1CCNc2ccc(cn2)C(=O)N 27a_100015184736_100000162237 [0,1,0,0,0,0|3,0,0]=4 854 B19R2.51570 Cc1nccn1CCOc2ccc(cc2)C(=O)N 7a_100000746352_100000742477 [0,1,0,0,0,0|1,0,0]=2 855 B19R2.51570 Cc1nccn1CCOc2ccc(cc2)C(C)C 7a_100000181308_100000742477 [0,1,0,0,0,0|2,0,1]=4 856 B19R2.51570 Cc1nccn1CCOc2ccc(cc2)C(C)O 7a_100000754508_100000742477 [0,1,0,0,0,0|1,0,1]=3 857 B19R2.51570 Cc1nccn1CCOc2ccc(cc2)S(=O)C 7a_200000064373_100000742477 [0,1,0,0,0,0|2,0,0]=3 858 B19R2.51570 Cc1nccn1CCOc2ccc(cc2)[N+](=O)[O-] 7a_100000185810_100000742477 [0,1,0,0,0,0|1,0,1]=3 859 B19R2.51570 Cc1nccn1CCOc2ccc(cc2)[S+](C)C 7a_100010188728_100000742477 [0,1,0,0,0,0|3,0,0]=4 860 B19R2.51570 Cc1nccn1CCOc2ccc(nc2)[N+](=O)[O-] 7a_100000060138_100000742477 [0,1,0,0,0,0|2,0,1]=4 861 B19R2.51570 Cc1nccn1CCSc2ccc(cc2)B(O)O 62a_100000742477_100000754493 [0,1,0,0,0,0|1,1,1]=4 862 B19R2.51570 Cc1nccn1CCSc2ccc(cc2)B(O)O 62a_100000754493_100000742477 [0,1,0,0,0,0|1,1,1]=4 863 B19R2.51570 Cc1nccn1CCSc2ccc(cc2)C(=O)N 62a_100000162191_100000742477 [0,1,0,0,0,0|1,1,0]=3 864 B19R2.51570 Cc1nccn1CCSc2ccc(cc2)C(=O)N 62a_100000742477_100000162191 [0,1,0,0,0,0|1,1,0]=3 865 B19R2.51570 Cc1nccn1CCSc2ccc(cc2)C(C)O 62a_100000742477_100000745893 [0,1,0,0,0,0|1,1,1]=4 866 B19R2.51570 Cc1nccn1CCSc2ccc(cc2)C(C)O 62a_100000745893_100000742477 [0,1,0,0,0,0|1,1,1]=4 867 B19R2.51570 Cc1nccn1CCSc2ccc(cc2)S(=O)C 62a_100009816266_100000742477 [0,1,0,0,0,0|2,1,0]=4 868 B19R2.51570 Cc1nccn1CCSc2ccc(cn2)C(=O)N 62a_100000162237_100000742477 [0,1,0,0,0,0|2,1,0]=4 869 B19R2.51570 Cc1nccn1CCSc2ccc(cn2)C(=O)N 62a_100000742477_100000162237 [0,1,0,0,0,0|2,1,0]=4 870 B19R2.51570 Cc1nccn1CCSc2ccc(nc2)C(=O)N 62a_100000742477_100011219284 [0,1,0,0,0,0|2,1,0]=4 871 B19R2.51570 Cc1nccn1CCSc2ccc(nc2)C(=O)N 62a_100011219284_100000742477 [0,1,0,0,0,0|2,1,0]=4 872 B19R2.51570 Cc1ncsc1CCOc2ccc(cc2)C(=O)N 34a_100000746352_100000057103 [0,1,0,0,0,0|3,0,0]=4 873 B19R2.51570 Cc1ncsc1CCOc2ccc(cc2)C(=O)N 7a_100000746352_100000057103 [0,1,0,0,0,0|3,0,0]=4 874 B17R1.299 C/C=C/CNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100102629194 [0,0,1,0,0,0|1,0,2]=4 875 B17R1.299 C=CCCNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100000754431 [0,0,1,0,0,0|1,0,1]=3 876 B19R3.62416 c1cn(cn1)CCOc2ccc(cc2)C3CC3 271570a_100011220607_100015186965 [0,0,0,1,0,0|2,0,1]=4 877 B19R3.62416 c1cn(cn1)CCOc2ccc(cc2)C3CC3 7a_100011997980_100000702546 [0,0,0,1,0,0|2,0,1]=4 878 B17R2.5640 CC(=O)c1cc(cs1)SCCn2ccnc2 62a_100000702546_100000718618 [0,0,0,0,1,0|2,1,0]=4 879 B17R2.5640 CC(=O)c1cc(cs1)SCCn2ccnc2 62a_100000718618_100000702546 [0,0,0,0,1,0|2,1,0]=4 880 B17R2.5640 CC(=O)c1ccc([nH]1)SCCn2ccnc2 62a_200010494458_100000702546 [0,0,0,0,1,0|2,1,0]=4 881 B17R2.5640 CC(=O)c1ccc(o1)SCCn2ccnc2 62a_100000702546_100000229899 [0,0,0,0,1,0|2,1,0]=4 882 B17R2.5640 CC(=O)c1ccc(s1)SCCn2ccnc2 62a_100000183331_100000702546 [0,0,0,0,1,0|2,1,0]=4 883 B17R2.5640 CC(=O)c1ccc(s1)SCCn2ccnc2 62a_100000702546_200000034408 [0,0,0,0,1,0|2,1,0]=4 884 B17R2.5640 CC(=O)c1csc(c1)SCCn2ccnc2 62a_100000702546_200012344231 [0,0,0,0,1,0|2,1,0]=4 885 B17R2.5640 CC(=O)c1csc(c1)SCCn2ccnc2 62a_200012344231_100000702546 [0,0,0,0,1,0|2,1,0]=4 886 B17R2.5640 NC(=O)c1cc(c[nH]1)SCCn2ccnc2 62a_100000229580_100000702546 [0,0,0,0,1,0|2,1,0]=4 887 B17R2.5640 NC(=O)c1cc(c[nH]1)SCCn2ccnc2 62a_100000702546_100000229580 [0,0,0,0,1,0|2,1,0]=4 888 B17R2.5640 NC(=O)c1cc(co1)SCCn2ccnc2 62a_100000702546_200009817131 [0,0,0,0,1,0|2,1,0]=4 889 B17R2.5640 NC(=O)c1cc(co1)SCCn2ccnc2 62a_200009817131_100000702546 [0,0,0,0,1,0|2,1,0]=4 890 B17R2.5640 NC(=O)c1cc(cs1)SCCn2ccnc2 62a_100000702546_100009812991 [0,0,0,0,1,0|2,1,0]=4 891 B17R2.5640 NC(=O)c1cc(cs1)SCCn2ccnc2 62a_100009812991_100000702546 [0,0,0,0,1,0|2,1,0]=4 892 B17R2.5640 NC(=O)c1ccc(s1)SCCn2ccnc2 62a_100000162267_100000702546 [0,0,0,0,1,0|2,1,0]=4 893 B17R2.5640 NC(=O)c1csc(c1)SCCn2ccnc2 62a_100000702546_100000747962 [0,0,0,0,1,0|2,1,0]=4 894 B17R2.5640 NC(=O)c1csc(c1)SCCn2ccnc2 62a_100000747962_100000702546 [0,0,0,0,1,0|2,1,0]=4 895 B17R2.5650 C=C(C)c1ccc(cc1)OCn2cncn2 34a_100009880102_200020645497 [0,0,0,0,1,0|3,0,0]=4 896 B17R2.5650 C=C(C)c1ccc(cc1)OCn2cncn2 7a_100009880102_200020645497 [0,0,0,0,1,0|3,0,0]=4 897 B17R2.5650 CC(=O)c1ccc(cc1)OCc2ccn[nH]2 34a_100000185113_100000728653 [0,0,0,0,1,0|3,0,0]=4 898 B17R2.5650 CC(=O)c1ccc(cc1)OCc2ccn[nH]2 7a_100000185113_100000728653 [0,0,0,0,1,0|3,0,0]=4 899 B17R2.5650 CC(=O)c1ccc(cc1)OCc2ccsc2 34a_100000185113_100011261437 [0,0,0,0,1,0|3,0,0]=4 900 B17R2.5650 CC(=O)c1ccc(cc1)OCc2ccsc2 7a_100000185113_100011261437 [0,0,0,0,1,0|3,0,0]=4 901 B17R2.5650 CC(=O)c1ccc(cc1)OCc2cncs2 34a_100000185113_100015185245 [0,0,0,0,1,0|3,0,0]=4 902 B17R2.5650 CC(=O)c1ccc(cc1)OCc2cncs2 7a_100000185113_100015185245 [0,0,0,0,1,0|3,0,0]=4 903 B17R2.5650 CC(=O)c1ccc(cc1)OCn2cncn2 34a_100000185113_200020645497 [0,0,0,0,1,0|2,0,0]=3 904 B17R2.5650 CC(=O)c1ccc(cc1)OCn2cncn2 7a_100000185113_200020645497 [0,0,0,0,1,0|2,0,0]=3 905 B17R2.5650 CC(=O)c1ccc(cc1)SCn2cncn2 62a_100000185465_200020645497 [0,0,0,0,1,0|2,1,0]=4 906 B17R2.5650 CC(=O)c1ccc(cc1)SCn2cncn2 62a_200020645497_100000185465 [0,0,0,0,1,0|2,1,0]=4 907 B17R2.5650 CC(=O)c1ccc(cn1)OCn2cncn2 34a_100012001710_200020645497 [0,0,0,0,1,0|3,0,0]=4 908 B17R2.5650 CC(=O)c1ccc(cn1)OCn2cncn2 7a_100012001710_200020645497 [0,0,0,0,1,0|3,0,0]=4 909 B17R2.5650 CC(O)c1ccc(cc1)OCn2cncn2 34a_100000754508_200020645497 [0,0,0,0,1,0|2,0,1]=4 910 B17R2.5650 CC(O)c1ccc(cc1)OCn2cncn2 7a_100000754508_200020645497 [0,0,0,0,1,0|2,0,1]=4 911 B17R2.5650 CS(=O)c1ccc(cc1)OCn2cncn2 34a_200000064373_200020645497 [0,0,0,0,1,0|3,0,0]=4 912 B17R2.5650 CS(=O)c1ccc(cc1)OCn2cncn2 7a_200000064373_200020645497 [0,0,0,0,1,0|3,0,0]=4 913 B17R2.5650 NC(=O)c1ccc(cc1)NCn2cncn2 34a_100000210537_200020645497 [0,0,0,0,1,0|3,0,0]=4 914 B17R2.5650 NC(=O)c1ccc(cc1)OCc2ccn[nH]2 34a_100000746352_100000728653 [0,0,0,0,1,0|3,0,0]=4 915 B17R2.5650 NC(=O)c1ccc(cc1)OCc2ccn[nH]2 7a_100000746352_100000728653 [0,0,0,0,1,0|3,0,0]=4 916 B17R2.5650 NC(=O)c1ccc(cc1)OCc2ccsc2 34a_100000746352_100011261437 [0,0,0,0,1,0|3,0,0]=4 917 B17R2.5650 NC(=O)c1ccc(cc1)OCc2ccsc2 7a_100000746352_100011261437 [0,0,0,0,1,0|3,0,0]=4 918 B17R2.5650 NC(=O)c1ccc(cc1)OCc2cncs2 34a_100000746352_100015185245 [0,0,0,0,1,0|3,0,0]=4 919 B17R2.5650 NC(=O)c1ccc(cc1)OCc2cncs2 7a_100000746352_100015185245 [0,0,0,0,1,0|3,0,0]=4 920 B17R2.5650 NC(=O)c1ccc(cc1)OCn2cncn2 34a_100000746352_200020645497 [0,0,0,0,1,0|2,0,0]=3 921 B17R2.5650 NC(=O)c1ccc(cc1)OCn2cncn2 7a_100000746352_200020645497 [0,0,0,0,1,0|2,0,0]=3 922 B17R2.5650 NC(=O)c1ccc(cc1)SCn2cncn2 62a_100000162191_200020645497 [0,0,0,0,1,0|2,1,0]=4 923 B17R2.5650 NC(=O)c1ccc(cc1)SCn2cncn2 62a_200020645497_100000162191 [0,0,0,0,1,0|2,1,0]=4 924 B17R2.5650 O=[N+]([O-])c1ccc(cc1)OCn2cncn2 34a_100000185810_200020645497 [0,0,0,0,1,0|2,0,1]=4 925 B17R2.5650 O=[N+]([O-])c1ccc(cc1)OCn2cncn2 7a_100000185810_200020645497 [0,0,0,0,1,0|2,0,1]=4 926 B19R2.8734 C=C(C)c1ccc(cc1)OCCc2cccnc2 7a_100009880102_200011713674 [0,0,0,0,0,1|3,0,0]=4 927 B19R2.8734 C=C(C)c1ccc(cc1)OCCc2ccncc2 7a_100009880102_100000723409 [0,0,0,0,0,1|3,0,0]=4 928 B19R2.8734 CC(=O)c1ccc(cc1)OCCc2ccccc2 1458a_100000396611_200000210301 [0,0,0,0,0,1|3,0,0]=4 929 B19R2.8734 CC(=O)c1ccc(cc1)OCCc2ccccc2 34a_100000185113_100000765856 [0,0,0,0,0,1|3,0,0]=4 930 B19R2.8734 CC(=O)c1ccc(cc1)OCCc2ccccc2 7a_100000185113_100000765856 [0,0,0,0,0,1|3,0,0]=4 931 B19R2.8734 CC(=O)c1ccc(cc1)OCCc2ccccn2 7a_100000185113_100015183660 [0,0,0,0,0,1|3,0,0]=4 932 B19R2.8734 CC(=O)c1ccc(cc1)OCCc2cccnc2 7a_100000185113_200011713674 [0,0,0,0,0,1|2,0,0]=3 933 B19R2.8734 CC(=O)c1ccc(cc1)OCCc2ccncc2 7a_100000185113_100000723409 [0,0,0,0,0,1|2,0,0]=3 934 B19R2.8734 CC(=O)c1ccc(cc1)SCCc2cccnc2 62a_100000185465_200011713674 [0,0,0,0,0,1|2,1,0]=4 935 B19R2.8734 CC(=O)c1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000185465 [0,0,0,0,0,1|2,1,0]=4 936 B19R2.8734 CC(=O)c1ccc(cc1)SCCc2ccncc2 62a_100000185465_100000723409 [0,0,0,0,0,1|2,1,0]=4 937 B19R2.8734 CC(=O)c1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000185465 [0,0,0,0,0,1|2,1,0]=4 938 B19R2.8734 CC(=O)c1ccc(cn1)OCCc2cccnc2 7a_100012001710_200011713674 [0,0,0,0,0,1|3,0,0]=4 939 B19R2.8734 CC(=O)c1ccc(cn1)OCCc2ccncc2 7a_100012001710_100000723409 [0,0,0,0,0,1|3,0,0]=4 940 B19R2.8734 CC(O)c1ccc(cc1)OCCc2cccnc2 7a_100000754508_200011713674 [0,0,0,0,0,1|2,0,1]=4 941 B19R2.8734 CC(O)c1ccc(cc1)OCCc2ccncc2 7a_100000754508_100000723409 [0,0,0,0,0,1|2,0,1]=4 942 B19R2.8734 CS(=O)c1ccc(cc1)OCCc2cccnc2 7a_200000064373_200011713674 [0,0,0,0,0,1|3,0,0]=4 943 B19R2.8734 CS(=O)c1ccc(cc1)OCCc2ccncc2 7a_200000064373_100000723409 [0,0,0,0,0,1|3,0,0]=4 944 B19R2.8734 NC(=O)c1ccc(cc1)NCCc2cccnc2 27a_100000736294_100000162191 [0,0,0,0,0,1|3,0,0]=4 945 B19R2.8734 NC(=O)c1ccc(cc1)NCCc2ccncc2 27a_100000742849_100000162191 [0,0,0,0,0,1|3,0,0]=4 946 B19R2.8734 NC(=O)c1ccc(cc1)NCCc2cnccn2 27a_100000723456_100000162191 [0,0,0,0,0,1|3,0,0]=4 947 B19R2.8734 NC(=O)c1ccc(cc1)OCCc2ccccc2 34a_100000746352_100000765856 [0,0,0,0,0,1|3,0,0]=4 948 B19R2.8734 NC(=O)c1ccc(cc1)OCCc2ccccc2 7a_100000746352_100000765856 [0,0,0,0,0,1|3,0,0]=4 949 B19R2.8734 NC(=O)c1ccc(cc1)OCCc2ccccn2 7a_100000746352_100015183660 [0,0,0,0,0,1|3,0,0]=4 950 B19R2.8734 NC(=O)c1ccc(cc1)OCCc2cccnc2 7a_100000746352_200011713674 [0,0,0,0,0,1|2,0,0]=3 951 B19R2.8734 NC(=O)c1ccc(cc1)OCCc2ccncc2 7a_100000746352_100000723409 [0,0,0,0,0,1|2,0,0]=3 952 B19R2.8734 NC(=O)c1ccc(cc1)SCCc2cccnc2 62a_100000162191_200011713674 [0,0,0,0,0,1|2,1,0]=4 953 B19R2.8734 NC(=O)c1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000162191 [0,0,0,0,0,1|2,1,0]=4 954 B19R2.8734 NC(=O)c1ccc(cc1)SCCc2ccncc2 62a_100000162191_100000723409 [0,0,0,0,0,1|2,1,0]=4 955 B19R2.8734 NC(=O)c1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000162191 [0,0,0,0,0,1|2,1,0]=4 956 B19R2.8734 O=C(O)c1ccc(cc1)CNCc2cccnc2 269956a_100000181780_100000733263 [0,0,0,0,0,1|3,0,0]=4 957 B19R2.8734 O=C(O)c1ccc(cc1)CNCc2ccncc2 269956a_100000181780_100015193705 [0,0,0,0,0,1|3,0,0]=4 958 B19R2.8734 O=C(O)c1ccc(cc1)CNCc2cnccn2 269956a_100000181780_100016995436 [0,0,0,0,0,1|3,0,0]=4 959 B19R2.8734 O=C(O)c1ccc(cc1)CNCc2cncnc2 269956a_100000181780_100016991940 [0,0,0,0,0,1|3,0,0]=4 960 B19R2.8734 O=[N+]([O-])c1ccc(cc1)OCCc2cccnc2 7a_100000185810_200011713674 [0,0,0,0,0,1|2,0,1]=4 961 B19R2.8734 O=[N+]([O-])c1ccc(cc1)OCCc2ccncc2 7a_100000185810_100000723409 [0,0,0,0,0,1|2,0,1]=4 962 B19R2.8734 [13CH3]C(=O)c1ccc(cc1)OCCc2ccccc2 1458a_100000396611_200025704644 [0,0,0,0,0,1|3,0,0]=4 963 B19R2.8740 C=C(C)c1ccc(cc1)OCCCn2cccc2 34a_100009880102_200009814367 [0,0,0,0,0,1|3,0,0]=4 964 B19R2.8740 C=C(C)c1ccc(cc1)OCCCn2cccc2 7a_100009880102_200009814367 [0,0,0,0,0,1|3,0,0]=4 965 B19R2.8740 C=C(C)c1ccc(cc1)OCCCn2ccnc2 34a_100009880102_100000756272 [0,0,0,0,0,1|2,0,0]=3 966 B19R2.8740 C=C(C)c1ccc(cc1)OCCCn2ccnc2 7a_100009880102_100000756272 [0,0,0,0,0,1|2,0,0]=3 967 B19R2.8740 C=C(C)c1ccc(cc1)OCCCn2cncn2 34a_100009880102_100102700105 [0,0,0,0,0,1|3,0,0]=4 968 B19R2.8740 C=C(C)c1ccc(cc1)OCCCn2cncn2 7a_100009880102_100102700105 [0,0,0,0,0,1|3,0,0]=4 969 B19R2.8740 C=C(C)c1ccc(cc1)SCCCn2ccnc2 62a_100000185454_100000756272 [0,0,0,0,0,1|2,1,0]=4 970 B19R2.8740 C=C(C)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000185454 [0,0,0,0,0,1|2,1,0]=4 971 B19R2.8740 CC(=O)c1ccc(cc1)CCSCn2cncn2 62a_200000038727_200020645497 [0,0,0,0,0,1|3,0,0]=4 972 B19R2.8740 CC(=O)c1ccc(cc1)CCSCn2cncn2 62a_200020645497_200000038727 [0,0,0,0,0,1|3,0,0]=4 973 B19R2.8740 CC(=O)c1ccc(cc1)CNCCn2cccc2 34a_100011368172_100000756337 [0,0,0,0,0,1|3,0,0]=4 974 B19R2.8740 CC(=O)c1ccc(cc1)CNCCn2cncn2 2230a_200000738561_100000756337 [0,0,0,0,0,1|3,0,0]=4 975 B19R2.8740 CC(=O)c1ccc(cc1)COCC[n+]2ccsc2 34a_200000100414_100000756337 [0,0,0,0,0,1|2,0,1]=4 976 B19R2.8740 CC(=O)c1ccc(cc1)COCCc2ccsc2 34a_100000748821_100000756337 [0,0,0,0,0,1|3,0,0]=4 977 B19R2.8740 CC(=O)c1ccc(cc1)COCCc2cn[nH]c2 34a_100000766553_100000756337 [0,0,0,0,0,1|3,0,0]=4 978 B19R2.8740 CC(=O)c1ccc(cc1)COCCc2cn[nH]c2 7a_100000082505_100000743252 [0,0,0,0,0,1|3,0,0]=4 979 B19R2.8740 CC(=O)c1ccc(cc1)COCCc2cnoc2 34a_100000732699_100000756337 [0,0,0,0,0,1|3,0,0]=4 980 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2cccc2 34a_100000179382_100000756337 [0,0,0,0,0,1|2,0,0]=3 981 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2cccc2 7a_100000082505_200000035178 [0,0,0,0,0,1|2,0,0]=3 982 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2cccn2 34a_100000743371_100000756337 [0,0,0,0,0,1|3,0,0]=4 983 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2cccn2 7a_100000082505_100000685285 [0,0,0,0,0,1|3,0,0]=4 984 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000756337 [0,0,0,0,0,1|1,0,0]=2 985 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2ccnc2 7a_100000082505_100000702546 [0,0,0,0,0,1|1,0,0]=2 986 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2ccnn2 34a_100000080814_100000756337 [0,0,0,0,0,1|2,0,0]=3 987 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2cncn2 34a_100000745309_100000756337 [0,0,0,0,0,1|2,0,0]=3 988 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2cncn2 7a_100000082505_100000731791 [0,0,0,0,0,1|2,0,0]=3 989 B19R2.8740 CC(=O)c1ccc(cc1)COCCn2cnnc2 34a_200011637517_100000756337 [0,0,0,0,0,1|2,0,0]=3 990 B19R2.8740 CC(=O)c1ccc(cc1)CSCCn2cccc2 62a_100000756337_200000035178 [0,0,0,0,0,1|2,1,0]=4 991 B19R2.8740 CC(=O)c1ccc(cc1)CSCCn2cccc2 62a_200009811947_100000756337 [0,0,0,0,0,1|2,1,0]=4 992 B19R2.8740 CC(=O)c1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000756337 [0,0,0,0,0,1|1,1,0]=3 993 B19R2.8740 CC(=O)c1ccc(cc1)CSCCn2ccnc2 62a_100000756337_100000702546 [0,0,0,0,0,1|1,1,0]=3 994 B19R2.8740 CC(=O)c1ccc(cc1)CSCCn2cncn2 62a_100000731791_100000756337 [0,0,0,0,0,1|2,1,0]=4 995 B19R2.8740 CC(=O)c1ccc(cc1)CSCCn2cncn2 62a_100000756337_100000731791 [0,0,0,0,0,1|2,1,0]=4 996 B19R2.8740 CC(=O)c1ccc(cc1)OCCCn2cccc2 34a_100000185113_200009814367 [0,0,0,0,0,1|2,0,0]=3 997 B19R2.8740 CC(=O)c1ccc(cc1)OCCCn2cccc2 7a_100000185113_200009814367 [0,0,0,0,0,1|2,0,0]=3 998 B19R2.8740 CC(=O)c1ccc(cc1)OCCCn2cccn2 7a_100000185113_100000739983 [0,0,0,0,0,1|3,0,0]=4 999 B19R2.8740 CC(=O)c1ccc(cc1)OCCCn2ccnc2 34a_100000185113_100000756272 [0,0,0,0,0,1|1,0,0]=2 1000 B19R2.8740 CC(=O)c1ccc(cc1)OCCCn2ccnc2 7a_100000185113_100000756272 [0,0,0,0,0,1|1,0,0]=2 1001 B19R2.8740 CC(=O)c1ccc(cc1)OCCCn2cncn2 34a_100000185113_100102700105 [0,0,0,0,0,1|2,0,0]=3 1002 B19R2.8740 CC(=O)c1ccc(cc1)OCCCn2cncn2 7a_100000185113_100102700105 [0,0,0,0,0,1|2,0,0]=3 1003 B19R2.8740 CC(=O)c1ccc(cc1)SCCCn2cccc2 62a_100000185465_200009814367 [0,0,0,0,0,1|2,1,0]=4 1004 B19R2.8740 CC(=O)c1ccc(cc1)SCCCn2cccc2 62a_200009814367_100000185465 [0,0,0,0,0,1|2,1,0]=4 1005 B19R2.8740 CC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000185465_100000756272 [0,0,0,0,0,1|1,1,0]=3 1006 B19R2.8740 CC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000185465 [0,0,0,0,0,1|1,1,0]=3 1007 B19R2.8740 CC(=O)c1ccc(cc1)SCCCn2cncn2 62a_100000185465_100102700105 [0,0,0,0,0,1|2,1,0]=4 1008 B19R2.8740 CC(=O)c1ccc(cc1)SCCCn2cncn2 62a_100102700105_100000185465 [0,0,0,0,0,1|2,1,0]=4 1009 B19R2.8740 CC(=O)c1ccc(cn1)OCCCn2cccc2 34a_100012001710_200009814367 [0,0,0,0,0,1|3,0,0]=4 1010 B19R2.8740 CC(=O)c1ccc(cn1)OCCCn2cccc2 7a_100012001710_200009814367 [0,0,0,0,0,1|3,0,0]=4 1011 B19R2.8740 CC(=O)c1ccc(cn1)OCCCn2ccnc2 34a_100012001710_100000756272 [0,0,0,0,0,1|2,0,0]=3 1012 B19R2.8740 CC(=O)c1ccc(cn1)OCCCn2ccnc2 7a_100012001710_100000756272 [0,0,0,0,0,1|2,0,0]=3 1013 B19R2.8740 CC(=O)c1ccc(cn1)OCCCn2cncn2 34a_100012001710_100102700105 [0,0,0,0,0,1|3,0,0]=4 1014 B19R2.8740 CC(=O)c1ccc(cn1)OCCCn2cncn2 7a_100012001710_100102700105 [0,0,0,0,0,1|3,0,0]=4 1015 B19R2.8740 CC(=O)c1ccc(cn1)SCCCn2ccnc2 62a_100000686046_100000756272 [0,0,0,0,0,1|2,1,0]=4 1016 B19R2.8740 CC(=O)c1ccc(cn1)SCCCn2ccnc2 62a_100000756272_100000686046 [0,0,0,0,0,1|2,1,0]=4 1017 B19R2.8740 CC(=O)c1ccc(nc1)NCCCn2ccnc2 27a_100000210438_100000690552 [0,0,0,0,0,1|3,0,0]=4 1018 B19R2.8740 CC(=O)c1ccc(nc1)SCCCn2ccnc2 62a_100000684857_100000756272 [0,0,0,0,0,1|2,1,0]=4 1019 B19R2.8740 CC(=O)c1ccc(nc1)SCCCn2ccnc2 62a_100000756272_100000684857 [0,0,0,0,0,1|2,1,0]=4 1020 B19R2.8740 CC(C)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000181262 [0,0,0,0,0,1|2,0,1]=4 1021 B19R2.8740 CC(C)c1ccc(cc1)COCCn2ccnc2 7a_100000181325_100000702546 [0,0,0,0,0,1|2,0,1]=4 1022 B19R2.8740 CC(C)c1ccc(cc1)OCCCn2ccnc2 34a_100000181308_100000756272 [0,0,0,0,0,1|2,0,1]=4 1023 B19R2.8740 CC(C)c1ccc(cc1)OCCCn2ccnc2 7a_100000181308_100000756272 [0,0,0,0,0,1|2,0,1]=4 1024 B19R2.8740 CC(O)c1ccc(cc1)NCCCn2ccnc2 2230a_100011216399_100000756272 [0,0,0,0,0,1|2,0,1]=4 1025 B19R2.8740 CC(O)c1ccc(cc1)NCCCn2ccnc2 34a_100011216399_100000756272 [0,0,0,0,0,1|2,0,1]=4 1026 B19R2.8740 CC(O)c1ccc(cc1)OCCCn2cccc2 34a_100000754508_200009814367 [0,0,0,0,0,1|2,0,1]=4 1027 B19R2.8740 CC(O)c1ccc(cc1)OCCCn2cccc2 7a_100000754508_200009814367 [0,0,0,0,0,1|2,0,1]=4 1028 B19R2.8740 CC(O)c1ccc(cc1)OCCCn2ccnc2 34a_100000754508_100000756272 [0,0,0,0,0,1|1,0,1]=3 1029 B19R2.8740 CC(O)c1ccc(cc1)OCCCn2ccnc2 7a_100000754508_100000756272 [0,0,0,0,0,1|1,0,1]=3 1030 B19R2.8740 CC(O)c1ccc(cc1)OCCCn2cncn2 34a_100000754508_100102700105 [0,0,0,0,0,1|2,0,1]=4 1031 B19R2.8740 CC(O)c1ccc(cc1)OCCCn2cncn2 7a_100000754508_100102700105 [0,0,0,0,0,1|2,0,1]=4 1032 B19R2.8740 CC(O)c1ccc(cc1)SCCCn2ccnc2 62a_100000745893_100000756272 [0,0,0,0,0,1|1,1,1]=4 1033 B19R2.8740 CC(O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000745893 [0,0,0,0,0,1|1,1,1]=4 1034 B19R2.8740 CN(C)c1ccc(cc1)OCCCn2ccnc2 34a_100000718910_100000756272 [0,0,0,0,0,1|3,0,0]=4 1035 B19R2.8740 CS(=O)c1ccc(cc1)OCCCn2cccc2 34a_200000064373_200009814367 [0,0,0,0,0,1|3,0,0]=4 1036 B19R2.8740 CS(=O)c1ccc(cc1)OCCCn2cccc2 7a_200000064373_200009814367 [0,0,0,0,0,1|3,0,0]=4 1037 B19R2.8740 CS(=O)c1ccc(cc1)OCCCn2ccnc2 34a_200000064373_100000756272 [0,0,0,0,0,1|2,0,0]=3 1038 B19R2.8740 CS(=O)c1ccc(cc1)OCCCn2ccnc2 7a_200000064373_100000756272 [0,0,0,0,0,1|2,0,0]=3 1039 B19R2.8740 CS(=O)c1ccc(cc1)OCCCn2cncn2 34a_200000064373_100102700105 [0,0,0,0,0,1|3,0,0]=4 1040 B19R2.8740 CS(=O)c1ccc(cc1)OCCCn2cncn2 7a_200000064373_100102700105 [0,0,0,0,0,1|3,0,0]=4 1041 B19R2.8740 CS(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100009816266_100000756272 [0,0,0,0,0,1|2,1,0]=4 1042 B19R2.8740 C[C@H](N)c1ccc(cc1)OCCCn2ccnc2 34a_100161106496_100000756272 [0,0,0,0,0,1|2,0,1]=4 1043 B19R2.8740 C[S+](C)c1ccc(cc1)OCCCn2ccnc2 34a_100010188728_100000756272 [0,0,0,0,0,1|3,0,0]=4 1044 B19R2.8740 C[S+](C)c1ccc(cc1)OCCCn2ccnc2 7a_100010188728_100000756272 [0,0,0,0,0,1|3,0,0]=4 1045 B19R2.8740 FC(F)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_200012343607 [0,0,0,0,0,1|2,0,1]=4 1046 B19R2.8740 NC(=O)c1ccc(cc1)CNCCn2cccc2 207a_100011368172_100000038677 [0,0,0,0,0,1|3,0,0]=4 1047 B19R2.8740 NC(=O)c1ccc(cc1)CNCCn2cccc2 270004a_100011368172_100000038677 [0,0,0,0,0,1|3,0,0]=4 1048 B19R2.8740 NC(=O)c1ccc(cc1)CNCCn2cccc2 34a_100011368172_100000231043 [0,0,0,0,0,1|3,0,0]=4 1049 B19R2.8740 NC(=O)c1ccc(cc1)CNCCn2ccnc2 207a_100000230061_100000038677 [0,0,0,0,0,1|2,0,0]=3 1050 B19R2.8740 NC(=O)c1ccc(cc1)CNCCn2ccnc2 270004a_100000230061_100000038677 [0,0,0,0,0,1|2,0,0]=3 1051 B19R2.8740 NC(=O)c1ccc(cc1)CNCCn2cncn2 207a_200000738561_100000038677 [0,0,0,0,0,1|3,0,0]=4 1052 B19R2.8740 NC(=O)c1ccc(cc1)CNCCn2cncn2 2230a_200000738561_100000231043 [0,0,0,0,0,1|3,0,0]=4 1053 B19R2.8740 NC(=O)c1ccc(cc1)CNCCn2cncn2 270004a_200000738561_100000038677 [0,0,0,0,0,1|3,0,0]=4 1054 B19R2.8740 NC(=O)c1ccc(cc1)COCC[n+]2ccsc2 34a_200000100414_100000231043 [0,0,0,0,0,1|2,0,1]=4 1055 B19R2.8740 NC(=O)c1ccc(cc1)COCCc2ccsc2 34a_100000748821_100000231043 [0,0,0,0,0,1|3,0,0]=4 1056 B19R2.8740 NC(=O)c1ccc(cc1)COCCc2cn[nH]c2 34a_100000766553_100000231043 [0,0,0,0,0,1|3,0,0]=4 1057 B19R2.8740 NC(=O)c1ccc(cc1)COCCc2cn[nH]c2 7a_100000162016_100000743252 [0,0,0,0,0,1|3,0,0]=4 1058 B19R2.8740 NC(=O)c1ccc(cc1)COCCc2cnoc2 34a_100000732699_100000231043 [0,0,0,0,0,1|3,0,0]=4 1059 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cccc2 34a_100000179382_100000231043 [0,0,0,0,0,1|2,0,0]=3 1060 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cccc2 7a_100000162016_200000035178 [0,0,0,0,0,1|2,0,0]=3 1061 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cccn2 34a_100000162016_100015204718 [0,0,0,0,0,1|3,0,0]=4 1062 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cccn2 34a_100000743371_100000231043 [0,0,0,0,0,1|3,0,0]=4 1063 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cccn2 7a_100000162016_100000685285 [0,0,0,0,0,1|3,0,0]=4 1064 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000231043 [0,0,0,0,0,1|1,0,0]=2 1065 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2ccnc2 7a_100000162016_100000702546 [0,0,0,0,0,1|1,0,0]=2 1066 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2ccnn2 34a_100000080814_100000231043 [0,0,0,0,0,1|2,0,0]=3 1067 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cncn2 34a_100000162016_200000749826 [0,0,0,0,0,1|2,0,0]=3 1068 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cncn2 34a_100000745309_100000231043 [0,0,0,0,0,1|2,0,0]=3 1069 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cncn2 7a_100000162016_100000731791 [0,0,0,0,0,1|2,0,0]=3 1070 B19R2.8740 NC(=O)c1ccc(cc1)COCCn2cnnc2 34a_200011637517_100000231043 [0,0,0,0,0,1|2,0,0]=3 1071 B19R2.8740 NC(=O)c1ccc(cc1)CSCCn2cccc2 62a_100000231043_200000035178 [0,0,0,0,0,1|2,1,0]=4 1072 B19R2.8740 NC(=O)c1ccc(cc1)CSCCn2cccc2 62a_200009811947_100000231043 [0,0,0,0,0,1|2,1,0]=4 1073 B19R2.8740 NC(=O)c1ccc(cc1)CSCCn2ccnc2 62a_100000231043_100000702546 [0,0,0,0,0,1|1,1,0]=3 1074 B19R2.8740 NC(=O)c1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000231043 [0,0,0,0,0,1|1,1,0]=3 1075 B19R2.8740 NC(=O)c1ccc(cc1)CSCCn2cncn2 62a_100000231043_100000731791 [0,0,0,0,0,1|2,1,0]=4 1076 B19R2.8740 NC(=O)c1ccc(cc1)CSCCn2cncn2 62a_100000731791_100000231043 [0,0,0,0,0,1|2,1,0]=4 1077 B19R2.8740 NC(=O)c1ccc(cc1)NCCCn2cccc2 34a_100000210537_200009814367 [0,0,0,0,0,1|3,0,0]=4 1078 B19R2.8740 NC(=O)c1ccc(cc1)NCCCn2ccnc2 27a_100000210438_100000162191 [0,0,0,0,0,1|2,0,0]=3 1079 B19R2.8740 NC(=O)c1ccc(cc1)NCCCn2ccnc2 34a_100000210537_100000756272 [0,0,0,0,0,1|2,0,0]=3 1080 B19R2.8740 NC(=O)c1ccc(cc1)NCCCn2cncn2 27a_100015184301_100000162191 [0,0,0,0,0,1|3,0,0]=4 1081 B19R2.8740 NC(=O)c1ccc(cc1)NCCCn2cncn2 34a_100000210537_100102700105 [0,0,0,0,0,1|3,0,0]=4 1082 B19R2.8740 NC(=O)c1ccc(cc1)OCCCn2cccc2 34a_100000746352_200009814367 [0,0,0,0,0,1|2,0,0]=3 1083 B19R2.8740 NC(=O)c1ccc(cc1)OCCCn2cccc2 7a_100000746352_200009814367 [0,0,0,0,0,1|2,0,0]=3 1084 B19R2.8740 NC(=O)c1ccc(cc1)OCCCn2cccn2 7a_100000746352_100000739983 [0,0,0,0,0,1|3,0,0]=4 1085 B19R2.8740 NC(=O)c1ccc(cc1)OCCCn2ccnc2 34a_100000746352_100000756272 [0,0,0,0,0,1|1,0,0]=2 1086 B19R2.8740 NC(=O)c1ccc(cc1)OCCCn2ccnc2 7a_100000746352_100000756272 [0,0,0,0,0,1|1,0,0]=2 1087 B19R2.8740 NC(=O)c1ccc(cc1)OCCCn2cncn2 34a_100000746352_100102700105 [0,0,0,0,0,1|2,0,0]=3 1088 B19R2.8740 NC(=O)c1ccc(cc1)OCCCn2cncn2 7a_100000746352_100102700105 [0,0,0,0,0,1|2,0,0]=3 1089 B19R2.8740 NC(=O)c1ccc(cc1)SCCCn2cccc2 62a_100000162191_200009814367 [0,0,0,0,0,1|2,1,0]=4 1090 B19R2.8740 NC(=O)c1ccc(cc1)SCCCn2cccc2 62a_200009814367_100000162191 [0,0,0,0,0,1|2,1,0]=4 1091 B19R2.8740 NC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000162191_100000756272 [0,0,0,0,0,1|1,1,0]=3 1092 B19R2.8740 NC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000162191 [0,0,0,0,0,1|1,1,0]=3 1093 B19R2.8740 NC(=O)c1ccc(cc1)SCCCn2cncn2 62a_100000162191_100102700105 [0,0,0,0,0,1|2,1,0]=4 1094 B19R2.8740 NC(=O)c1ccc(cc1)SCCCn2cncn2 62a_100102700105_100000162191 [0,0,0,0,0,1|2,1,0]=4 1095 B19R2.8740 NC(=O)c1ccc(cn1)SCCCn2ccnc2 62a_100000756272_100011219284 [0,0,0,0,0,1|2,1,0]=4 1096 B19R2.8740 NC(=O)c1ccc(cn1)SCCCn2ccnc2 62a_100011219284_100000756272 [0,0,0,0,0,1|2,1,0]=4 1097 B19R2.8740 NC(=O)c1ccc(nc1)NCCCn2ccnc2 27a_100000210438_100000162237 [0,0,0,0,0,1|3,0,0]=4 1098 B19R2.8740 NC(=O)c1ccc(nc1)SCCCn2ccnc2 62a_100000162237_100000756272 [0,0,0,0,0,1|2,1,0]=4 1099 B19R2.8740 NC(=O)c1ccc(nc1)SCCCn2ccnc2 62a_100000756272_100000162237 [0,0,0,0,0,1|2,1,0]=4 1100 B19R2.8740 O=C(O)c1ccc(cc1)CCNCc2ccn[nH]2 269956a_100000704756_100000728653 [0,0,0,0,0,1|3,0,0]=4 1101 B19R2.8740 O=C(O)c1ccc(cc1)CCNCc2ccsc2 269956a_100000704756_100011261437 [0,0,0,0,0,1|3,0,0]=4 1102 B19R2.8740 O=C(O)c1ccc(cc1)CCNCc2cncs2 269956a_100000704756_100015185245 [0,0,0,0,0,1|3,0,0]=4 1103 B19R2.8740 O=C(O)c1ccc(cc1)CCNCn2cncn2 269956a_100000704756_200020645497 [0,0,0,0,0,1|2,0,0]=3 1104 B19R2.8740 O=C(O)c1ccc(cc1)CNCCc2cn[nH]c2 269956a_100000181780_100000743252 [0,0,0,0,0,1|3,0,0]=4 1105 B19R2.8740 O=C(O)c1ccc(cc1)CNCCn2cccc2 269956a_100000181780_200000035178 [0,0,0,0,0,1|2,0,0]=3 1106 B19R2.8740 O=C(O)c1ccc(cc1)CNCCn2cccn2 269956a_100000181780_100000685285 [0,0,0,0,0,1|3,0,0]=4 1107 B19R2.8740 O=C(O)c1ccc(cc1)CNCCn2ccnc2 269956a_100000181780_100000702546 [0,0,0,0,0,1|1,0,0]=2 1108 B19R2.8740 O=C(O)c1ccc(cc1)CNCCn2cncn2 269956a_100000181780_100000731791 [0,0,0,0,0,1|2,0,0]=3 1109 B19R2.8740 O=C(O)c1ccc(cn1)CNCCn2cccc2 269956a_100000762669_200000035178 [0,0,0,0,0,1|3,0,0]=4 1110 B19R2.8740 O=C(O)c1ccc(cn1)CNCCn2ccnc2 269956a_100000762669_100000702546 [0,0,0,0,0,1|2,0,0]=3 1111 B19R2.8740 O=C(O)c1ccc(cn1)CNCCn2cncn2 269956a_100000762669_100000731791 [0,0,0,0,0,1|3,0,0]=4 1112 B19R2.8740 O=[N+]([O-])c1ccc(cc1)CNCCn2ccnc2 207a_100000230061_100000189386 [0,0,0,0,0,1|2,0,1]=4 1113 B19R2.8740 O=[N+]([O-])c1ccc(cc1)CNCCn2ccnc2 270004a_100000230061_100000189386 [0,0,0,0,0,1|2,0,1]=4 1114 B19R2.8740 O=[N+]([O-])c1ccc(cc1)COCCn2cccc2 34a_100000179382_100000181861 [0,0,0,0,0,1|2,0,1]=4 1115 B19R2.8740 O=[N+]([O-])c1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000181861 [0,0,0,0,0,1|1,0,1]=3 1116 B19R2.8740 O=[N+]([O-])c1ccc(cc1)COCCn2ccnn2 34a_100000080814_100000181861 [0,0,0,0,0,1|2,0,1]=4 1117 B19R2.8740 O=[N+]([O-])c1ccc(cc1)COCCn2cncn2 34a_100000211695_200000749826 [0,0,0,0,0,1|2,0,1]=4 1118 B19R2.8740 O=[N+]([O-])c1ccc(cc1)COCCn2cncn2 34a_100000745309_100000181861 [0,0,0,0,0,1|2,0,1]=4 1119 B19R2.8740 O=[N+]([O-])c1ccc(cc1)COCCn2cnnc2 34a_200011637517_100000181861 [0,0,0,0,0,1|2,0,1]=4 1120 B19R2.8740 O=[N+]([O-])c1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000184243 [0,0,0,0,0,1|1,1,1]=4 1121 B19R2.8740 O=[N+]([O-])c1ccc(cc1)NCCCn2ccnc2 2230a_100015195142_100000756272 [0,0,0,0,0,1|2,0,1]=4 1122 B19R2.8740 O=[N+]([O-])c1ccc(cc1)NCCCn2ccnc2 34a_100015195142_100000756272 [0,0,0,0,0,1|2,0,1]=4 1123 B19R2.8740 O=[N+]([O-])c1ccc(cc1)OCCCn2cccc2 34a_100000185810_200009814367 [0,0,0,0,0,1|2,0,1]=4 1124 B19R2.8740 O=[N+]([O-])c1ccc(cc1)OCCCn2cccc2 7a_100000185810_200009814367 [0,0,0,0,0,1|2,0,1]=4 1125 B19R2.8740 O=[N+]([O-])c1ccc(cc1)OCCCn2ccnc2 34a_100000185810_100000756272 [0,0,0,0,0,1|1,0,1]=3 1126 B19R2.8740 O=[N+]([O-])c1ccc(cc1)OCCCn2ccnc2 7a_100000185810_100000756272 [0,0,0,0,0,1|1,0,1]=3 1127 B19R2.8740 O=[N+]([O-])c1ccc(cc1)OCCCn2cncn2 34a_100000185810_100102700105 [0,0,0,0,0,1|2,0,1]=4 1128 B19R2.8740 O=[N+]([O-])c1ccc(cc1)OCCCn2cncn2 7a_100000185810_100102700105 [0,0,0,0,0,1|2,0,1]=4 1129 B19R2.8740 O=[N+]([O-])c1ccc(cn1)OCCCn2ccnc2 7a_100000060138_100000756272 [0,0,0,0,0,1|2,0,1]=4 1130 B19R2.8740 OB(O)c1ccc(cc1)COCCn2cccc2 34a_100000179382_100009813762 [0,0,0,0,0,1|2,0,1]=4 1131 B19R2.8740 OB(O)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_100009813762 [0,0,0,0,0,1|1,0,1]=3 1132 B19R2.8740 OB(O)c1ccc(cc1)COCCn2ccnn2 34a_100000080814_100009813762 [0,0,0,0,0,1|2,0,1]=4 1133 B19R2.8740 OB(O)c1ccc(cc1)COCCn2cncn2 34a_100000745309_100009813762 [0,0,0,0,0,1|2,0,1]=4 1134 B19R2.8740 OB(O)c1ccc(cc1)COCCn2cnnc2 34a_200011637517_100009813762 [0,0,0,0,0,1|2,0,1]=4 1135 B19R2.8740 OB(O)c1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100009813762 [0,0,0,0,0,1|1,1,1]=4 1136 B19R2.8740 OB(O)c1ccc(cc1)CSCCn2ccnc2 62a_100009813762_100000702546 [0,0,0,0,0,1|1,1,1]=4 1137 B19R2.8740 OB(O)c1ccc(cc1)SCCCn2ccnc2 62a_100000754493_100000756272 [0,0,0,0,0,1|1,1,1]=4 1138 B19R2.8740 OB(O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000754493 [0,0,0,0,0,1|1,1,1]=4 1139 B19R2.13473 BrC(=Cc1ccc(cc1)SCCn2ccnc2)Br 62a_100000702546_200013992848 [0,0,0,0,0,1|2,1,0]=4 1140 B19R2.13473 BrC(=Cc1ccc(cc1)SCCn2ccnc2)Br 62a_200013992848_100000702546 [0,0,0,0,0,1|2,1,0]=4 1141 B19R2.13473 CC(=Cc1ccc(cc1)OCCn2ccnc2)C 271570a_100102525489_100015186965 [0,0,0,0,0,1|2,0,0]=3 1142 B19R2.13473 CC(=O)Cc1ccc(cc1)OCCc2cn[nH]c2 7a_100011218180_100000743252 [0,0,0,0,0,1|3,0,0]=4 1143 B19R2.13473 CC(=O)Cc1ccc(cc1)OCCn2cccc2 7a_100011218180_200000035178 [0,0,0,0,0,1|2,0,0]=3 1144 B19R2.13473 CC(=O)Cc1ccc(cc1)OCCn2cccn2 34a_100011218180_100015204718 [0,0,0,0,0,1|3,0,0]=4 1145 B19R2.13473 CC(=O)Cc1ccc(cc1)OCCn2cccn2 7a_100011218180_100000685285 [0,0,0,0,0,1|3,0,0]=4 1146 B19R2.13473 CC(=O)Cc1ccc(cc1)OCCn2ccnc2 7a_100011218180_100000702546 [0,0,0,0,0,1|1,0,0]=2 1147 B19R2.13473 CC(=O)Cc1ccc(cc1)OCCn2cncn2 34a_100011218180_200000749826 [0,0,0,0,0,1|2,0,0]=3 1148 B19R2.13473 CC(=O)Cc1ccc(cc1)OCCn2cncn2 7a_100011218180_100000731791 [0,0,0,0,0,1|2,0,0]=3 1149 B19R2.13473 CC(=O)Cc1ccc(cc1)SCCn2cccc2 62a_100000691760_200000035178 [0,0,0,0,0,1|2,1,0]=4 1150 B19R2.13473 CC(=O)Cc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000691760 [0,0,0,0,0,1|2,1,0]=4 1151 B19R2.13473 CC(=O)Cc1ccc(cc1)SCCn2ccnc2 62a_100000691760_100000702546 [0,0,0,0,0,1|1,1,0]=3 1152 B19R2.13473 CC(=O)Cc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000691760 [0,0,0,0,0,1|1,1,0]=3 1153 B19R2.13473 CC(=O)Cc1ccc(cc1)SCCn2cncn2 62a_100000691760_100000731791 [0,0,0,0,0,1|2,1,0]=4 1154 B19R2.13473 CC(=O)Cc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000691760 [0,0,0,0,0,1|2,1,0]=4 1155 B19R2.13473 CC(=O)Nc1ccc(cc1)NCCn2cncn2 34a_100000184111_200000749826 [0,0,0,0,0,1|3,0,0]=4 1156 B19R2.13473 CC(=O)Nc1ccc(cc1)OCCc2cn[nH]c2 7a_100000184395_100000743252 [0,0,0,0,0,1|3,0,0]=4 1157 B19R2.13473 CC(=O)Nc1ccc(cc1)OCCn2cccc2 7a_100000184395_200000035178 [0,0,0,0,0,1|2,0,0]=3 1158 B19R2.13473 CC(=O)Nc1ccc(cc1)OCCn2cccn2 34a_100000184395_100015204718 [0,0,0,0,0,1|3,0,0]=4 1159 B19R2.13473 CC(=O)Nc1ccc(cc1)OCCn2cccn2 7a_100000184395_100000685285 [0,0,0,0,0,1|3,0,0]=4 1160 B19R2.13473 CC(=O)Nc1ccc(cc1)OCCn2ccnc2 7a_100000184395_100000702546 [0,0,0,0,0,1|1,0,0]=2 1161 B19R2.13473 CC(=O)Nc1ccc(cc1)OCCn2cncn2 34a_100000184395_200000749826 [0,0,0,0,0,1|2,0,0]=3 1162 B19R2.13473 CC(=O)Nc1ccc(cc1)OCCn2cncn2 7a_100000184395_100000731791 [0,0,0,0,0,1|2,0,0]=3 1163 B19R2.13473 CC(=O)Nc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000155215 [0,0,0,0,0,1|2,1,0]=4 1164 B19R2.13473 CC(=O)Nc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000155215 [0,0,0,0,0,1|1,1,0]=3 1165 B19R2.13473 CC(=O)Nc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000155215 [0,0,0,0,0,1|2,1,0]=4 1166 B19R2.13473 CC(=O)Nc1ccc(cn1)OCCn2cccc2 7a_200000094647_200000035178 [0,0,0,0,0,1|3,0,0]=4 1167 B19R2.13473 CC(=O)Nc1ccc(cn1)OCCn2ccnc2 7a_200000094647_100000702546 [0,0,0,0,0,1|2,0,0]=3 1168 B19R2.13473 CC(=O)Nc1ccc(cn1)OCCn2cncn2 34a_200000094647_200000749826 [0,0,0,0,0,1|3,0,0]=4 1169 B19R2.13473 CC(=O)Nc1ccc(cn1)OCCn2cncn2 7a_200000094647_100000731791 [0,0,0,0,0,1|3,0,0]=4 1170 B19R2.13473 CC(=O)Nc1ccc(cn1)SCCn2ccnc2 62a_100000702546_100000193312 [0,0,0,0,0,1|2,1,0]=4 1171 B19R2.13473 CC(=O)Nc1ccc(nc1)SCCn2ccnc2 62a_100000702546_100011934715 [0,0,0,0,0,1|2,1,0]=4 1172 B19R2.13473 CC(=O)Oc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000002173 [0,0,0,0,0,1|2,1,0]=4 1173 B19R2.13473 CC(=O)Oc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000002173 [0,0,0,0,0,1|1,1,0]=3 1174 B19R2.13473 CC(=O)Oc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000002173 [0,0,0,0,0,1|2,1,0]=4 1175 B19R2.13473 CC(=O)Sc1ccc(cc1)SCCn2cccc2 62a_200009995050_200000035178 [0,0,0,0,0,1|2,1,0]=4 1176 B19R2.13473 CC(=O)Sc1ccc(cc1)SCCn2ccnc2 62a_200009995050_100000702546 [0,0,0,0,0,1|1,1,0]=3 1177 B19R2.13473 CC(=O)Sc1ccc(cc1)SCCn2cncn2 62a_200009995050_100000731791 [0,0,0,0,0,1|2,1,0]=4 1178 B19R2.13473 CC(=S)Oc1ccc(cc1)SCCn2ccnc2 62a_100000702546_200009816735 [0,0,0,0,0,1|1,2,0]=4 1179 B19R2.13473 CC(C)Oc1ccc(cc1)OCCn2ccnc2 7a_100000757185_100000702546 [0,0,0,0,0,1|2,0,1]=4 1180 B19R2.13473 CC(C)Sc1ccc(cc1)OCCn2ccnc2 62a_100000210206_100015186965 [0,0,0,0,0,1|2,0,1]=4 1181 B19R2.13473 CC(C)Sc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100000210206 [0,0,0,0,0,1|2,0,1]=4 1182 B19R2.13473 CN(C)Cc1ccc(cc1)OCCn2ccnc2 270004a_100102631434_100015187263 [0,0,0,0,0,1|3,0,0]=4 1183 B19R2.13473 FC(=Cc1ccc(cc1)SCCn2ccnc2)F 62a_100000702546_200009816947 [0,0,0,0,0,1|2,1,0]=4 1184 B19R2.13473 FC(=Cc1ccc(cc1)SCCn2ccnc2)F 62a_200009816947_100000702546 [0,0,0,0,0,1|2,1,0]=4 1185 B19R2.13473 FC(F)Oc1ccc(cc1)OCCn2ccnc2 7a_100011217645_100000702546 [0,0,0,0,0,1|2,0,1]=4 1186 B19R2.13473 NC(=O)Cc1ccc(cc1)NCCn2cccc2 2230a_100000738315_200009811947 [0,0,0,0,0,1|3,0,0]=4 1187 B19R2.13473 NC(=O)Cc1ccc(cc1)NCCn2cncn2 2230a_100000738315_100000731791 [0,0,0,0,0,1|3,0,0]=4 1188 B19R2.13473 NC(=O)Cc1ccc(cc1)NCCn2cncn2 34a_100000738315_200000749826 [0,0,0,0,0,1|3,0,0]=4 1189 B19R2.13473 NC(=O)Cc1ccc(cc1)OCCn2cccn2 34a_100000020825_100015204718 [0,0,0,0,0,1|3,0,0]=4 1190 B19R2.13473 NC(=O)Cc1ccc(cc1)OCCn2cncn2 34a_100000020825_200000749826 [0,0,0,0,0,1|2,0,0]=3 1191 B19R2.13473 NC(=O)Cc1ccc(cc1)SCCn2cccc2 62a_100000162331_200000035178 [0,0,0,0,0,1|2,1,0]=4 1192 B19R2.13473 NC(=O)Cc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000162331 [0,0,0,0,0,1|2,1,0]=4 1193 B19R2.13473 NC(=O)Cc1ccc(cc1)SCCn2ccnc2 62a_100000162331_100000702546 [0,0,0,0,0,1|1,1,0]=3 1194 B19R2.13473 NC(=O)Cc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000162331 [0,0,0,0,0,1|1,1,0]=3 1195 B19R2.13473 NC(=O)Cc1ccc(cc1)SCCn2cncn2 62a_100000162331_100000731791 [0,0,0,0,0,1|2,1,0]=4 1196 B19R2.13473 NC(=O)Cc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000162331 [0,0,0,0,0,1|2,1,0]=4 1197 B19R2.13473 NC(=O)Cc1ccc(cn1)SCCn2ccnc2 62a_100000702546_200010888337 [0,0,0,0,0,1|2,1,0]=4 1198 B19R2.13473 NC(=O)Cc1ccc(cn1)SCCn2ccnc2 62a_200010888337_100000702546 [0,0,0,0,0,1|2,1,0]=4 1199 B19R2.13473 NC(=O)Cc1ccc(nc1)SCCn2ccnc2 62a_100000702546_200000071513 [0,0,0,0,0,1|2,1,0]=4 1200 B19R2.13473 NC(=O)Cc1ccc(nc1)SCCn2ccnc2 62a_200000071513_100000702546 [0,0,0,0,0,1|2,1,0]=4 1201 B19R2.13473 NC(=O)Nc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000198584 [0,0,0,0,0,1|2,1,0]=4 1202 B19R2.13473 NC(=O)Nc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000198584 [0,0,0,0,0,1|1,1,0]=3 1203 B19R2.13473 NC(=O)Nc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000198584 [0,0,0,0,0,1|2,1,0]=4 1204 B19R2.13473 O=C(O)Cc1ccc(cc1)CNCn2cncn2 269956a_100016989728_200020645497 [0,0,0,0,0,1|3,0,0]=4 1205 B16R1.260 C=CCCNCCOc1ccc(cc1)C=O 2230a_100015191253_100000040479 [1,0,1,0,0,0|1,0,1]=4 1206 B16R1.1402 C=CCCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000754431 [1,0,1,0,0,0|1,0,1]=4 1207 B16R1.1402 C=CCNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100000210623 [1,0,1,0,0,0|0,0,1]=3 1208 B16R1.1402 O=CCNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_200015260668 [1,0,1,0,0,0|1,0,1]=4 1209 B16R2.135 Brc1ccc(cc1)OCCn2cccc2 7a_100000185759_200000035178 [2,0,0,0,0,0|2,0,0]=4 1210 B16R2.135 Brc1ccc(cc1)OCCn2ccnc2 7a_100000185759_100000702546 [2,0,0,0,0,0|1,0,0]=3 1211 B16R2.135 Brc1ccc(cc1)OCCn2cncn2 34a_100000185759_200000749826 [2,0,0,0,0,0|2,0,0]=4 1212 B16R2.135 Brc1ccc(cc1)OCCn2cncn2 7a_100000185759_100000731791 [2,0,0,0,0,0|2,0,0]=4 1213 B16R2.135 Brc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000752885 [2,0,0,0,0,0|1,1,0]=4 1214 B16R2.135 Brc1ccc(cc1)SCCn2ccnc2 62a_100000752885_100000702546 [2,0,0,0,0,0|1,1,0]=4 1215 B16R2.135 Brc1ccc(cn1)OCCn2ccnc2 7a_100000685995_100000702546 [2,0,0,0,0,0|2,0,0]=4 1216 B16R2.135 Cc1ccc(cc1)OCCn2cccc2 7a_100000210336_200000035178 [2,0,0,0,0,0|1,0,1]=4 1217 B16R2.135 Cc1ccc(cc1)OCCn2ccnc2 7a_100000210336_100000702546 [2,0,0,0,0,0|0,0,1]=3 1218 B16R2.135 Cc1ccc(cc1)OCCn2cncn2 34a_100000210336_200000749826 [2,0,0,0,0,0|1,0,1]=4 1219 B16R2.135 Cc1ccc(cc1)OCCn2cncn2 7a_100000210336_100000731791 [2,0,0,0,0,0|1,0,1]=4 1220 B16R2.135 Cc1ccc(cc1)SCCn2ccnc2 62a_100000186775_100000702546 [2,0,0,0,0,0|0,1,1]=4 1221 B16R2.135 Cc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000186775 [2,0,0,0,0,0|0,1,1]=4 1222 B16R2.135 Cc1ccc(cn1)OCCn2ccnc2 7a_100000745506_100000702546 [2,0,0,0,0,0|1,0,1]=4 1223 B16R2.135 Clc1ccc(cc1)OCCn2cccc2 7a_100000210216_200000035178 [2,0,0,0,0,0|2,0,0]=4 1224 B16R2.135 Clc1ccc(cc1)OCCn2ccnc2 7a_100000210216_100000702546 [2,0,0,0,0,0|1,0,0]=3 1225 B16R2.135 Clc1ccc(cc1)OCCn2cncn2 34a_100000210216_200000749826 [2,0,0,0,0,0|2,0,0]=4 1226 B16R2.135 Clc1ccc(cc1)OCCn2cncn2 7a_100000210216_100000731791 [2,0,0,0,0,0|2,0,0]=4 1227 B16R2.135 Clc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000755918 [2,0,0,0,0,0|1,1,0]=4 1228 B16R2.135 Clc1ccc(cc1)SCCn2ccnc2 62a_100000755918_100000702546 [2,0,0,0,0,0|1,1,0]=4 1229 B16R2.135 Clc1ccc(cn1)OCCn2ccnc2 7a_100000744096_100000702546 [2,0,0,0,0,0|2,0,0]=4 1230 B16R2.135 Fc1ccc(cc1)OCCn2cncn2 34a_100000210339_200000749826 [2,0,0,0,0,0|2,0,0]=4 1231 B16R2.135 Fc1ccc(cc1)SCCn2ccnc2 62a_100000211213_100000702546 [2,0,0,0,0,0|1,1,0]=4 1232 B16R2.135 Fc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000211213 [2,0,0,0,0,0|1,1,0]=4 1233 B16R2.135 Fc1ccc(cn1)OCCn2ccnc2 7a_100000688820_100000702546 [2,0,0,0,0,0|2,0,0]=4 1234 B16R2.135 Ic1ccc(cc1)OCCn2cccc2 7a_100000212066_200000035178 [2,0,0,0,0,0|2,0,0]=4 1235 B16R2.135 Ic1ccc(cc1)OCCn2ccnc2 7a_100000212066_100000702546 [2,0,0,0,0,0|1,0,0]=3 1236 B16R2.135 Ic1ccc(cc1)OCCn2cncn2 34a_100000212066_200000749826 [2,0,0,0,0,0|2,0,0]=4 1237 B16R2.135 Ic1ccc(cc1)OCCn2cncn2 7a_100000212066_100000731791 [2,0,0,0,0,0|2,0,0]=4 1238 B16R2.135 Ic1ccc(cn1)OCCn2ccnc2 7a_100000687607_100000702546 [2,0,0,0,0,0|2,0,0]=4 1239 B16R2.135 Nc1ccc(cc1)OCCn2cncn2 34a_100000185829_200000749826 [2,0,0,0,0,0|2,0,0]=4 1240 B16R2.135 Nc1ccc(cc1)SCCn2ccnc2 62a_100000185761_100000702546 [2,0,0,0,0,0|1,1,0]=4 1241 B16R2.135 Nc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000185761 [2,0,0,0,0,0|1,1,0]=4 1242 B16R2.135 Nc1ccc(cn1)OCCn2ccnc2 7a_100015188713_100000702546 [2,0,0,0,0,0|2,0,0]=4 1243 B16R2.135 O=c1ccc(c[nH]1)OCCn2cncn2 34a_100000075641_200000749826 [2,0,0,0,0,0|2,0,0]=4 1244 B16R2.135 O=c1ccc(c[nH]1)SCCn2ccnc2 62a_100000212171_100000702546 [2,0,0,0,0,0|1,1,0]=4 1245 B16R2.135 O=c1ccc(c[nH]1)SCCn2ccnc2 62a_100000702546_100000212171 [2,0,0,0,0,0|1,1,0]=4 1246 B16R2.135 Oc1ccc(cc1)NCCn2cncn2 34a_100000185829_200000749826 [2,0,0,0,0,0|2,0,0]=4 1247 B16R2.135 Oc1ccc(cc1)OCCn2cccn2 271570a_203496583355_200011487139 [2,0,0,0,0,0|2,0,0]=4 1248 B16R2.135 Oc1ccc(cc1)OCCn2ccnc2 271570a_203496583355_100015186965 [2,0,0,0,0,0|0,0,0]=2 1249 B16R2.135 Oc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000185759 [2,0,0,0,0,0|1,1,0]=4 1250 B16R2.135 Oc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000185759 [2,0,0,0,0,0|0,1,0]=3 1251 B16R2.135 Oc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000185759 [2,0,0,0,0,0|1,1,0]=4 1252 B16R2.135 Oc1ccc(nc1)SCCn2ccnc2 62a_100000685995_100000702546 [2,0,0,0,0,0|1,1,0]=4 1253 B16R2.135 Oc1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000744096 [2,0,0,0,0,0|1,1,0]=4 1254 B18R1.291 C=CCCCNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100011713584 [0,1,1,0,0,0|1,0,1]=4 1255 B18R1.291 C=COCCNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100000039644 [0,1,1,0,0,0|1,0,1]=4 1256 B18R1.291 CC/C=C\CNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100103147603 [0,1,1,0,0,0|1,0,1]=4 1257 B18R1.322 C=CCCNCCOc1ccc(cc1)C(=O)OC 2230a_100015191253_100000742590 [0,1,1,0,0,0|1,0,1]=4 1258 B18R1.1159 C=CC(O)CNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100000730141 [0,1,1,0,0,0|1,0,1]=4 1259 B18R1.20890 C=C(C)CCNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100000730704 [0,1,1,0,0,0|1,0,1]=4 1260 B18R2.59 Cc1cn(nn1)CCOc2ccc(cc2)C=O 274090a_100000040479_200000242740 [1,1,0,0,0,0|1,0,0]=3 1261 B18R2.77 C=Cc1ccc(cc1)OCC(C)n2cncn2 34a_100000189437_200015185000 [1,1,0,0,0,0|2,0,0]=4 1262 B18R2.77 C=Cc1ccc(cc1)OCC(C)n2cncn2 7a_100000189437_200015185000 [1,1,0,0,0,0|2,0,0]=4 1263 B18R2.77 CC(COc1ccc(cc1)CO)n2cncn2 34a_100000211755_200015185000 [1,1,0,0,0,0|1,0,1]=4 1264 B18R2.77 CC(CSc1ccc(cc1)C=O)n2cncn2 62a_100000188517_200015185000 [1,1,0,0,0,0|1,1,0]=4 1265 B18R2.77 CC(CSc1ccc(cc1)C=O)n2cncn2 62a_200015185000_100000188517 [1,1,0,0,0,0|1,1,0]=4 1266 B18R2.90 O=Cc1ccc(cc1)CC(=O)Cn2ccnc2 1458a_100000739072_100000075337 [1,1,0,0,0,0|1,0,1]=4 1267 B18R2.91 C=Cc1ccc(cc1)OCCn2ccnc2C 7a_100000189437_100000742477 [1,1,0,0,0,0|1,0,0]=3 1268 B18R2.91 C=Cc1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000748128 [1,1,0,0,0,0|1,1,0]=4 1269 B18R2.91 C=Cc1ccc(cc1)SCCn2ccnc2C 62a_100000748128_100000742477 [1,1,0,0,0,0|1,1,0]=4 1270 B18R2.91 CCc1ccc(cc1)OCCn2ccnc2C 7a_100000211359_100000742477 [1,1,0,0,0,0|1,0,1]=4 1271 B18R2.91 Cc1nccn1CCNc2ccc(cc2)CO 2230a_100011215238_100000742477 [1,1,0,0,0,0|1,0,1]=4 1272 B18R2.91 Cc1nccn1CCOc2ccc(cc2)C#N 7a_100000210344_100000742477 [1,1,0,0,0,0|1,0,1]=4 1273 B18R2.91 Cc1nccn1CCSc2ccc(cc2)C=O 62a_100000188517_100000742477 [1,1,0,0,0,0|0,1,0]=3 1274 B18R2.91 Cc1nccn1CCSc2ccc(cc2)C=O 62a_100000742477_100000188517 [1,1,0,0,0,0|0,1,0]=3 1275 B18R2.91 Cc1nccn1CCSc2ccc(cc2)CO 62a_100000690907_100000742477 [1,1,0,0,0,0|0,1,1]=4 1276 B18R2.91 Cc1nccn1CCSc2ccc(cc2)CO 62a_100000742477_100000690907 [1,1,0,0,0,0|0,1,1]=4 1277 B18R2.91 Cc1nccn1CCSc2ccc(cn2)C=O 62a_100000742477_100000766901 [1,1,0,0,0,0|1,1,0]=4 1278 B18R2.91 Cc1nccn1CCSc2ccc(cn2)C=O 62a_100000766901_100000742477 [1,1,0,0,0,0|1,1,0]=4 1279 B18R2.91 Cc1nccn1CCSc2ccc(nc2)C=O 62a_100000742477_100000754260 [1,1,0,0,0,0|1,1,0]=4 1280 B18R2.91 Cc1nccn1CCSc2ccc(nc2)C=O 62a_100000754260_100000742477 [1,1,0,0,0,0|1,1,0]=4 1281 B18R2.100 C=Cc1ccc(cc1)C(=O)CCn2ccnc2 1458a_100000687532_100000702546 [1,1,0,0,0,0|2,0,0]=4 1282 B18R2.100 O=C(CCn1ccnc1)c2ccc(cc2)CO 1458a_100000183892_100000702546 [1,1,0,0,0,0|1,0,1]=4 1283 B18R2.3176 CCc1ccc(c(c1)Br)OCCn2ccnc2 7a_100012339963_100000702546 [1,1,0,0,0,0|1,0,1]=4 1284 B18R2.3176 CCc1ccc(c(c1)N)OCCn2ccnc2 7a_100000765835_100000702546 [1,1,0,0,0,0|1,0,1]=4 1285 B18R2.3176 COc1ccc(c(c1)Br)OCCn2ccnc2 7a_100000685887_100000702546 [1,1,0,0,0,0|2,0,0]=4 1286 B18R2.3176 COc1ccc(c(c1)C)OCCn2ccnc2 7a_100012002223_100000702546 [1,1,0,0,0,0|2,0,0]=4 1287 B18R2.3176 COc1ccc(c(c1)Cl)OCCn2ccnc2 7a_100000038596_100000702546 [1,1,0,0,0,0|2,0,0]=4 1288 B18R2.3176 COc1ccc(c(c1)F)OCCn2ccnc2 7a_100000036999_100000702546 [1,1,0,0,0,0|2,0,0]=4 1289 B18R2.3176 Cc1cc(ccc1OCCn2cccc2)CO 7a_100000075815_200000035178 [1,1,0,0,0,0|1,0,1]=4 1290 B18R2.3176 Cc1cc(ccc1OCCn2ccnc2)C#N 7a_100000749339_100000702546 [1,1,0,0,0,0|1,0,1]=4 1291 B18R2.3176 Cc1cc(ccc1OCCn2ccnc2)CO 7a_100000075815_100000702546 [1,1,0,0,0,0|0,0,1]=3 1292 B18R2.3176 Cc1cc(ccc1OCCn2cncn2)CO 34a_100000075815_200000749826 [1,1,0,0,0,0|1,0,1]=4 1293 B18R2.3176 Cc1cc(ccc1OCCn2cncn2)CO 7a_100000075815_100000731791 [1,1,0,0,0,0|1,0,1]=4 1294 B18R2.3176 Cc1cc(ccc1SCCn2cccc2)C=O 62a_100000765772_200000035178 [1,1,0,0,0,0|1,1,0]=4 1295 B18R2.3176 Cc1cc(ccc1SCCn2cccc2)C=O 62a_200009811947_100000765772 [1,1,0,0,0,0|1,1,0]=4 1296 B18R2.3176 Cc1cc(ccc1SCCn2ccnc2)C=O 62a_100000702546_100000765772 [1,1,0,0,0,0|0,1,0]=3 1297 B18R2.3176 Cc1cc(ccc1SCCn2ccnc2)C=O 62a_100000765772_100000702546 [1,1,0,0,0,0|0,1,0]=3 1298 B18R2.3176 Cc1cc(ccc1SCCn2ccnc2)CO 62a_100000702546_100000718852 [1,1,0,0,0,0|0,1,1]=4 1299 B18R2.3176 Cc1cc(ccc1SCCn2ccnc2)CO 62a_100000718852_100000702546 [1,1,0,0,0,0|0,1,1]=4 1300 B18R2.3176 Cc1cc(ccc1SCCn2cncn2)C=O 62a_100000731791_100000765772 [1,1,0,0,0,0|1,1,0]=4 1301 B18R2.3176 Cc1cc(ccc1SCCn2cncn2)C=O 62a_100000765772_100000731791 [1,1,0,0,0,0|1,1,0]=4 1302 B18R2.3176 Cc1cc(cnc1SCCn2ccnc2)C=O 62a_100000070293_100000702546 [1,1,0,0,0,0|1,1,0]=4 1303 B18R2.3176 Cc1cc(cnc1SCCn2ccnc2)C=O 62a_100000702546_100000070293 [1,1,0,0,0,0|1,1,0]=4 1304 B18R2.3176 Cc1cc(ncc1SCCn2ccnc2)C=O 62a_100000702546_100009814806 [1,1,0,0,0,0|1,1,0]=4 1305 B18R2.3176 Cc1cc(ncc1SCCn2ccnc2)C=O 62a_100009814806_100000702546 [1,1,0,0,0,0|1,1,0]=4 1306 B18R2.3176 Cc1nc(ccc1SCCn2ccnc2)C=O 62a_100000702546_100010238520 [1,1,0,0,0,0|1,1,0]=4 1307 B18R2.3176 Cc1nc(ccc1SCCn2ccnc2)C=O 62a_100010238520_100000702546 [1,1,0,0,0,0|1,1,0]=4 1308 B18R2.3176 N#Cc1ccc(c(c1)Br)OCCn2ccnc2 7a_100011216086_100000702546 [1,1,0,0,0,0|1,0,1]=4 1309 B18R2.3176 N#Cc1ccc(c(c1)Cl)OCCn2ccnc2 7a_100000205955_100000702546 [1,1,0,0,0,0|1,0,1]=4 1310 B18R2.3176 N#Cc1ccc(c(c1)F)OCCn2ccnc2 7a_100000751310_100000702546 [1,1,0,0,0,0|1,0,1]=4 1311 B18R2.3176 N#Cc1ccc(c(c1)I)OCCn2ccnc2 7a_100000725478_100000702546 [1,1,0,0,0,0|1,0,1]=4 1312 B18R2.3176 N#Cc1ccc(c(c1)N)OCCn2ccnc2 7a_100000766272_100000702546 [1,1,0,0,0,0|1,0,1]=4 1313 B18R2.3176 Nc1cc(ccc1OCCn2cncn2)CO 34a_100000123545_200000749826 [1,1,0,0,0,0|1,0,1]=4 1314 B18R2.3176 Nc1cc(ccc1SCCn2ccnc2)CO 62a_100000702546_100012347568 [1,1,0,0,0,0|0,1,1]=4 1315 B18R2.3176 Nc1cc(ccc1SCCn2ccnc2)CO 62a_100012347568_100000702546 [1,1,0,0,0,0|0,1,1]=4 1316 B18R2.3176 O=Cc1ccc(c(c1)F)SCCn2cccc2 62a_100000686674_200000035178 [1,1,0,0,0,0|1,1,0]=4 1317 B18R2.3176 O=Cc1ccc(c(c1)F)SCCn2cccc2 62a_200009811947_100000686674 [1,1,0,0,0,0|1,1,0]=4 1318 B18R2.3176 O=Cc1ccc(c(c1)F)SCCn2ccnc2 62a_100000686674_100000702546 [1,1,0,0,0,0|0,1,0]=3 1319 B18R2.3176 O=Cc1ccc(c(c1)F)SCCn2ccnc2 62a_100000702546_100000686674 [1,1,0,0,0,0|0,1,0]=3 1320 B18R2.3176 O=Cc1ccc(c(c1)F)SCCn2cncn2 62a_100000686674_100000731791 [1,1,0,0,0,0|1,1,0]=4 1321 B18R2.3176 O=Cc1ccc(c(c1)F)SCCn2cncn2 62a_100000731791_100000686674 [1,1,0,0,0,0|1,1,0]=4 1322 B18R2.3176 O=Cc1ccc(c(c1)O)SCCn2cccc2 62a_100000041418_200000035178 [1,1,0,0,0,0|1,1,0]=4 1323 B18R2.3176 O=Cc1ccc(c(c1)O)SCCn2cccc2 62a_200009811947_100000041418 [1,1,0,0,0,0|1,1,0]=4 1324 B18R2.3176 O=Cc1ccc(c(c1)O)SCCn2ccnc2 62a_100000041418_100000702546 [1,1,0,0,0,0|0,1,0]=3 1325 B18R2.3176 O=Cc1ccc(c(c1)O)SCCn2ccnc2 62a_100000702546_100000041418 [1,1,0,0,0,0|0,1,0]=3 1326 B18R2.3176 O=Cc1ccc(c(c1)O)SCCn2cncn2 62a_100000041418_100000731791 [1,1,0,0,0,0|1,1,0]=4 1327 B18R2.3176 O=Cc1ccc(c(c1)O)SCCn2cncn2 62a_100000731791_100000041418 [1,1,0,0,0,0|1,1,0]=4 1328 B18R2.3176 O=Cc1cnc(c(c1)F)SCCn2ccnc2 62a_100000702546_100009866847 [1,1,0,0,0,0|1,1,0]=4 1329 B18R2.3176 O=Cc1cnc(c(c1)F)SCCn2ccnc2 62a_100009866847_100000702546 [1,1,0,0,0,0|1,1,0]=4 1330 B18R2.3176 OCc1ccc(c(c1)Br)OCCn2cccc2 7a_100011191544_200000035178 [1,1,0,0,0,0|1,0,1]=4 1331 B18R2.3176 OCc1ccc(c(c1)Br)OCCn2ccnc2 7a_100011191544_100000702546 [1,1,0,0,0,0|0,0,1]=3 1332 B18R2.3176 OCc1ccc(c(c1)Br)OCCn2cncn2 34a_100011191544_200000749826 [1,1,0,0,0,0|1,0,1]=4 1333 B18R2.3176 OCc1ccc(c(c1)Br)OCCn2cncn2 7a_100011191544_100000731791 [1,1,0,0,0,0|1,0,1]=4 1334 B18R2.3176 OCc1ccc(c(c1)Cl)SCCn2ccnc2 62a_100000702546_100000718186 [1,1,0,0,0,0|0,1,1]=4 1335 B18R2.3176 OCc1ccc(c(c1)Cl)SCCn2ccnc2 62a_100000718186_100000702546 [1,1,0,0,0,0|0,1,1]=4 1336 B18R2.3176 OCc1ccc(c(c1)F)SCCn2ccnc2 62a_100000702546_100011533735 [1,1,0,0,0,0|0,1,1]=4 1337 B18R2.3176 OCc1ccc(c(c1)F)SCCn2ccnc2 62a_100011533735_100000702546 [1,1,0,0,0,0|0,1,1]=4 1338 B18R2.3176 OCc1ccc(c(c1)O)SCCn2ccnc2 62a_100000049605_100000702546 [1,1,0,0,0,0|0,1,1]=4 1339 B18R2.3176 OCc1ccc(c(c1)O)SCCn2ccnc2 62a_100000702546_100000049605 [1,1,0,0,0,0|0,1,1]=4 1340 B18R2.3176 OCc1ccc(c(n1)Br)OCCn2ccnc2 7a_200009817064_100000702546 [1,1,0,0,0,0|1,0,1]=4 1341 B18R2.3176 OCc1ccc(c(n1)Cl)OCCn2ccnc2 7a_200000118097_100000702546 [1,1,0,0,0,0|1,0,1]=4 1342 B18R2.3844 Br/C=C/c1ccc(cc1)SCCn2ccnc2 62a_100000702546_200016255901 [1,1,0,0,0,0|1,1,0]=4 1343 B18R2.3844 Br/C=C/c1ccc(cc1)SCCn2ccnc2 62a_200016255901_100000702546 [1,1,0,0,0,0|1,1,0]=4 1344 B18R2.3844 BrCCc1ccc(cc1)OCCn2ccnc2 7a_100009816426_100000702546 [1,1,0,0,0,0|1,0,1]=4 1345 B18R2.3844 C/C=C/c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100016259036 [1,1,0,0,0,0|1,1,0]=4 1346 B18R2.3844 C/C=C/c1ccc(cc1)SCCn2ccnc2 62a_100016259036_100000702546 [1,1,0,0,0,0|1,1,0]=4 1347 B18R2.3844 C=C=Cc1ccc(cc1)OCCn2ccnc2 271570a_100015277604_100015186965 [1,1,0,0,0,0|1,0,0]=3 1348 B18R2.3844 C=CCc1ccc(cc1)OCCn2cccc2 7a_100000078792_200000035178 [1,1,0,0,0,0|2,0,0]=4 1349 B18R2.3844 C=CCc1ccc(cc1)OCCn2ccnc2 7a_100000078792_100000702546 [1,1,0,0,0,0|1,0,0]=3 1350 B18R2.3844 C=CCc1ccc(cc1)OCCn2cncn2 34a_100000078792_200000749826 [1,1,0,0,0,0|2,0,0]=4 1351 B18R2.3844 C=CCc1ccc(cc1)OCCn2cncn2 7a_100000078792_100000731791 [1,1,0,0,0,0|2,0,0]=4 1352 B18R2.3844 C=COc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000704263 [1,1,0,0,0,0|1,1,0]=4 1353 B18R2.3844 C=COc1ccc(cc1)SCCn2ccnc2 62a_100000704263_100000702546 [1,1,0,0,0,0|1,1,0]=4 1354 B18R2.3844 CC=Cc1ccc(cc1)OCCn2ccnc2 271570a_100016259895_100015186965 [1,1,0,0,0,0|1,0,0]=3 1355 B18R2.3844 CCCc1ccc(cc1)OCCn2ccnc2 7a_100000749406_100000702546 [1,1,0,0,0,0|1,0,1]=4 1356 B18R2.3844 CCNc1ccc(cc1)OCCn2ccnc2 7a_100011337800_100000702546 [1,1,0,0,0,0|1,0,1]=4 1357 B18R2.3844 CCSc1ccc(cc1)OCCn2ccnc2 62a_100000210202_100015186965 [1,1,0,0,0,0|1,0,1]=4 1358 B18R2.3844 CCSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100000210202 [1,1,0,0,0,0|1,0,1]=4 1359 B18R2.3844 CNCc1ccc(cc1)OCCn2ccnc2 207a_100102657272_100015187263 [1,1,0,0,0,0|1,0,1]=4 1360 B18R2.3844 CNCc1ccc(cc1)OCCn2ccnc2 270004a_106832991635_100015187263 [1,1,0,0,0,0|1,0,1]=4 1361 B18R2.3844 COCc1ccc(cc1)OCCn2cccc2 7a_200011995677_200000035178 [1,1,0,0,0,0|1,0,1]=4 1362 B18R2.3844 COCc1ccc(cc1)OCCn2ccnc2 7a_200011995677_100000702546 [1,1,0,0,0,0|0,0,1]=3 1363 B18R2.3844 COCc1ccc(cc1)OCCn2cncn2 34a_200011995677_200000749826 [1,1,0,0,0,0|1,0,1]=4 1364 B18R2.3844 COCc1ccc(cc1)OCCn2cncn2 7a_200011995677_100000731791 [1,1,0,0,0,0|1,0,1]=4 1365 B18R2.3844 COCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100011493685 [1,1,0,0,0,0|0,1,1]=4 1366 B18R2.3844 COCc1ccc(cc1)SCCn2ccnc2 62a_100011493685_100000702546 [1,1,0,0,0,0|0,1,1]=4 1367 B18R2.3844 FCSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100015361967 [1,1,0,0,0,0|1,0,1]=4 1368 B18R2.3844 FCSc1ccc(cc1)OCCn2ccnc2 62a_100015361967_100015186965 [1,1,0,0,0,0|1,0,1]=4 1369 B18R2.3844 N#CCc1ccc(cc1)OCCn2ccnc2 7a_100000198970_100000702546 [1,1,0,0,0,0|1,0,1]=4 1370 B18R2.3844 O=CCc1ccc(cc1)SCCn2cccc2 62a_100011361690_200000035178 [1,1,0,0,0,0|1,1,0]=4 1371 B18R2.3844 O=CCc1ccc(cc1)SCCn2cccc2 62a_200009811947_100011361690 [1,1,0,0,0,0|1,1,0]=4 1372 B18R2.3844 O=CCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100011361690 [1,1,0,0,0,0|0,1,0]=3 1373 B18R2.3844 O=CCc1ccc(cc1)SCCn2ccnc2 62a_100011361690_100000702546 [1,1,0,0,0,0|0,1,0]=3 1374 B18R2.3844 O=CCc1ccc(cc1)SCCn2cncn2 62a_100000731791_100011361690 [1,1,0,0,0,0|1,1,0]=4 1375 B18R2.3844 O=CCc1ccc(cc1)SCCn2cncn2 62a_100011361690_100000731791 [1,1,0,0,0,0|1,1,0]=4 1376 B18R2.3844 OCCc1ccc(cc1)OCCn2cccc2 7a_100011215338_200000035178 [1,1,0,0,0,0|1,0,1]=4 1377 B18R2.3844 OCCc1ccc(cc1)OCCn2ccnc2 7a_100011215338_100000702546 [1,1,0,0,0,0|0,0,1]=3 1378 B18R2.3844 OCCc1ccc(cc1)OCCn2cncn2 34a_100011215338_200000749826 [1,1,0,0,0,0|1,0,1]=4 1379 B18R2.3844 OCCc1ccc(cc1)OCCn2cncn2 7a_100011215338_100000731791 [1,1,0,0,0,0|1,0,1]=4 1380 B18R2.3844 OCCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000766406 [1,1,0,0,0,0|0,1,1]=4 1381 B18R2.3844 OCCc1ccc(cc1)SCCn2ccnc2 62a_100000766406_100000702546 [1,1,0,0,0,0|0,1,1]=4 1382 B18R2.18851 C=Cc1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100011935271 [1,1,0,0,0,0|1,1,0]=4 1383 B18R2.18851 C=Cc1ccc(cc1F)SCCn2ccnc2 62a_100011935271_100000702546 [1,1,0,0,0,0|1,1,0]=4 1384 B18R2.18851 CCc1ccc(cc1Cl)OCCn2ccnc2 7a_100009886192_100000702546 [1,1,0,0,0,0|1,0,1]=4 1385 B18R2.18851 CNc1ccc(cc1C)OCCn2ccnc2 7a_100161107805_100000702546 [1,1,0,0,0,0|2,0,0]=4 1386 B18R2.18851 COc1ccc(cc1Br)OCCn2ccnc2 7a_100010234764_100000702546 [1,1,0,0,0,0|2,0,0]=4 1387 B18R2.18851 COc1ccc(cc1C)OCCn2ccnc2 7a_100000759738_100000702546 [1,1,0,0,0,0|2,0,0]=4 1388 B18R2.18851 COc1ccc(cc1Cl)OCCn2ccnc2 7a_200009861682_100000702546 [1,1,0,0,0,0|2,0,0]=4 1389 B18R2.18851 COc1ccc(cc1F)OCCn2ccnc2 7a_100000746305_100000702546 [1,1,0,0,0,0|2,0,0]=4 1390 B18R2.18851 COc1ccc(cc1I)OCCn2ccnc2 7a_100010084122_100000702546 [1,1,0,0,0,0|2,0,0]=4 1391 B18R2.18851 Cc1cc(ccc1C#N)OCCn2ccnc2 7a_100000720286_100000702546 [1,1,0,0,0,0|1,0,1]=4 1392 B18R2.18851 Cc1cc(ccc1C=O)SCCn2cccc2 62a_100000766358_200000035178 [1,1,0,0,0,0|1,1,0]=4 1393 B18R2.18851 Cc1cc(ccc1C=O)SCCn2cccc2 62a_200009811947_100000766358 [1,1,0,0,0,0|1,1,0]=4 1394 B18R2.18851 Cc1cc(ccc1C=O)SCCn2ccnc2 62a_100000702546_100000766358 [1,1,0,0,0,0|0,1,0]=3 1395 B18R2.18851 Cc1cc(ccc1C=O)SCCn2ccnc2 62a_100000766358_100000702546 [1,1,0,0,0,0|0,1,0]=3 1396 B18R2.18851 Cc1cc(ccc1C=O)SCCn2cncn2 62a_100000731791_100000766358 [1,1,0,0,0,0|1,1,0]=4 1397 B18R2.18851 Cc1cc(ccc1C=O)SCCn2cncn2 62a_100000766358_100000731791 [1,1,0,0,0,0|1,1,0]=4 1398 B18R2.18851 Cc1cc(ccc1CO)SCCn2ccnc2 62a_100000702546_100000748258 [1,1,0,0,0,0|0,1,1]=4 1399 B18R2.18851 Cc1cc(ccc1CO)SCCn2ccnc2 62a_100000748258_100000702546 [1,1,0,0,0,0|0,1,1]=4 1400 B18R2.18851 Cc1cc(cnc1C=O)SCCn2ccnc2 62a_100000702546_100010185443 [1,1,0,0,0,0|1,1,0]=4 1401 B18R2.18851 Cc1cc(cnc1C=O)SCCn2ccnc2 62a_100010185443_100000702546 [1,1,0,0,0,0|1,1,0]=4 1402 B18R2.18851 Cc1cc(ncc1C=O)SCCn2ccnc2 62a_100000085382_100000702546 [1,1,0,0,0,0|1,1,0]=4 1403 B18R2.18851 Cc1cc(ncc1C=O)SCCn2ccnc2 62a_100000702546_100000085382 [1,1,0,0,0,0|1,1,0]=4 1404 B18R2.18851 Cc1nc(ccc1C=O)SCCn2ccnc2 62a_100000050599_100000702546 [1,1,0,0,0,0|1,1,0]=4 1405 B18R2.18851 Cc1nc(ccc1C=O)SCCn2ccnc2 62a_100000702546_100000050599 [1,1,0,0,0,0|1,1,0]=4 1406 B18R2.18851 N#Cc1ccc(cc1Br)OCCn2ccnc2 7a_100012184851_100000702546 [1,1,0,0,0,0|1,0,1]=4 1407 B18R2.18851 N#Cc1ccc(cc1Cl)OCCn2ccnc2 7a_100000716493_100000702546 [1,1,0,0,0,0|1,0,1]=4 1408 B18R2.18851 N#Cc1ccc(cc1F)OCCn2ccnc2 7a_100000753931_100000702546 [1,1,0,0,0,0|1,0,1]=4 1409 B18R2.18851 Nc1cc(ccc1C=O)SCCn2cccc2 62a_100009814810_200000035178 [1,1,0,0,0,0|1,1,0]=4 1410 B18R2.18851 Nc1cc(ccc1C=O)SCCn2ccnc2 62a_100009814810_100000702546 [1,1,0,0,0,0|0,1,0]=3 1411 B18R2.18851 Nc1cc(ccc1C=O)SCCn2cncn2 62a_100009814810_100000731791 [1,1,0,0,0,0|1,1,0]=4 1412 B18R2.18851 Nc1cc(ccc1CO)SCCn2ccnc2 62a_100000702546_100000718831 [1,1,0,0,0,0|0,1,1]=4 1413 B18R2.18851 Nc1cc(ccc1CO)SCCn2ccnc2 62a_100000718831_100000702546 [1,1,0,0,0,0|0,1,1]=4 1414 B18R2.18851 Nc1cc(ncc1C=O)SCCn2ccnc2 62a_100000050503_100000702546 [1,1,0,0,0,0|1,1,0]=4 1415 B18R2.18851 Nc1cc(ncc1C=O)SCCn2ccnc2 62a_100000702546_100000050503 [1,1,0,0,0,0|1,1,0]=4 1416 B18R2.18851 O=Cc1ccc(cc1Br)SCCn2cccc2 62a_100010185650_200000035178 [1,1,0,0,0,0|1,1,0]=4 1417 B18R2.18851 O=Cc1ccc(cc1Br)SCCn2cccc2 62a_200009811947_100010185650 [1,1,0,0,0,0|1,1,0]=4 1418 B18R2.18851 O=Cc1ccc(cc1Br)SCCn2ccnc2 62a_100000702546_100010185650 [1,1,0,0,0,0|0,1,0]=3 1419 B18R2.18851 O=Cc1ccc(cc1Br)SCCn2ccnc2 62a_100010185650_100000702546 [1,1,0,0,0,0|0,1,0]=3 1420 B18R2.18851 O=Cc1ccc(cc1Br)SCCn2cncn2 62a_100000731791_100010185650 [1,1,0,0,0,0|1,1,0]=4 1421 B18R2.18851 O=Cc1ccc(cc1Br)SCCn2cncn2 62a_100010185650_100000731791 [1,1,0,0,0,0|1,1,0]=4 1422 B18R2.18851 O=Cc1ccc(cc1Cl)SCCn2cccc2 62a_100000727542_200000035178 [1,1,0,0,0,0|1,1,0]=4 1423 B18R2.18851 O=Cc1ccc(cc1Cl)SCCn2cccc2 62a_200009811947_100000727542 [1,1,0,0,0,0|1,1,0]=4 1424 B18R2.18851 O=Cc1ccc(cc1Cl)SCCn2ccnc2 62a_100000702546_100000727542 [1,1,0,0,0,0|0,1,0]=3 1425 B18R2.18851 O=Cc1ccc(cc1Cl)SCCn2ccnc2 62a_100000727542_100000702546 [1,1,0,0,0,0|0,1,0]=3 1426 B18R2.18851 O=Cc1ccc(cc1Cl)SCCn2cncn2 62a_100000727542_100000731791 [1,1,0,0,0,0|1,1,0]=4 1427 B18R2.18851 O=Cc1ccc(cc1Cl)SCCn2cncn2 62a_100000731791_100000727542 [1,1,0,0,0,0|1,1,0]=4 1428 B18R2.18851 O=Cc1ccc(cc1F)SCCn2cccc2 62a_100000211676_200000035178 [1,1,0,0,0,0|1,1,0]=4 1429 B18R2.18851 O=Cc1ccc(cc1F)SCCn2cccc2 62a_200009811947_100000211676 [1,1,0,0,0,0|1,1,0]=4 1430 B18R2.18851 O=Cc1ccc(cc1F)SCCn2ccnc2 62a_100000211676_100000702546 [1,1,0,0,0,0|0,1,0]=3 1431 B18R2.18851 O=Cc1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100000211676 [1,1,0,0,0,0|0,1,0]=3 1432 B18R2.18851 O=Cc1ccc(cc1F)SCCn2cncn2 62a_100000211676_100000731791 [1,1,0,0,0,0|1,1,0]=4 1433 B18R2.18851 O=Cc1ccc(cc1F)SCCn2cncn2 62a_100000731791_100000211676 [1,1,0,0,0,0|1,1,0]=4 1434 B18R2.18851 O=Cc1ccc(cc1O)SCCn2cccc2 62a_100011277552_200000035178 [1,1,0,0,0,0|1,1,0]=4 1435 B18R2.18851 O=Cc1ccc(cc1O)SCCn2cccc2 62a_200009811947_100011277552 [1,1,0,0,0,0|1,1,0]=4 1436 B18R2.18851 O=Cc1ccc(cc1O)SCCn2ccnc2 62a_100000702546_100011277552 [1,1,0,0,0,0|0,1,0]=3 1437 B18R2.18851 O=Cc1ccc(cc1O)SCCn2ccnc2 62a_100011277552_100000702546 [1,1,0,0,0,0|0,1,0]=3 1438 B18R2.18851 O=Cc1ccc(cc1O)SCCn2cncn2 62a_100000731791_100011277552 [1,1,0,0,0,0|1,1,0]=4 1439 B18R2.18851 O=Cc1ccc(cc1O)SCCn2cncn2 62a_100011277552_100000731791 [1,1,0,0,0,0|1,1,0]=4 1440 B18R2.18851 O=Cc1ccc(nc1F)NCCn2ccnc2 27a_100000230061_100010064369 [1,1,0,0,0,0|2,0,0]=4 1441 B18R2.18851 O=Cc1ccc(nc1F)SCCn2ccnc2 62a_100000702546_100010064369 [1,1,0,0,0,0|1,1,0]=4 1442 B18R2.18851 O=Cc1ccc(nc1F)SCCn2ccnc2 62a_100010064369_100000702546 [1,1,0,0,0,0|1,1,0]=4 1443 B18R2.18851 O=Cc1ncc(cc1F)SCCn2ccnc2 62a_100000702546_100010180630 [1,1,0,0,0,0|1,1,0]=4 1444 B18R2.18851 O=Cc1ncc(cc1F)SCCn2ccnc2 62a_100010180630_100000702546 [1,1,0,0,0,0|1,1,0]=4 1445 B18R2.18851 OCc1ccc(cc1Br)OCCn2cccc2 7a_100010146404_200000035178 [1,1,0,0,0,0|1,0,1]=4 1446 B18R2.18851 OCc1ccc(cc1Br)OCCn2ccnc2 7a_100010146404_100000702546 [1,1,0,0,0,0|0,0,1]=3 1447 B18R2.18851 OCc1ccc(cc1Br)OCCn2cncn2 34a_100010146404_200000749826 [1,1,0,0,0,0|1,0,1]=4 1448 B18R2.18851 OCc1ccc(cc1Br)OCCn2cncn2 7a_100010146404_100000731791 [1,1,0,0,0,0|1,0,1]=4 1449 B18R2.18851 OCc1ccc(cc1Br)SCCn2ccnc2 62a_100000702546_100010240206 [1,1,0,0,0,0|0,1,1]=4 1450 B18R2.18851 OCc1ccc(cc1Br)SCCn2ccnc2 62a_100010240206_100000702546 [1,1,0,0,0,0|0,1,1]=4 1451 B18R2.18851 OCc1ccc(cc1Cl)OCCn2cccc2 7a_200000075811_200000035178 [1,1,0,0,0,0|1,0,1]=4 1452 B18R2.18851 OCc1ccc(cc1Cl)OCCn2ccnc2 7a_200000075811_100000702546 [1,1,0,0,0,0|0,0,1]=3 1453 B18R2.18851 OCc1ccc(cc1Cl)OCCn2cncn2 34a_200000075811_200000749826 [1,1,0,0,0,0|1,0,1]=4 1454 B18R2.18851 OCc1ccc(cc1Cl)OCCn2cncn2 7a_200000075811_100000731791 [1,1,0,0,0,0|1,0,1]=4 1455 B18R2.18851 OCc1ccc(cc1F)OCCn2cccc2 7a_100000084598_200000035178 [1,1,0,0,0,0|1,0,1]=4 1456 B18R2.18851 OCc1ccc(cc1F)OCCn2ccnc2 7a_100000084598_100000702546 [1,1,0,0,0,0|0,0,1]=3 1457 B18R2.18851 OCc1ccc(cc1F)OCCn2cncn2 34a_100000084598_200000749826 [1,1,0,0,0,0|1,0,1]=4 1458 B18R2.18851 OCc1ccc(cc1F)OCCn2cncn2 7a_100000084598_100000731791 [1,1,0,0,0,0|1,0,1]=4 1459 B18R2.18851 OCc1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100011191541 [1,1,0,0,0,0|0,1,1]=4 1460 B18R2.18851 OCc1ccc(cc1F)SCCn2ccnc2 62a_100011191541_100000702546 [1,1,0,0,0,0|0,1,1]=4 1461 B18R2.18851 OCc1ccc(cc1O)SCCn2ccnc2 62a_100000071718_100000702546 [1,1,0,0,0,0|0,1,1]=4 1462 B18R2.18851 OCc1ccc(cc1O)SCCn2ccnc2 62a_100000702546_100000071718 [1,1,0,0,0,0|0,1,1]=4 1463 B18R2.9362 COC(=O)c1c[nH]c(c1)SCCn2ccnc2 62a_100000702546_100009840242 [0,1,0,0,1,0|1,1,0]=4 1464 B18R2.9362 COC(=O)c1c[nH]c(c1)SCCn2ccnc2 62a_100009840242_100000702546 [0,1,0,0,1,0|1,1,0]=4 1465 B18R2.9362 COC(=O)c1cc(c[nH]1)SCCn2ccnc2 62a_100000702546_100000205823 [0,1,0,0,1,0|1,1,0]=4 1466 B18R2.9362 COC(=O)c1cc(co1)SCCn2ccnc2 62a_100000702546_100009992624 [0,1,0,0,1,0|1,1,0]=4 1467 B18R2.9362 COC(=O)c1cc(cs1)SCCn2ccnc2 62a_100000702546_100009815473 [0,1,0,0,1,0|1,1,0]=4 1468 B18R2.9362 COC(=O)c1cc(cs1)SCCn2ccnc2 62a_100009815473_100000702546 [0,1,0,0,1,0|1,1,0]=4 1469 B18R2.9362 COC(=O)c1ccc([nH]1)SCCn2ccnc2 62a_100000702546_100000687774 [0,1,0,0,1,0|1,1,0]=4 1470 B18R2.9362 COC(=O)c1ccc(o1)SCCn2ccnc2 62a_100000702546_100000148852 [0,1,0,0,1,0|1,1,0]=4 1471 B18R2.9362 COC(=O)c1ccc(s1)SCCn2ccnc2 62a_100000148107_100000702546 [0,1,0,0,1,0|1,1,0]=4 1472 B18R2.9362 COC(=O)c1ccc(s1)SCCn2ccnc2 62a_100000702546_100000148107 [0,1,0,0,1,0|1,1,0]=4 1473 B18R2.9362 COC(=O)c1csc(c1)SCCn2ccnc2 62a_100000692058_100000702546 [0,1,0,0,1,0|1,1,0]=4 1474 B18R2.9362 COC(=O)c1csc(c1)SCCn2ccnc2 62a_100000702546_100000692058 [0,1,0,0,1,0|1,1,0]=4 1475 B18R2.9387 CC(=NO)c1ccc(cc1)OCn2cncn2 34a_100000164205_200020645497 [0,1,0,0,1,0|2,0,0]=4 1476 B18R2.9387 CCC(=O)c1ccc(cc1)OCn2cncn2 34a_100000212119_200020645497 [0,1,0,0,1,0|2,0,0]=4 1477 B18R2.9387 CCC(=O)c1ccc(cc1)OCn2cncn2 7a_100000212119_200020645497 [0,1,0,0,1,0|2,0,0]=4 1478 B18R2.9387 CNC(=O)c1ccc(cc1)OCn2cncn2 34a_100000192141_200020645497 [0,1,0,0,1,0|2,0,0]=4 1479 B18R2.9387 CNC(=O)c1ccc(cc1)OCn2cncn2 7a_100000192141_200020645497 [0,1,0,0,1,0|2,0,0]=4 1480 B18R2.9387 COC(=O)c1ccc(cc1)OCc2ccn[nH]2 34a_100000150123_100000728653 [0,1,0,0,1,0|2,0,0]=4 1481 B18R2.9387 COC(=O)c1ccc(cc1)OCc2ccn[nH]2 7a_100000150123_100000728653 [0,1,0,0,1,0|2,0,0]=4 1482 B18R2.9387 COC(=O)c1ccc(cc1)OCc2ccsc2 34a_100000150123_100011261437 [0,1,0,0,1,0|2,0,0]=4 1483 B18R2.9387 COC(=O)c1ccc(cc1)OCc2ccsc2 7a_100000150123_100011261437 [0,1,0,0,1,0|2,0,0]=4 1484 B18R2.9387 COC(=O)c1ccc(cc1)OCc2cncs2 34a_100000150123_100015185245 [0,1,0,0,1,0|2,0,0]=4 1485 B18R2.9387 COC(=O)c1ccc(cc1)OCc2cncs2 7a_100000150123_100015185245 [0,1,0,0,1,0|2,0,0]=4 1486 B18R2.9387 COC(=O)c1ccc(cc1)OCn2cncn2 34a_100000150123_200020645497 [0,1,0,0,1,0|1,0,0]=3 1487 B18R2.9387 COC(=O)c1ccc(cc1)OCn2cncn2 7a_100000150123_200020645497 [0,1,0,0,1,0|1,0,0]=3 1488 B18R2.9387 COC(=O)c1ccc(cc1)SCn2cncn2 62a_100000150774_200020645497 [0,1,0,0,1,0|1,1,0]=4 1489 B18R2.9387 COC(=O)c1ccc(cc1)SCn2cncn2 62a_200020645497_100000150774 [0,1,0,0,1,0|1,1,0]=4 1490 B18R2.9387 COC(=O)c1ccc(cn1)OCn2cncn2 34a_100011997255_200020645497 [0,1,0,0,1,0|2,0,0]=4 1491 B18R2.9387 COC(=O)c1ccc(cn1)OCn2cncn2 7a_100011997255_200020645497 [0,1,0,0,1,0|2,0,0]=4 1492 B18R2.9387 NC(=NO)c1ccc(cc1)OCn2cncn2 34a_100000231063_200020645497 [0,1,0,0,1,0|2,0,0]=4 1493 B18R2.9387 NNC(=O)c1ccc(cc1)OCn2cncn2 34a_100000185078_200020645497 [0,1,0,0,1,0|2,0,0]=4 1494 B18R2.9387 O=C(CBr)c1ccc(cc1)OCn2cncn2 7a_100009814261_200020645497 [0,1,0,0,1,0|2,0,0]=4 1495 B18R2.9387 O=C(CCl)c1ccc(cc1)OCn2cncn2 7a_100000018856_200020645497 [0,1,0,0,1,0|2,0,0]=4 1496 B18R2.9387 O=C(CF)c1ccc(cc1)OCn2cncn2 34a_200010654591_200020645497 [0,1,0,0,1,0|2,0,0]=4 1497 B18R2.9387 O=C(CF)c1ccc(cc1)OCn2cncn2 7a_200010654591_200020645497 [0,1,0,0,1,0|2,0,0]=4 1498 B18R2.9387 O=C(CO)c1ccc(cc1)SCn2cncn2 62a_100011219529_200020645497 [0,1,0,0,1,0|1,1,0]=4 1499 B18R2.9387 O=C(CO)c1ccc(cc1)SCn2cncn2 62a_200020645497_100011219529 [0,1,0,0,1,0|1,1,0]=4 1500 B18R2.29079 CC(=O)c1ccc(cc1Br)OCn2cncn2 34a_100012340537_200020645497 [0,1,0,0,1,0|2,0,0]=4 1501 B18R2.29079 CC(=O)c1ccc(cc1Br)OCn2cncn2 7a_100012340537_200020645497 [0,1,0,0,1,0|2,0,0]=4 1502 B18R2.29079 CC(=O)c1ccc(cc1C)OCn2cncn2 34a_100000702595_200020645497 [0,1,0,0,1,0|2,0,0]=4 1503 B18R2.29079 CC(=O)c1ccc(cc1C)OCn2cncn2 7a_100000702595_200020645497 [0,1,0,0,1,0|2,0,0]=4 1504 B18R2.29079 CC(=O)c1ccc(cc1Cl)OCn2cncn2 34a_100011933989_200020645497 [0,1,0,0,1,0|2,0,0]=4 1505 B18R2.29079 CC(=O)c1ccc(cc1Cl)OCn2cncn2 7a_100011933989_200020645497 [0,1,0,0,1,0|2,0,0]=4 1506 B18R2.29079 CC(=O)c1ccc(cc1F)OCn2cncn2 34a_100000752407_200020645497 [0,1,0,0,1,0|2,0,0]=4 1507 B18R2.29079 CC(=O)c1ccc(cc1F)OCn2cncn2 7a_100000752407_200020645497 [0,1,0,0,1,0|2,0,0]=4 1508 B18R2.29079 NC(=O)c1ccc(cc1Cl)OCn2cncn2 34a_100011997949_200020645497 [0,1,0,0,1,0|2,0,0]=4 1509 B18R2.29079 NC(=O)c1ccc(cc1Cl)OCn2cncn2 7a_100011997949_200020645497 [0,1,0,0,1,0|2,0,0]=4 1510 B18R2.29079 NC(=O)c1ccc(cc1F)OCn2cncn2 34a_200012186767_200020645497 [0,1,0,0,1,0|2,0,0]=4 1511 B18R2.29079 NC(=O)c1ccc(cc1F)OCn2cncn2 7a_200012186767_200020645497 [0,1,0,0,1,0|2,0,0]=4 1512 B18R2.29079 NC(=O)c1ccc(cc1N)OCn2cncn2 34a_100012186684_200020645497 [0,1,0,0,1,0|2,0,0]=4 1513 B18R2.29079 NC(=O)c1ccc(cc1N)OCn2cncn2 7a_100012186684_200020645497 [0,1,0,0,1,0|2,0,0]=4 1514 B18R2.29483 CC(=O)c1ccc(cc1)CCn2cc(nn2)C 274090a_200000038727_200000242740 [0,1,0,0,1,0|2,0,0]=4 1515 B18R2.63469 CC(=O)c1ccc(c(c1)Br)OCn2cncn2 34a_100011772453_200020645497 [0,1,0,0,1,0|2,0,0]=4 1516 B18R2.63469 CC(=O)c1ccc(c(c1)Br)OCn2cncn2 7a_100011772453_200020645497 [0,1,0,0,1,0|2,0,0]=4 1517 B18R2.63469 CC(=O)c1ccc(c(c1)C)OCn2cncn2 34a_100000188726_200020645497 [0,1,0,0,1,0|2,0,0]=4 1518 B18R2.63469 CC(=O)c1ccc(c(c1)C)OCn2cncn2 7a_100000188726_200020645497 [0,1,0,0,1,0|2,0,0]=4 1519 B18R2.63469 CC(=O)c1ccc(c(c1)Cl)OCn2cncn2 34a_100000188625_200020645497 [0,1,0,0,1,0|2,0,0]=4 1520 B18R2.63469 CC(=O)c1ccc(c(c1)Cl)OCn2cncn2 7a_100000188625_200020645497 [0,1,0,0,1,0|2,0,0]=4 1521 B18R2.63469 CC(=O)c1ccc(c(c1)F)OCn2cncn2 34a_100000751691_200020645497 [0,1,0,0,1,0|2,0,0]=4 1522 B18R2.63469 CC(=O)c1ccc(c(c1)F)OCn2cncn2 7a_100000751691_200020645497 [0,1,0,0,1,0|2,0,0]=4 1523 B18R2.63469 CC(=O)c1ccc(c(c1)N)OCn2cncn2 34a_100000117292_200020645497 [0,1,0,0,1,0|2,0,0]=4 1524 B18R2.63469 CC(=O)c1ccc(c(c1)N)OCn2cncn2 7a_100000117292_200020645497 [0,1,0,0,1,0|2,0,0]=4 1525 B18R2.63469 NC(=O)c1ccc(c(c1)Cl)OCn2cncn2 34a_200000192832_200020645497 [0,1,0,0,1,0|2,0,0]=4 1526 B18R2.63469 NC(=O)c1ccc(c(c1)Cl)OCn2cncn2 7a_200000192832_200020645497 [0,1,0,0,1,0|2,0,0]=4 1527 B20R2.16343 CCC(=O)c1ccc(cc1)OCCc2cccnc2 7a_100000212119_200011713674 [0,1,0,0,0,1|2,0,0]=4 1528 B20R2.16343 CCC(=O)c1ccc(cc1)OCCc2ccncc2 7a_100000212119_100000723409 [0,1,0,0,0,1|2,0,0]=4 1529 B20R2.16343 CNC(=O)c1ccc(cc1)OCCc2cccnc2 7a_100000192141_200011713674 [0,1,0,0,0,1|2,0,0]=4 1530 B20R2.16343 CNC(=O)c1ccc(cc1)OCCc2ccncc2 7a_100000192141_100000723409 [0,1,0,0,0,1|2,0,0]=4 1531 B20R2.16343 COC(=O)c1ccc(cc1)OCCN2CC=CCC2 2230a_100000698166_100000742590 [0,1,0,0,0,1|1,0,1]=4 1532 B20R2.16343 COC(=O)c1ccc(cc1)OCCN2CC=CCC2 269982a_100000698166_100000742590 [0,1,0,0,0,1|1,0,1]=4 1533 B20R2.16343 COC(=O)c1ccc(cc1)OCCN2CC=CCC2 34a_100000698166_100000742590 [0,1,0,0,0,1|1,0,1]=4 1534 B20R2.16343 COC(=O)c1ccc(cc1)OCCc2ccccc2 34a_100000150123_100000765856 [0,1,0,0,0,1|2,0,0]=4 1535 B20R2.16343 COC(=O)c1ccc(cc1)OCCc2ccccc2 7a_100000150123_100000765856 [0,1,0,0,0,1|2,0,0]=4 1536 B20R2.16343 COC(=O)c1ccc(cc1)OCCc2ccccn2 7a_100000150123_100015183660 [0,1,0,0,0,1|2,0,0]=4 1537 B20R2.16343 COC(=O)c1ccc(cc1)OCCc2cccnc2 7a_100000150123_200011713674 [0,1,0,0,0,1|1,0,0]=3 1538 B20R2.16343 COC(=O)c1ccc(cc1)OCCc2ccncc2 7a_100000150123_100000723409 [0,1,0,0,0,1|1,0,0]=3 1539 B20R2.16343 COC(=O)c1ccc(cc1)SCCc2cccnc2 62a_100000150774_200011713674 [0,1,0,0,0,1|1,1,0]=4 1540 B20R2.16343 COC(=O)c1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000150774 [0,1,0,0,0,1|1,1,0]=4 1541 B20R2.16343 COC(=O)c1ccc(cc1)SCCc2ccncc2 62a_100000150774_100000723409 [0,1,0,0,0,1|1,1,0]=4 1542 B20R2.16343 COC(=O)c1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000150774 [0,1,0,0,0,1|1,1,0]=4 1543 B20R2.16343 COC(=O)c1ccc(cn1)OCCc2cccnc2 7a_100011997255_200011713674 [0,1,0,0,0,1|2,0,0]=4 1544 B20R2.16343 COC(=O)c1ccc(cn1)OCCc2ccncc2 7a_100011997255_100000723409 [0,1,0,0,0,1|2,0,0]=4 1545 B20R2.16343 O=C(CBr)c1ccc(cc1)OCCc2cccnc2 7a_100009814261_200011713674 [0,1,0,0,0,1|2,0,0]=4 1546 B20R2.16343 O=C(CBr)c1ccc(cc1)OCCc2ccncc2 7a_100009814261_100000723409 [0,1,0,0,0,1|2,0,0]=4 1547 B20R2.16343 O=C(CCl)c1ccc(cc1)OCCc2cccnc2 7a_100000018856_200011713674 [0,1,0,0,0,1|2,0,0]=4 1548 B20R2.16343 O=C(CCl)c1ccc(cc1)OCCc2ccncc2 7a_100000018856_100000723409 [0,1,0,0,0,1|2,0,0]=4 1549 B20R2.16343 O=C(CF)c1ccc(cc1)OCCc2cccnc2 7a_200010654591_200011713674 [0,1,0,0,0,1|2,0,0]=4 1550 B20R2.16343 O=C(CF)c1ccc(cc1)OCCc2ccncc2 7a_200010654591_100000723409 [0,1,0,0,0,1|2,0,0]=4 1551 B20R2.16343 O=C(CO)c1ccc(cc1)SCCc2cccnc2 62a_100011219529_200011713674 [0,1,0,0,0,1|1,1,0]=4 1552 B20R2.16343 O=C(CO)c1ccc(cc1)SCCc2cccnc2 62a_200011713674_100011219529 [0,1,0,0,0,1|1,1,0]=4 1553 B20R2.16343 O=C(CO)c1ccc(cc1)SCCc2ccncc2 62a_100000723409_100011219529 [0,1,0,0,0,1|1,1,0]=4 1554 B20R2.16343 O=C(CO)c1ccc(cc1)SCCc2ccncc2 62a_100011219529_100000723409 [0,1,0,0,0,1|1,1,0]=4 1555 B20R2.65836 CC(=O)c1ccc(cc1Br)OCCc2cccnc2 7a_100012340537_200011713674 [0,1,0,0,0,1|2,0,0]=4 1556 B20R2.65836 CC(=O)c1ccc(cc1Br)OCCc2ccncc2 7a_100012340537_100000723409 [0,1,0,0,0,1|2,0,0]=4 1557 B20R2.65836 CC(=O)c1ccc(cc1C)OCCc2cccnc2 7a_100000702595_200011713674 [0,1,0,0,0,1|2,0,0]=4 1558 B20R2.65836 CC(=O)c1ccc(cc1C)OCCc2ccncc2 7a_100000702595_100000723409 [0,1,0,0,0,1|2,0,0]=4 1559 B20R2.65836 CC(=O)c1ccc(cc1Cl)OCCc2cccnc2 7a_100011933989_200011713674 [0,1,0,0,0,1|2,0,0]=4 1560 B20R2.65836 CC(=O)c1ccc(cc1Cl)OCCc2ccncc2 7a_100011933989_100000723409 [0,1,0,0,0,1|2,0,0]=4 1561 B20R2.65836 CC(=O)c1ccc(cc1F)OCCc2cccnc2 7a_100000752407_200011713674 [0,1,0,0,0,1|2,0,0]=4 1562 B20R2.65836 CC(=O)c1ccc(cc1F)OCCc2ccncc2 7a_100000752407_100000723409 [0,1,0,0,0,1|2,0,0]=4 1563 B20R2.65836 NC(=O)c1ccc(cc1Cl)OCCc2cccnc2 7a_100011997949_200011713674 [0,1,0,0,0,1|2,0,0]=4 1564 B20R2.65836 NC(=O)c1ccc(cc1Cl)OCCc2ccncc2 7a_100011997949_100000723409 [0,1,0,0,0,1|2,0,0]=4 1565 B20R2.65836 NC(=O)c1ccc(cc1F)OCCc2cccnc2 7a_200012186767_200011713674 [0,1,0,0,0,1|2,0,0]=4 1566 B20R2.65836 NC(=O)c1ccc(cc1F)OCCc2ccncc2 7a_200012186767_100000723409 [0,1,0,0,0,1|2,0,0]=4 1567 B20R2.65836 NC(=O)c1ccc(cc1N)OCCc2cccnc2 7a_100012186684_200011713674 [0,1,0,0,0,1|2,0,0]=4 1568 B20R2.65836 NC(=O)c1ccc(cc1N)OCCc2ccncc2 7a_100012186684_100000723409 [0,1,0,0,0,1|2,0,0]=4 1569 B20R2.148809 CC(=O)c1ccc(c(c1)Br)OCCc2cccnc2 7a_100011772453_200011713674 [0,1,0,0,0,1|2,0,0]=4 1570 B20R2.148809 CC(=O)c1ccc(c(c1)Br)OCCc2ccncc2 7a_100011772453_100000723409 [0,1,0,0,0,1|2,0,0]=4 1571 B20R2.148809 CC(=O)c1ccc(c(c1)C)OCCc2cccnc2 7a_100000188726_200011713674 [0,1,0,0,0,1|2,0,0]=4 1572 B20R2.148809 CC(=O)c1ccc(c(c1)C)OCCc2ccncc2 7a_100000188726_100000723409 [0,1,0,0,0,1|2,0,0]=4 1573 B20R2.148809 CC(=O)c1ccc(c(c1)Cl)OCCc2cccnc2 7a_100000188625_200011713674 [0,1,0,0,0,1|2,0,0]=4 1574 B20R2.148809 CC(=O)c1ccc(c(c1)Cl)OCCc2ccncc2 7a_100000188625_100000723409 [0,1,0,0,0,1|2,0,0]=4 1575 B20R2.148809 CC(=O)c1ccc(c(c1)F)OCCc2cccnc2 7a_100000751691_200011713674 [0,1,0,0,0,1|2,0,0]=4 1576 B20R2.148809 CC(=O)c1ccc(c(c1)F)OCCc2ccncc2 7a_100000751691_100000723409 [0,1,0,0,0,1|2,0,0]=4 1577 B20R2.148809 CC(=O)c1ccc(c(c1)N)OCCc2cccnc2 7a_100000117292_200011713674 [0,1,0,0,0,1|2,0,0]=4 1578 B20R2.148809 CC(=O)c1ccc(c(c1)N)OCCc2ccncc2 7a_100000117292_100000723409 [0,1,0,0,0,1|2,0,0]=4 1579 B20R2.148809 NC(=O)c1ccc(c(c1)Cl)OCCc2cccnc2 7a_200000192832_200011713674 [0,1,0,0,0,1|2,0,0]=4 1580 B20R2.148809 NC(=O)c1ccc(c(c1)Cl)OCCc2ccncc2 7a_200000192832_100000723409 [0,1,0,0,0,1|2,0,0]=4 1581 B20R2.10604 CC(=O)c1ccc(cc1)COCC(C)n2cncn2 34a_100012017348_100000756337 [0,1,0,0,0,1|2,0,0]=4 1582 B20R2.10604 CC(=O)c1ccc(cc1)COCC(C)n2cncn2 7a_100000082505_200015185000 [0,1,0,0,0,1|2,0,0]=4 1583 B20R2.10604 CC(CNCc1ccc(cc1)C(=O)O)n2cncn2 269956a_100000181780_200015185000 [0,1,0,0,0,1|2,0,0]=4 1584 B20R2.10604 CC(COCc1ccc(cc1)C(=O)N)n2cncn2 34a_100000162016_200015185000 [0,1,0,0,0,1|2,0,0]=4 1585 B20R2.10604 CC(COCc1ccc(cc1)C(=O)N)n2cncn2 34a_100012017348_100000231043 [0,1,0,0,0,1|2,0,0]=4 1586 B20R2.10604 CC(COCc1ccc(cc1)C(=O)N)n2cncn2 7a_100000162016_200015185000 [0,1,0,0,0,1|2,0,0]=4 1587 B20R2.10606 CC(=O)c1ccc(cc1)CCC(=O)Cn2ccnc2 1458a_100000739072_200000038727 [0,1,0,0,0,1|2,0,0]=4 1588 B20R2.16358 CC(=NO)c1ccc(cc1)OCCCn2cccc2 34a_100000164205_200009814367 [0,1,0,0,0,1|2,0,0]=4 1589 B20R2.16358 CC(=NO)c1ccc(cc1)OCCCn2ccnc2 34a_100000164205_100000756272 [0,1,0,0,0,1|1,0,0]=3 1590 B20R2.16358 CC(=NO)c1ccc(cc1)OCCCn2cncn2 34a_100000164205_100102700105 [0,1,0,0,0,1|2,0,0]=4 1591 B20R2.16358 CCC(=O)c1ccc(cc1)OCCCn2cccc2 34a_100000212119_200009814367 [0,1,0,0,0,1|2,0,0]=4 1592 B20R2.16358 CCC(=O)c1ccc(cc1)OCCCn2cccc2 7a_100000212119_200009814367 [0,1,0,0,0,1|2,0,0]=4 1593 B20R2.16358 CCC(=O)c1ccc(cc1)OCCCn2ccnc2 34a_100000212119_100000756272 [0,1,0,0,0,1|1,0,0]=3 1594 B20R2.16358 CCC(=O)c1ccc(cc1)OCCCn2ccnc2 7a_100000212119_100000756272 [0,1,0,0,0,1|1,0,0]=3 1595 B20R2.16358 CCC(=O)c1ccc(cc1)OCCCn2cncn2 34a_100000212119_100102700105 [0,1,0,0,0,1|2,0,0]=4 1596 B20R2.16358 CCC(=O)c1ccc(cc1)OCCCn2cncn2 7a_100000212119_100102700105 [0,1,0,0,0,1|2,0,0]=4 1597 B20R2.16358 CCC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000211647_100000756272 [0,1,0,0,0,1|1,1,0]=4 1598 B20R2.16358 CCC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000211647 [0,1,0,0,0,1|1,1,0]=4 1599 B20R2.16358 CNC(=O)c1ccc(cc1)CNCCn2ccnc2 207a_100000230061_100000043907 [0,1,0,0,0,1|2,0,0]=4 1600 B20R2.16358 CNC(=O)c1ccc(cc1)CNCCn2ccnc2 270004a_100000230061_100000043907 [0,1,0,0,0,1|2,0,0]=4 1601 B20R2.16358 CNC(=O)c1ccc(cc1)COCCn2cccc2 34a_100000179382_100000753832 [0,1,0,0,0,1|2,0,0]=4 1602 B20R2.16358 CNC(=O)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000753832 [0,1,0,0,0,1|1,0,0]=3 1603 B20R2.16358 CNC(=O)c1ccc(cc1)COCCn2ccnn2 34a_100000080814_100000753832 [0,1,0,0,0,1|2,0,0]=4 1604 B20R2.16358 CNC(=O)c1ccc(cc1)COCCn2cncn2 34a_100000745309_100000753832 [0,1,0,0,0,1|2,0,0]=4 1605 B20R2.16358 CNC(=O)c1ccc(cc1)COCCn2cnnc2 34a_200011637517_100000753832 [0,1,0,0,0,1|2,0,0]=4 1606 B20R2.16358 CNC(=O)c1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000753832 [0,1,0,0,0,1|1,1,0]=4 1607 B20R2.16358 CNC(=O)c1ccc(cc1)CSCCn2ccnc2 62a_100000753832_100000702546 [0,1,0,0,0,1|1,1,0]=4 1608 B20R2.16358 CNC(=O)c1ccc(cc1)NCCCn2ccnc2 2230a_100000184841_100000756272 [0,1,0,0,0,1|2,0,0]=4 1609 B20R2.16358 CNC(=O)c1ccc(cc1)NCCCn2ccnc2 27a_100000210438_100000155074 [0,1,0,0,0,1|2,0,0]=4 1610 B20R2.16358 CNC(=O)c1ccc(cc1)NCCCn2ccnc2 34a_100000184841_100000756272 [0,1,0,0,0,1|2,0,0]=4 1611 B20R2.16358 CNC(=O)c1ccc(cc1)OCCCn2cccc2 34a_100000192141_200009814367 [0,1,0,0,0,1|2,0,0]=4 1612 B20R2.16358 CNC(=O)c1ccc(cc1)OCCCn2cccc2 7a_100000192141_200009814367 [0,1,0,0,0,1|2,0,0]=4 1613 B20R2.16358 CNC(=O)c1ccc(cc1)OCCCn2ccnc2 34a_100000192141_100000756272 [0,1,0,0,0,1|1,0,0]=3 1614 B20R2.16358 CNC(=O)c1ccc(cc1)OCCCn2ccnc2 7a_100000192141_100000756272 [0,1,0,0,0,1|1,0,0]=3 1615 B20R2.16358 CNC(=O)c1ccc(cc1)OCCCn2cncn2 34a_100000192141_100102700105 [0,1,0,0,0,1|2,0,0]=4 1616 B20R2.16358 CNC(=O)c1ccc(cc1)OCCCn2cncn2 7a_100000192141_100102700105 [0,1,0,0,0,1|2,0,0]=4 1617 B20R2.16358 CNC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000155074_100000756272 [0,1,0,0,0,1|1,1,0]=4 1618 B20R2.16358 CNC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000155074 [0,1,0,0,0,1|1,1,0]=4 1619 B20R2.16358 CNC(=O)c1ccc(cn1)OCCCn2ccnc2 34a_100009861314_100000756272 [0,1,0,0,0,1|2,0,0]=4 1620 B20R2.16358 CNC(=O)c1ccc(cn1)OCCCn2ccnc2 7a_100009861314_100000756272 [0,1,0,0,0,1|2,0,0]=4 1621 B20R2.16358 COC(=O)c1ccc(cc1)CCOCn2cncn2 34a_100010779965_200020645497 [0,1,0,0,0,1|2,0,0]=4 1622 B20R2.16358 COC(=O)c1ccc(cc1)CCOCn2cncn2 7a_100010779965_200020645497 [0,1,0,0,0,1|2,0,0]=4 1623 B20R2.16358 COC(=O)c1ccc(cc1)CCSCn2cncn2 62a_100010192280_200020645497 [0,1,0,0,0,1|2,0,0]=4 1624 B20R2.16358 COC(=O)c1ccc(cc1)CCSCn2cncn2 62a_200020645497_100010192280 [0,1,0,0,0,1|2,0,0]=4 1625 B20R2.16358 COC(=O)c1ccc(cc1)CNCCn2cccc2 270004a_100011368172_100000148700 [0,1,0,0,0,1|2,0,0]=4 1626 B20R2.16358 COC(=O)c1ccc(cc1)CNCCn2cccc2 34a_100011368172_100000735637 [0,1,0,0,0,1|2,0,0]=4 1627 B20R2.16358 COC(=O)c1ccc(cc1)CNCCn2ccnc2 270004a_100000230061_100000148700 [0,1,0,0,0,1|1,0,0]=3 1628 B20R2.16358 COC(=O)c1ccc(cc1)CNCCn2cncn2 2230a_200000738561_100000735637 [0,1,0,0,0,1|2,0,0]=4 1629 B20R2.16358 COC(=O)c1ccc(cc1)CNCCn2cncn2 270004a_200000738561_100000148700 [0,1,0,0,0,1|2,0,0]=4 1630 B20R2.16358 COC(=O)c1ccc(cc1)COCC[n+]2ccsc2 34a_200000100414_100000735637 [0,1,0,0,0,1|1,0,1]=4 1631 B20R2.16358 COC(=O)c1ccc(cc1)COCCc2ccsc2 34a_100000748821_100000735637 [0,1,0,0,0,1|2,0,0]=4 1632 B20R2.16358 COC(=O)c1ccc(cc1)COCCc2cn[nH]c2 34a_100000766553_100000735637 [0,1,0,0,0,1|2,0,0]=4 1633 B20R2.16358 COC(=O)c1ccc(cc1)COCCc2cn[nH]c2 7a_100000151488_100000743252 [0,1,0,0,0,1|2,0,0]=4 1634 B20R2.16358 COC(=O)c1ccc(cc1)COCCc2cnoc2 34a_100000732699_100000735637 [0,1,0,0,0,1|2,0,0]=4 1635 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cccc2 34a_100000179382_100000735637 [0,1,0,0,0,1|1,0,0]=3 1636 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cccc2 7a_100000151488_200000035178 [0,1,0,0,0,1|1,0,0]=3 1637 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cccn2 34a_100000151488_100015204718 [0,1,0,0,0,1|2,0,0]=4 1638 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cccn2 34a_100000743371_100000735637 [0,1,0,0,0,1|2,0,0]=4 1639 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cccn2 7a_100000151488_100000685285 [0,1,0,0,0,1|2,0,0]=4 1640 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000735637 [0,1,0,0,0,1|0,0,0]=2 1641 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2ccnc2 7a_100000151488_100000702546 [0,1,0,0,0,1|0,0,0]=2 1642 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2ccnn2 34a_100000080814_100000735637 [0,1,0,0,0,1|1,0,0]=3 1643 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cncn2 34a_100000151488_200000749826 [0,1,0,0,0,1|1,0,0]=3 1644 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cncn2 34a_100000745309_100000735637 [0,1,0,0,0,1|1,0,0]=3 1645 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cncn2 7a_100000151488_100000731791 [0,1,0,0,0,1|1,0,0]=3 1646 B20R2.16358 COC(=O)c1ccc(cc1)COCCn2cnnc2 34a_200011637517_100000735637 [0,1,0,0,0,1|1,0,0]=3 1647 B20R2.16358 COC(=O)c1ccc(cc1)CSCCn2cccc2 62a_100000735637_200000035178 [0,1,0,0,0,1|1,1,0]=4 1648 B20R2.16358 COC(=O)c1ccc(cc1)CSCCn2cccc2 62a_200009811947_100000187170 [0,1,0,0,0,1|1,1,0]=4 1649 B20R2.16358 COC(=O)c1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000187170 [0,1,0,0,0,1|0,1,0]=3 1650 B20R2.16358 COC(=O)c1ccc(cc1)CSCCn2ccnc2 62a_100000735637_100000702546 [0,1,0,0,0,1|0,1,0]=3 1651 B20R2.16358 COC(=O)c1ccc(cc1)CSCCn2cncn2 62a_100000731791_100000187170 [0,1,0,0,0,1|1,1,0]=4 1652 B20R2.16358 COC(=O)c1ccc(cc1)CSCCn2cncn2 62a_100000735637_100000731791 [0,1,0,0,0,1|1,1,0]=4 1653 B20R2.16358 COC(=O)c1ccc(cc1)OCCCn2cccc2 34a_100000150123_200009814367 [0,1,0,0,0,1|1,0,0]=3 1654 B20R2.16358 COC(=O)c1ccc(cc1)OCCCn2cccc2 7a_100000150123_200009814367 [0,1,0,0,0,1|1,0,0]=3 1655 B20R2.16358 COC(=O)c1ccc(cc1)OCCCn2cccn2 7a_100000150123_100000739983 [0,1,0,0,0,1|2,0,0]=4 1656 B20R2.16358 COC(=O)c1ccc(cc1)OCCCn2ccnc2 34a_100000150123_100000756272 [0,1,0,0,0,1|0,0,0]=2 1657 B20R2.16358 COC(=O)c1ccc(cc1)OCCCn2ccnc2 7a_100000150123_100000756272 [0,1,0,0,0,1|0,0,0]=2 1658 B20R2.16358 COC(=O)c1ccc(cc1)OCCCn2cncn2 34a_100000150123_100102700105 [0,1,0,0,0,1|1,0,0]=3 1659 B20R2.16358 COC(=O)c1ccc(cc1)OCCCn2cncn2 7a_100000150123_100102700105 [0,1,0,0,0,1|1,0,0]=3 1660 B20R2.16358 COC(=O)c1ccc(cc1)OCCOc2ccsc2 34a_100000106738_100000742590 [0,1,0,0,0,1|2,0,0]=4 1661 B20R2.16358 COC(=O)c1ccc(cc1)OCCOc2ccsc2 7a_100000106738_100000742590 [0,1,0,0,0,1|2,0,0]=4 1662 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2ccoc2 62a_100000742590_100011215275 [0,1,0,0,0,1|2,0,0]=4 1663 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2ccoc2 62a_100011215275_100000742590 [0,1,0,0,0,1|2,0,0]=4 1664 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2ccsc2 62a_100000738268_100000742590 [0,1,0,0,0,1|2,0,0]=4 1665 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2ccsc2 62a_100000742590_100000738268 [0,1,0,0,0,1|2,0,0]=4 1666 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cn[nH]c2 62a_100000238712_100000742590 [0,1,0,0,0,1|2,0,0]=4 1667 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cn[nH]c2 62a_100000742590_100000238712 [0,1,0,0,0,1|2,0,0]=4 1668 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cnco2 62a_100000742590_100020591547 [0,1,0,0,0,1|2,0,0]=4 1669 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cnco2 62a_100020591547_100000742590 [0,1,0,0,0,1|2,0,0]=4 1670 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cncs2 62a_100000742590_100011934649 [0,1,0,0,0,1|2,0,0]=4 1671 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cncs2 62a_100011934649_100000742590 [0,1,0,0,0,1|2,0,0]=4 1672 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cnoc2 62a_100000742590_100009815712 [0,1,0,0,0,1|2,0,0]=4 1673 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cnoc2 62a_100009815712_100000742590 [0,1,0,0,0,1|2,0,0]=4 1674 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cnsc2 62a_100000742590_100009815736 [0,1,0,0,0,1|2,0,0]=4 1675 B20R2.16358 COC(=O)c1ccc(cc1)OCCSc2cnsc2 62a_100009815736_100000742590 [0,1,0,0,0,1|2,0,0]=4 1676 B20R2.16358 COC(=O)c1ccc(cc1)SCCCn2cccc2 62a_100000150774_200009814367 [0,1,0,0,0,1|1,1,0]=4 1677 B20R2.16358 COC(=O)c1ccc(cc1)SCCCn2cccc2 62a_200009814367_100000150774 [0,1,0,0,0,1|1,1,0]=4 1678 B20R2.16358 COC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000150774_100000756272 [0,1,0,0,0,1|0,1,0]=3 1679 B20R2.16358 COC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000150774 [0,1,0,0,0,1|0,1,0]=3 1680 B20R2.16358 COC(=O)c1ccc(cc1)SCCCn2cncn2 62a_100000150774_100102700105 [0,1,0,0,0,1|1,1,0]=4 1681 B20R2.16358 COC(=O)c1ccc(cc1)SCCCn2cncn2 62a_100102700105_100000150774 [0,1,0,0,0,1|1,1,0]=4 1682 B20R2.16358 COC(=O)c1ccc(cn1)CNCCn2ccnc2 270004a_100000230061_102516457225 [0,1,0,0,0,1|2,0,0]=4 1683 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2cccc2 34a_100000179382_100010177729 [0,1,0,0,0,1|2,0,0]=4 1684 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2cccc2 7a_100009873365_200000035178 [0,1,0,0,0,1|2,0,0]=4 1685 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2ccnc2 34a_100000719764_100010177729 [0,1,0,0,0,1|1,0,0]=3 1686 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2ccnc2 7a_100009873365_100000702546 [0,1,0,0,0,1|1,0,0]=3 1687 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2ccnn2 34a_100000080814_100010177729 [0,1,0,0,0,1|2,0,0]=4 1688 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2cncn2 34a_100000745309_100010177729 [0,1,0,0,0,1|2,0,0]=4 1689 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2cncn2 34a_100009873365_200000749826 [0,1,0,0,0,1|2,0,0]=4 1690 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2cncn2 7a_100009873365_100000731791 [0,1,0,0,0,1|2,0,0]=4 1691 B20R2.16358 COC(=O)c1ccc(cn1)COCCn2cnnc2 34a_200011637517_100010177729 [0,1,0,0,0,1|2,0,0]=4 1692 B20R2.16358 COC(=O)c1ccc(cn1)CSCCn2ccnc2 62a_100000702546_100010177729 [0,1,0,0,0,1|1,1,0]=4 1693 B20R2.16358 COC(=O)c1ccc(cn1)CSCCn2ccnc2 62a_100010177729_100000702546 [0,1,0,0,0,1|1,1,0]=4 1694 B20R2.16358 COC(=O)c1ccc(cn1)OCCCn2cccc2 34a_100011997255_200009814367 [0,1,0,0,0,1|2,0,0]=4 1695 B20R2.16358 COC(=O)c1ccc(cn1)OCCCn2cccc2 7a_100011997255_200009814367 [0,1,0,0,0,1|2,0,0]=4 1696 B20R2.16358 COC(=O)c1ccc(cn1)OCCCn2ccnc2 34a_100011997255_100000756272 [0,1,0,0,0,1|1,0,0]=3 1697 B20R2.16358 COC(=O)c1ccc(cn1)OCCCn2ccnc2 7a_100011997255_100000756272 [0,1,0,0,0,1|1,0,0]=3 1698 B20R2.16358 COC(=O)c1ccc(cn1)OCCCn2cncn2 34a_100011997255_100102700105 [0,1,0,0,0,1|2,0,0]=4 1699 B20R2.16358 COC(=O)c1ccc(cn1)OCCCn2cncn2 7a_100011997255_100102700105 [0,1,0,0,0,1|2,0,0]=4 1700 B20R2.16358 COC(=O)c1ccc(cn1)SCCCn2ccnc2 62a_100000756272_100102712061 [0,1,0,0,0,1|1,1,0]=4 1701 B20R2.16358 COC(=O)c1ccc(cn1)SCCCn2ccnc2 62a_100102712061_100000756272 [0,1,0,0,0,1|1,1,0]=4 1702 B20R2.16358 COC(=O)c1ccc(nc1)CNCCn2ccnc2 270004a_100000230061_100000762506 [0,1,0,0,0,1|2,0,0]=4 1703 B20R2.16358 COC(=O)c1ccc(nc1)COCCn2cccc2 34a_100000179382_100010230174 [0,1,0,0,0,1|2,0,0]=4 1704 B20R2.16358 COC(=O)c1ccc(nc1)COCCn2ccnc2 34a_100000719764_100010230174 [0,1,0,0,0,1|1,0,0]=3 1705 B20R2.16358 COC(=O)c1ccc(nc1)COCCn2ccnn2 34a_100000080814_100010230174 [0,1,0,0,0,1|2,0,0]=4 1706 B20R2.16358 COC(=O)c1ccc(nc1)COCCn2cncn2 34a_100000239634_200000749826 [0,1,0,0,0,1|2,0,0]=4 1707 B20R2.16358 COC(=O)c1ccc(nc1)COCCn2cncn2 34a_100000745309_100010230174 [0,1,0,0,0,1|2,0,0]=4 1708 B20R2.16358 COC(=O)c1ccc(nc1)COCCn2cnnc2 34a_200011637517_100010230174 [0,1,0,0,0,1|2,0,0]=4 1709 B20R2.16358 COC(=O)c1ccc(nc1)CSCCn2ccnc2 62a_100000702546_100010230174 [0,1,0,0,0,1|1,1,0]=4 1710 B20R2.16358 COC(=O)c1ccc(nc1)CSCCn2ccnc2 62a_100010230174_100000702546 [0,1,0,0,0,1|1,1,0]=4 1711 B20R2.16358 COC(=O)c1ccc(nc1)NCCCn2ccnc2 27a_100000210438_100000733799 [0,1,0,0,0,1|2,0,0]=4 1712 B20R2.16358 COC(=O)c1ccc(nc1)SCCCn2ccnc2 62a_100000733799_100000756272 [0,1,0,0,0,1|1,1,0]=4 1713 B20R2.16358 COC(=O)c1ccc(nc1)SCCCn2ccnc2 62a_100000756272_100000733799 [0,1,0,0,0,1|1,1,0]=4 1714 B20R2.16358 COC(=O)c1cnc(cn1)COCCn2ccnc2 34a_100000719764_200010203303 [0,1,0,0,0,1|2,0,0]=4 1715 B20R2.16358 COC(C)c1ccc(cc1)OCCCn2ccnc2 34a_200010658654_100000756272 [0,1,0,0,0,1|1,0,1]=4 1716 B20R2.16358 COC(C)c1ccc(cc1)OCCCn2ccnc2 7a_200010658654_100000756272 [0,1,0,0,0,1|1,0,1]=4 1717 B20R2.16358 N#CC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100009994572 [0,1,0,0,0,1|1,1,0]=4 1718 B20R2.16358 NC(=NO)c1ccc(cc1)OCCCn2cccc2 34a_100000231063_200009814367 [0,1,0,0,0,1|2,0,0]=4 1719 B20R2.16358 NC(=NO)c1ccc(cc1)OCCCn2ccnc2 34a_100000231063_100000756272 [0,1,0,0,0,1|1,0,0]=3 1720 B20R2.16358 NC(=NO)c1ccc(cc1)OCCCn2cncn2 34a_100000231063_100102700105 [0,1,0,0,0,1|2,0,0]=4 1721 B20R2.16358 NCC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000017248_100000756272 [0,1,0,0,0,1|1,1,0]=4 1722 B20R2.16358 NCC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000017248 [0,1,0,0,0,1|1,1,0]=4 1723 B20R2.16358 NCC(O)c1ccc(cc1)OCCCn2ccnc2 34a_100000067596_100000756272 [0,1,0,0,0,1|1,0,1]=4 1724 B20R2.16358 NNC(=O)c1ccc(cc1)NCCCn2ccnc2 27a_100000210438_100000183614 [0,1,0,0,0,1|2,0,0]=4 1725 B20R2.16358 NNC(=O)c1ccc(cc1)OCCCn2cccc2 34a_100000185078_200009814367 [0,1,0,0,0,1|2,0,0]=4 1726 B20R2.16358 NNC(=O)c1ccc(cc1)OCCCn2ccnc2 34a_100000185078_100000756272 [0,1,0,0,0,1|1,0,0]=3 1727 B20R2.16358 NNC(=O)c1ccc(cc1)OCCCn2cncn2 34a_100000185078_100102700105 [0,1,0,0,0,1|2,0,0]=4 1728 B20R2.16358 NNC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000183614_100000756272 [0,1,0,0,0,1|1,1,0]=4 1729 B20R2.16358 NNC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000183614 [0,1,0,0,0,1|1,1,0]=4 1730 B20R2.16358 O=C(CBr)c1ccc(cc1)OCCCn2cccc2 7a_100009814261_200009814367 [0,1,0,0,0,1|2,0,0]=4 1731 B20R2.16358 O=C(CBr)c1ccc(cc1)OCCCn2ccnc2 7a_100009814261_100000756272 [0,1,0,0,0,1|1,0,0]=3 1732 B20R2.16358 O=C(CBr)c1ccc(cc1)OCCCn2cncn2 7a_100009814261_100102700105 [0,1,0,0,0,1|2,0,0]=4 1733 B20R2.16358 O=C(CCl)c1ccc(cc1)OCCCn2cccc2 7a_100000018856_200009814367 [0,1,0,0,0,1|2,0,0]=4 1734 B20R2.16358 O=C(CCl)c1ccc(cc1)OCCCn2ccnc2 7a_100000018856_100000756272 [0,1,0,0,0,1|1,0,0]=3 1735 B20R2.16358 O=C(CCl)c1ccc(cc1)OCCCn2cncn2 7a_100000018856_100102700105 [0,1,0,0,0,1|2,0,0]=4 1736 B20R2.16358 O=C(CF)c1ccc(cc1)OCCCn2cccc2 34a_200010654591_200009814367 [0,1,0,0,0,1|2,0,0]=4 1737 B20R2.16358 O=C(CF)c1ccc(cc1)OCCCn2cccc2 7a_200010654591_200009814367 [0,1,0,0,0,1|2,0,0]=4 1738 B20R2.16358 O=C(CF)c1ccc(cc1)OCCCn2ccnc2 34a_200010654591_100000756272 [0,1,0,0,0,1|1,0,0]=3 1739 B20R2.16358 O=C(CF)c1ccc(cc1)OCCCn2ccnc2 7a_200010654591_100000756272 [0,1,0,0,0,1|1,0,0]=3 1740 B20R2.16358 O=C(CF)c1ccc(cc1)OCCCn2cncn2 34a_200010654591_100102700105 [0,1,0,0,0,1|2,0,0]=4 1741 B20R2.16358 O=C(CF)c1ccc(cc1)OCCCn2cncn2 7a_200010654591_100102700105 [0,1,0,0,0,1|2,0,0]=4 1742 B20R2.16358 O=C(CO)c1ccc(cc1)SCCCn2cccc2 62a_100011219529_200009814367 [0,1,0,0,0,1|1,1,0]=4 1743 B20R2.16358 O=C(CO)c1ccc(cc1)SCCCn2cccc2 62a_200009814367_100011219529 [0,1,0,0,0,1|1,1,0]=4 1744 B20R2.16358 O=C(CO)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100011219529 [0,1,0,0,0,1|0,1,0]=3 1745 B20R2.16358 O=C(CO)c1ccc(cc1)SCCCn2ccnc2 62a_100011219529_100000756272 [0,1,0,0,0,1|0,1,0]=3 1746 B20R2.16358 O=C(CO)c1ccc(cc1)SCCCn2cncn2 62a_100011219529_100102700105 [0,1,0,0,0,1|1,1,0]=4 1747 B20R2.16358 O=C(CO)c1ccc(cc1)SCCCn2cncn2 62a_100102700105_100011219529 [0,1,0,0,0,1|1,1,0]=4 1748 B20R2.16358 O=CC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000725942_100000756272 [0,1,0,0,0,1|0,1,1]=4 1749 B20R2.16358 O=CC(=O)c1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000725942 [0,1,0,0,0,1|0,1,1]=4 1750 B20R2.28639 CC(C)(O)c1ccc(cc1)OCCCn2ccnc2 34a_100000695648_100000756272 [0,1,0,0,0,1|1,0,1]=4 1751 B20R2.28639 CC(C)(O)c1ccc(cc1)OCCCn2ccnc2 7a_100000695648_100000756272 [0,1,0,0,0,1|1,0,1]=4 1752 B20R2.28639 CS(=O)(=O)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000717844 [0,1,0,0,0,1|1,0,1]=4 1753 B20R2.28639 CS(=O)(=O)c1ccc(cc1)COCCn2ccnc2 7a_100000728255_100000702546 [0,1,0,0,0,1|1,0,1]=4 1754 B20R2.28639 CS(=O)(=O)c1ccc(cc1)OCCCn2ccnc2 34a_100000230201_100000756272 [0,1,0,0,0,1|1,0,1]=4 1755 B20R2.28639 CS(=O)(=O)c1ccc(cc1)OCCCn2ccnc2 7a_100000230201_100000756272 [0,1,0,0,0,1|1,0,1]=4 1756 B20R2.28639 NS(=O)(=O)c1ccc(cc1)COCCn2ccnc2 34a_100000719764_200012292325 [0,1,0,0,0,1|1,0,1]=4 1757 B20R2.28639 NS(=O)(=O)c1ccc(cc1)OCCCn2ccnc2 34a_100000738502_100000756272 [0,1,0,0,0,1|1,0,1]=4 1758 B20R2.28639 NS(=O)(=O)c1ccc(cc1)OCCCn2ccnc2 7a_100000738502_100000756272 [0,1,0,0,0,1|1,0,1]=4 1759 B20R2.28639 O=S(=O)([O-])c1ccc(cc1)OCCCn2ccnc2 7a_100000698548_100000756272 [0,1,0,0,0,1|1,0,1]=4 1760 B20R2.65825 CC(=O)c1ccc(c(c1)Br)COCCn2cccc2 34a_100000179382_100010884425 [0,1,0,0,0,1|2,0,0]=4 1761 B20R2.65825 CC(=O)c1ccc(c(c1)Br)COCCn2ccnc2 34a_100000719764_100010884425 [0,1,0,0,0,1|1,0,0]=3 1762 B20R2.65825 CC(=O)c1ccc(c(c1)Br)COCCn2ccnn2 34a_100000080814_100010884425 [0,1,0,0,0,1|2,0,0]=4 1763 B20R2.65825 CC(=O)c1ccc(c(c1)Br)COCCn2cncn2 34a_100000745309_100010884425 [0,1,0,0,0,1|2,0,0]=4 1764 B20R2.65825 CC(=O)c1ccc(c(c1)Br)COCCn2cnnc2 34a_200011637517_100010884425 [0,1,0,0,0,1|2,0,0]=4 1765 B20R2.65825 CC(=O)c1ccc(c(c1)Br)CSCCn2ccnc2 62a_100010884425_100000702546 [0,1,0,0,0,1|1,1,0]=4 1766 B20R2.65825 CC(=O)c1ccc(c(c1)Br)OCCCn2cccc2 34a_100011772453_200009814367 [0,1,0,0,0,1|2,0,0]=4 1767 B20R2.65825 CC(=O)c1ccc(c(c1)Br)OCCCn2cccc2 7a_100011772453_200009814367 [0,1,0,0,0,1|2,0,0]=4 1768 B20R2.65825 CC(=O)c1ccc(c(c1)Br)OCCCn2ccnc2 34a_100011772453_100000756272 [0,1,0,0,0,1|1,0,0]=3 1769 B20R2.65825 CC(=O)c1ccc(c(c1)Br)OCCCn2ccnc2 7a_100011772453_100000756272 [0,1,0,0,0,1|1,0,0]=3 1770 B20R2.65825 CC(=O)c1ccc(c(c1)Br)OCCCn2cncn2 34a_100011772453_100102700105 [0,1,0,0,0,1|2,0,0]=4 1771 B20R2.65825 CC(=O)c1ccc(c(c1)Br)OCCCn2cncn2 7a_100011772453_100102700105 [0,1,0,0,0,1|2,0,0]=4 1772 B20R2.65825 CC(=O)c1ccc(c(c1)Br)SCCCn2ccnc2 62a_100000756272_100010146554 [0,1,0,0,0,1|1,1,0]=4 1773 B20R2.65825 CC(=O)c1ccc(c(c1)Br)SCCCn2ccnc2 62a_100010146554_100000756272 [0,1,0,0,0,1|1,1,0]=4 1774 B20R2.65825 CC(=O)c1ccc(c(c1)C)OCCCn2cccc2 34a_100000188726_200009814367 [0,1,0,0,0,1|2,0,0]=4 1775 B20R2.65825 CC(=O)c1ccc(c(c1)C)OCCCn2cccc2 7a_100000188726_200009814367 [0,1,0,0,0,1|2,0,0]=4 1776 B20R2.65825 CC(=O)c1ccc(c(c1)C)OCCCn2ccnc2 34a_100000188726_100000756272 [0,1,0,0,0,1|1,0,0]=3 1777 B20R2.65825 CC(=O)c1ccc(c(c1)C)OCCCn2ccnc2 7a_100000188726_100000756272 [0,1,0,0,0,1|1,0,0]=3 1778 B20R2.65825 CC(=O)c1ccc(c(c1)C)OCCCn2cncn2 34a_100000188726_100102700105 [0,1,0,0,0,1|2,0,0]=4 1779 B20R2.65825 CC(=O)c1ccc(c(c1)C)OCCCn2cncn2 7a_100000188726_100102700105 [0,1,0,0,0,1|2,0,0]=4 1780 B20R2.65825 CC(=O)c1ccc(c(c1)C)SCCCn2ccnc2 62a_100000697869_100000756272 [0,1,0,0,0,1|1,1,0]=4 1781 B20R2.65825 CC(=O)c1ccc(c(c1)C)SCCCn2ccnc2 62a_100000756272_100000697869 [0,1,0,0,0,1|1,1,0]=4 1782 B20R2.65825 CC(=O)c1ccc(c(c1)Cl)OCCCn2cccc2 34a_100000188625_200009814367 [0,1,0,0,0,1|2,0,0]=4 1783 B20R2.65825 CC(=O)c1ccc(c(c1)Cl)OCCCn2cccc2 7a_100000188625_200009814367 [0,1,0,0,0,1|2,0,0]=4 1784 B20R2.65825 CC(=O)c1ccc(c(c1)Cl)OCCCn2ccnc2 34a_100000188625_100000756272 [0,1,0,0,0,1|1,0,0]=3 1785 B20R2.65825 CC(=O)c1ccc(c(c1)Cl)OCCCn2ccnc2 7a_100000188625_100000756272 [0,1,0,0,0,1|1,0,0]=3 1786 B20R2.65825 CC(=O)c1ccc(c(c1)Cl)OCCCn2cncn2 34a_100000188625_100102700105 [0,1,0,0,0,1|2,0,0]=4 1787 B20R2.65825 CC(=O)c1ccc(c(c1)Cl)OCCCn2cncn2 7a_100000188625_100102700105 [0,1,0,0,0,1|2,0,0]=4 1788 B20R2.65825 CC(=O)c1ccc(c(c1)F)OCCCn2cccc2 34a_100000751691_200009814367 [0,1,0,0,0,1|2,0,0]=4 1789 B20R2.65825 CC(=O)c1ccc(c(c1)F)OCCCn2cccc2 7a_100000751691_200009814367 [0,1,0,0,0,1|2,0,0]=4 1790 B20R2.65825 CC(=O)c1ccc(c(c1)F)OCCCn2ccnc2 34a_100000751691_100000756272 [0,1,0,0,0,1|1,0,0]=3 1791 B20R2.65825 CC(=O)c1ccc(c(c1)F)OCCCn2ccnc2 7a_100000751691_100000756272 [0,1,0,0,0,1|1,0,0]=3 1792 B20R2.65825 CC(=O)c1ccc(c(c1)F)OCCCn2cncn2 34a_100000751691_100102700105 [0,1,0,0,0,1|2,0,0]=4 1793 B20R2.65825 CC(=O)c1ccc(c(c1)F)OCCCn2cncn2 7a_100000751691_100102700105 [0,1,0,0,0,1|2,0,0]=4 1794 B20R2.65825 CC(=O)c1ccc(c(c1)F)SCCCn2ccnc2 62a_100000690002_100000756272 [0,1,0,0,0,1|1,1,0]=4 1795 B20R2.65825 CC(=O)c1ccc(c(c1)F)SCCCn2ccnc2 62a_100000756272_100000690002 [0,1,0,0,0,1|1,1,0]=4 1796 B20R2.65825 CC(=O)c1ccc(c(c1)N)OCCCn2cccc2 34a_100000117292_200009814367 [0,1,0,0,0,1|2,0,0]=4 1797 B20R2.65825 CC(=O)c1ccc(c(c1)N)OCCCn2cccc2 7a_100000117292_200009814367 [0,1,0,0,0,1|2,0,0]=4 1798 B20R2.65825 CC(=O)c1ccc(c(c1)N)OCCCn2ccnc2 34a_100000117292_100000756272 [0,1,0,0,0,1|1,0,0]=3 1799 B20R2.65825 CC(=O)c1ccc(c(c1)N)OCCCn2ccnc2 7a_100000117292_100000756272 [0,1,0,0,0,1|1,0,0]=3 1800 B20R2.65825 CC(=O)c1ccc(c(c1)N)OCCCn2cncn2 34a_100000117292_100102700105 [0,1,0,0,0,1|2,0,0]=4 1801 B20R2.65825 CC(=O)c1ccc(c(c1)N)OCCCn2cncn2 7a_100000117292_100102700105 [0,1,0,0,0,1|2,0,0]=4 1802 B20R2.65825 CC(=O)c1ccc(c(c1)N)SCCCn2ccnc2 62a_100009816534_100000756272 [0,1,0,0,0,1|1,1,0]=4 1803 B20R2.65825 Cc1cc(ccc1COCCn2ccnc2)[N+](=O)[O-] 34a_100000719764_100010218038 [0,1,0,0,0,1|1,0,1]=4 1804 B20R2.65825 Cc1cc(ccc1COCCn2ccnc2)[N+](=O)[O-] 7a_100009883322_100000702546 [0,1,0,0,0,1|1,0,1]=4 1805 B20R2.65825 Cc1cc(ccc1NCCCn2ccnc2)C(=O)N 27a_100000210438_100011218126 [0,1,0,0,0,1|2,0,0]=4 1806 B20R2.65825 Cc1cc(ccc1NCCCn2ccnc2)C(=O)N 34a_100000746439_100000756272 [0,1,0,0,0,1|2,0,0]=4 1807 B20R2.65825 Cc1cc(ccc1NCCCn2ccnc2)C(=O)N 7a_100000746439_100000756272 [0,1,0,0,0,1|2,0,0]=4 1808 B20R2.65825 Cc1cc(ccc1OCCCn2ccnc2)[N+](=O)[O-] 34a_100000744956_100000756272 [0,1,0,0,0,1|1,0,1]=4 1809 B20R2.65825 Cc1cc(ccc1OCCCn2ccnc2)[N+](=O)[O-] 7a_100000744956_100000756272 [0,1,0,0,0,1|1,0,1]=4 1810 B20R2.65825 Cc1cc(ccc1SCCCn2ccnc2)C(=O)N 62a_100000756272_100011218126 [0,1,0,0,0,1|1,1,0]=4 1811 B20R2.65825 Cc1cc(ccc1SCCCn2ccnc2)C(=O)N 62a_100011218126_100000756272 [0,1,0,0,0,1|1,1,0]=4 1812 B20R2.65825 NC(=O)c1ccc(c(c1)Br)NCCCn2ccnc2 27a_100000210438_100009814583 [0,1,0,0,0,1|2,0,0]=4 1813 B20R2.65825 NC(=O)c1ccc(c(c1)Br)SCCCn2ccnc2 62a_100000756272_100009814583 [0,1,0,0,0,1|1,1,0]=4 1814 B20R2.65825 NC(=O)c1ccc(c(c1)Br)SCCCn2ccnc2 62a_100009814583_100000756272 [0,1,0,0,0,1|1,1,0]=4 1815 B20R2.65825 NC(=O)c1ccc(c(c1)Cl)OCCCn2cccc2 34a_200000192832_200009814367 [0,1,0,0,0,1|2,0,0]=4 1816 B20R2.65825 NC(=O)c1ccc(c(c1)Cl)OCCCn2cccc2 7a_200000192832_200009814367 [0,1,0,0,0,1|2,0,0]=4 1817 B20R2.65825 NC(=O)c1ccc(c(c1)Cl)OCCCn2ccnc2 34a_200000192832_100000756272 [0,1,0,0,0,1|1,0,0]=3 1818 B20R2.65825 NC(=O)c1ccc(c(c1)Cl)OCCCn2ccnc2 7a_200000192832_100000756272 [0,1,0,0,0,1|1,0,0]=3 1819 B20R2.65825 NC(=O)c1ccc(c(c1)Cl)OCCCn2cncn2 34a_200000192832_100102700105 [0,1,0,0,0,1|2,0,0]=4 1820 B20R2.65825 NC(=O)c1ccc(c(c1)Cl)OCCCn2cncn2 7a_200000192832_100102700105 [0,1,0,0,0,1|2,0,0]=4 1821 B20R2.65825 NC(=O)c1ccc(c(c1)F)NCCCn2ccnc2 27a_100000210438_100000686215 [0,1,0,0,0,1|2,0,0]=4 1822 B20R2.65825 NC(=O)c1ccc(c(c1)F)SCCCn2ccnc2 62a_100000686215_100000756272 [0,1,0,0,0,1|1,1,0]=4 1823 B20R2.65825 NC(=O)c1ccc(c(c1)F)SCCCn2ccnc2 62a_100000756272_100000686215 [0,1,0,0,0,1|1,1,0]=4 1824 B20R2.65825 NC(=O)c1ccc(c(c1)O)SCCCn2ccnc2 62a_100000756272_100012344895 [0,1,0,0,0,1|1,1,0]=4 1825 B20R2.65825 NC(=O)c1ccc(c(c1)O)SCCCn2ccnc2 62a_100012344895_100000756272 [0,1,0,0,0,1|1,1,0]=4 1826 B20R2.65825 Nc1cc(ccc1OCCCn2ccnc2)[N+](=O)[O-] 34a_100000181223_100000756272 [0,1,0,0,0,1|1,0,1]=4 1827 B20R2.65825 Nc1cc(ccc1OCCCn2ccnc2)[N+](=O)[O-] 7a_100000181223_100000756272 [0,1,0,0,0,1|1,0,1]=4 1828 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)Br)COCCn2ccnc2 34a_100000719764_100000741879 [0,1,0,0,0,1|1,0,1]=4 1829 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)Br)OCCCn2ccnc2 34a_100000756651_100000756272 [0,1,0,0,0,1|1,0,1]=4 1830 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)Br)OCCCn2ccnc2 7a_100000756651_100000756272 [0,1,0,0,0,1|1,0,1]=4 1831 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)Cl)COCCn2ccnc2 34a_100000719764_100000747184 [0,1,0,0,0,1|1,0,1]=4 1832 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)Cl)COCCn2ccnc2 7a_100000694850_100000702546 [0,1,0,0,0,1|1,0,1]=4 1833 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)Cl)OCCCn2ccnc2 34a_100000206008_100000756272 [0,1,0,0,0,1|1,0,1]=4 1834 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)Cl)OCCCn2ccnc2 7a_100000206008_100000756272 [0,1,0,0,0,1|1,0,1]=4 1835 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)F)COCCn2ccnc2 34a_100000719764_100000759423 [0,1,0,0,0,1|1,0,1]=4 1836 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)F)COCCn2ccnc2 7a_100012002375_100000702546 [0,1,0,0,0,1|1,0,1]=4 1837 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)F)OCCCn2ccnc2 34a_100000739697_100000756272 [0,1,0,0,0,1|1,0,1]=4 1838 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)F)OCCCn2ccnc2 7a_100000739697_100000756272 [0,1,0,0,0,1|1,0,1]=4 1839 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)I)COCCn2ccnc2 7a_200010150283_100000702546 [0,1,0,0,0,1|1,0,1]=4 1840 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)I)OCCCn2ccnc2 34a_100012047213_100000756272 [0,1,0,0,0,1|1,0,1]=4 1841 B20R2.65825 O=[N+]([O-])c1ccc(c(c1)I)OCCCn2ccnc2 7a_100012047213_100000756272 [0,1,0,0,0,1|1,0,1]=4 1842 B20R2.65910 CC(=O)c1ccc(cc1Br)OCCCn2cccc2 34a_100012340537_200009814367 [0,1,0,0,0,1|2,0,0]=4 1843 B20R2.65910 CC(=O)c1ccc(cc1Br)OCCCn2cccc2 7a_100012340537_200009814367 [0,1,0,0,0,1|2,0,0]=4 1844 B20R2.65910 CC(=O)c1ccc(cc1Br)OCCCn2ccnc2 34a_100012340537_100000756272 [0,1,0,0,0,1|1,0,0]=3 1845 B20R2.65910 CC(=O)c1ccc(cc1Br)OCCCn2ccnc2 7a_100012340537_100000756272 [0,1,0,0,0,1|1,0,0]=3 1846 B20R2.65910 CC(=O)c1ccc(cc1Br)OCCCn2cncn2 34a_100012340537_100102700105 [0,1,0,0,0,1|2,0,0]=4 1847 B20R2.65910 CC(=O)c1ccc(cc1Br)OCCCn2cncn2 7a_100012340537_100102700105 [0,1,0,0,0,1|2,0,0]=4 1848 B20R2.65910 CC(=O)c1ccc(cc1C)OCCCn2cccc2 34a_100000702595_200009814367 [0,1,0,0,0,1|2,0,0]=4 1849 B20R2.65910 CC(=O)c1ccc(cc1C)OCCCn2cccc2 7a_100000702595_200009814367 [0,1,0,0,0,1|2,0,0]=4 1850 B20R2.65910 CC(=O)c1ccc(cc1C)OCCCn2ccnc2 34a_100000702595_100000756272 [0,1,0,0,0,1|1,0,0]=3 1851 B20R2.65910 CC(=O)c1ccc(cc1C)OCCCn2ccnc2 7a_100000702595_100000756272 [0,1,0,0,0,1|1,0,0]=3 1852 B20R2.65910 CC(=O)c1ccc(cc1C)OCCCn2cncn2 34a_100000702595_100102700105 [0,1,0,0,0,1|2,0,0]=4 1853 B20R2.65910 CC(=O)c1ccc(cc1C)OCCCn2cncn2 7a_100000702595_100102700105 [0,1,0,0,0,1|2,0,0]=4 1854 B20R2.65910 CC(=O)c1ccc(cc1C)SCCCn2ccnc2 62a_100000756272_100012360112 [0,1,0,0,0,1|1,1,0]=4 1855 B20R2.65910 CC(=O)c1ccc(cc1C)SCCCn2ccnc2 62a_100012360112_100000756272 [0,1,0,0,0,1|1,1,0]=4 1856 B20R2.65910 CC(=O)c1ccc(cc1Cl)OCCCn2cccc2 34a_100011933989_200009814367 [0,1,0,0,0,1|2,0,0]=4 1857 B20R2.65910 CC(=O)c1ccc(cc1Cl)OCCCn2cccc2 7a_100011933989_200009814367 [0,1,0,0,0,1|2,0,0]=4 1858 B20R2.65910 CC(=O)c1ccc(cc1Cl)OCCCn2ccnc2 34a_100011933989_100000756272 [0,1,0,0,0,1|1,0,0]=3 1859 B20R2.65910 CC(=O)c1ccc(cc1Cl)OCCCn2ccnc2 7a_100011933989_100000756272 [0,1,0,0,0,1|1,0,0]=3 1860 B20R2.65910 CC(=O)c1ccc(cc1Cl)OCCCn2cncn2 34a_100011933989_100102700105 [0,1,0,0,0,1|2,0,0]=4 1861 B20R2.65910 CC(=O)c1ccc(cc1Cl)OCCCn2cncn2 7a_100011933989_100102700105 [0,1,0,0,0,1|2,0,0]=4 1862 B20R2.65910 CC(=O)c1ccc(cc1F)NCCCn2ccnc2 27a_100000210438_100000690205 [0,1,0,0,0,1|2,0,0]=4 1863 B20R2.65910 CC(=O)c1ccc(cc1F)OCCCn2cccc2 34a_100000752407_200009814367 [0,1,0,0,0,1|2,0,0]=4 1864 B20R2.65910 CC(=O)c1ccc(cc1F)OCCCn2cccc2 7a_100000752407_200009814367 [0,1,0,0,0,1|2,0,0]=4 1865 B20R2.65910 CC(=O)c1ccc(cc1F)OCCCn2ccnc2 34a_100000752407_100000756272 [0,1,0,0,0,1|1,0,0]=3 1866 B20R2.65910 CC(=O)c1ccc(cc1F)OCCCn2ccnc2 7a_100000752407_100000756272 [0,1,0,0,0,1|1,0,0]=3 1867 B20R2.65910 CC(=O)c1ccc(cc1F)OCCCn2cncn2 34a_100000752407_100102700105 [0,1,0,0,0,1|2,0,0]=4 1868 B20R2.65910 CC(=O)c1ccc(cc1F)OCCCn2cncn2 7a_100000752407_100102700105 [0,1,0,0,0,1|2,0,0]=4 1869 B20R2.65910 CC(=O)c1ccc(cc1F)SCCCn2ccnc2 62a_100000690205_100000756272 [0,1,0,0,0,1|1,1,0]=4 1870 B20R2.65910 CC(=O)c1ccc(cc1N)SCCCn2ccnc2 62a_100011590516_100000756272 [0,1,0,0,0,1|1,1,0]=4 1871 B20R2.65910 Cc1cc(ccc1C(=O)N)NCCCn2ccnc2 27a_100000210438_100011327924 [0,1,0,0,0,1|2,0,0]=4 1872 B20R2.65910 Cc1cc(ccc1C(=O)N)NCCCn2ccnc2 34a_200000751758_100000756272 [0,1,0,0,0,1|2,0,0]=4 1873 B20R2.65910 Cc1cc(ccc1C(=O)N)NCCCn2ccnc2 7a_200000751758_100000756272 [0,1,0,0,0,1|2,0,0]=4 1874 B20R2.65910 Cc1cc(ccc1C(=O)N)SCCCn2ccnc2 62a_100000756272_100011327924 [0,1,0,0,0,1|1,1,0]=4 1875 B20R2.65910 Cc1cc(ccc1C(=O)N)SCCCn2ccnc2 62a_100011327924_100000756272 [0,1,0,0,0,1|1,1,0]=4 1876 B20R2.65910 Cc1cc(ccc1[N+](=O)[O-])COCCn2ccnc2 34a_100000719764_100009816690 [0,1,0,0,0,1|1,0,1]=4 1877 B20R2.65910 Cc1cc(ccc1[N+](=O)[O-])COCCn2ccnc2 7a_100000032365_100000702546 [0,1,0,0,0,1|1,0,1]=4 1878 B20R2.65910 Cc1cc(ccc1[N+](=O)[O-])OCCCn2ccnc2 34a_100000195451_100000756272 [0,1,0,0,0,1|1,0,1]=4 1879 B20R2.65910 Cc1cc(ccc1[N+](=O)[O-])OCCCn2ccnc2 7a_100000195451_100000756272 [0,1,0,0,0,1|1,0,1]=4 1880 B20R2.65910 NC(=O)c1ccc(cc1Br)NCCCn2ccnc2 27a_100000210438_200010146565 [0,1,0,0,0,1|2,0,0]=4 1881 B20R2.65910 NC(=O)c1ccc(cc1Br)SCCCn2ccnc2 62a_200010146565_100000756272 [0,1,0,0,0,1|1,1,0]=4 1882 B20R2.65910 NC(=O)c1ccc(cc1Cl)NCCCn2ccnc2 34a_100000737725_100000756272 [0,1,0,0,0,1|2,0,0]=4 1883 B20R2.65910 NC(=O)c1ccc(cc1Cl)NCCCn2ccnc2 7a_100000737725_100000756272 [0,1,0,0,0,1|2,0,0]=4 1884 B20R2.65910 NC(=O)c1ccc(cc1Cl)OCCCn2cccc2 34a_100011997949_200009814367 [0,1,0,0,0,1|2,0,0]=4 1885 B20R2.65910 NC(=O)c1ccc(cc1Cl)OCCCn2cccc2 7a_100011997949_200009814367 [0,1,0,0,0,1|2,0,0]=4 1886 B20R2.65910 NC(=O)c1ccc(cc1Cl)OCCCn2ccnc2 34a_100011997949_100000756272 [0,1,0,0,0,1|1,0,0]=3 1887 B20R2.65910 NC(=O)c1ccc(cc1Cl)OCCCn2ccnc2 7a_100011997949_100000756272 [0,1,0,0,0,1|1,0,0]=3 1888 B20R2.65910 NC(=O)c1ccc(cc1Cl)OCCCn2cncn2 34a_100011997949_100102700105 [0,1,0,0,0,1|2,0,0]=4 1889 B20R2.65910 NC(=O)c1ccc(cc1Cl)OCCCn2cncn2 7a_100011997949_100102700105 [0,1,0,0,0,1|2,0,0]=4 1890 B20R2.65910 NC(=O)c1ccc(cc1F)NCCCn2ccnc2 27a_100000210438_100000216903 [0,1,0,0,0,1|2,0,0]=4 1891 B20R2.65910 NC(=O)c1ccc(cc1F)NCCCn2ccnc2 34a_100000749959_100000756272 [0,1,0,0,0,1|2,0,0]=4 1892 B20R2.65910 NC(=O)c1ccc(cc1F)NCCCn2ccnc2 7a_100000749959_100000756272 [0,1,0,0,0,1|2,0,0]=4 1893 B20R2.65910 NC(=O)c1ccc(cc1F)OCCCn2cccc2 34a_200012186767_200009814367 [0,1,0,0,0,1|2,0,0]=4 1894 B20R2.65910 NC(=O)c1ccc(cc1F)OCCCn2cccc2 7a_200012186767_200009814367 [0,1,0,0,0,1|2,0,0]=4 1895 B20R2.65910 NC(=O)c1ccc(cc1F)OCCCn2ccnc2 34a_200012186767_100000756272 [0,1,0,0,0,1|1,0,0]=3 1896 B20R2.65910 NC(=O)c1ccc(cc1F)OCCCn2ccnc2 7a_200012186767_100000756272 [0,1,0,0,0,1|1,0,0]=3 1897 B20R2.65910 NC(=O)c1ccc(cc1F)OCCCn2cncn2 34a_200012186767_100102700105 [0,1,0,0,0,1|2,0,0]=4 1898 B20R2.65910 NC(=O)c1ccc(cc1F)OCCCn2cncn2 7a_200012186767_100102700105 [0,1,0,0,0,1|2,0,0]=4 1899 B20R2.65910 NC(=O)c1ccc(cc1F)SCCCn2ccnc2 62a_100000216903_100000756272 [0,1,0,0,0,1|1,1,0]=4 1900 B20R2.65910 NC(=O)c1ccc(cc1N)OCCCn2cccc2 34a_100012186684_200009814367 [0,1,0,0,0,1|2,0,0]=4 1901 B20R2.65910 NC(=O)c1ccc(cc1N)OCCCn2cccc2 7a_100012186684_200009814367 [0,1,0,0,0,1|2,0,0]=4 1902 B20R2.65910 NC(=O)c1ccc(cc1N)OCCCn2ccnc2 34a_100012186684_100000756272 [0,1,0,0,0,1|1,0,0]=3 1903 B20R2.65910 NC(=O)c1ccc(cc1N)OCCCn2ccnc2 7a_100012186684_100000756272 [0,1,0,0,0,1|1,0,0]=3 1904 B20R2.65910 NC(=O)c1ccc(cc1N)OCCCn2cncn2 34a_100012186684_100102700105 [0,1,0,0,0,1|2,0,0]=4 1905 B20R2.65910 NC(=O)c1ccc(cc1N)OCCCn2cncn2 7a_100012186684_100102700105 [0,1,0,0,0,1|2,0,0]=4 1906 B20R2.65910 NC(=O)c1ccc(cc1N)SCCCn2ccnc2 62a_100012349972_100000756272 [0,1,0,0,0,1|1,1,0]=4 1907 B20R2.65910 NC(=O)c1ccc(cc1O)NCCCn2ccnc2 34a_100000223280_100000756272 [0,1,0,0,0,1|2,0,0]=4 1908 B20R2.65910 NC(=O)c1ccc(cc1O)NCCCn2ccnc2 7a_100000223280_100000756272 [0,1,0,0,0,1|2,0,0]=4 1909 B20R2.65910 NC(=O)c1ccc(cc1O)SCCCn2ccnc2 62a_100011550861_100000756272 [0,1,0,0,0,1|1,1,0]=4 1910 B20R2.65910 Nc1cc(ccc1[N+](=O)[O-])OCCCn2ccnc2 7a_100000729835_100000756272 [0,1,0,0,0,1|1,0,1]=4 1911 B20R2.65910 O=[N+]([O-])c1ccc(cc1Br)OCCCn2ccnc2 34a_100012356988_100000756272 [0,1,0,0,0,1|1,0,1]=4 1912 B20R2.65910 O=[N+]([O-])c1ccc(cc1Br)OCCCn2ccnc2 7a_100012356988_100000756272 [0,1,0,0,0,1|1,0,1]=4 1913 B20R2.65910 O=[N+]([O-])c1ccc(cc1Cl)OCCCn2ccnc2 34a_100000746235_100000756272 [0,1,0,0,0,1|1,0,1]=4 1914 B20R2.65910 O=[N+]([O-])c1ccc(cc1Cl)OCCCn2ccnc2 7a_100000746235_100000756272 [0,1,0,0,0,1|1,0,1]=4 1915 B20R2.65910 O=[N+]([O-])c1ccc(cc1F)COCCn2ccnc2 34a_100000719764_100000687068 [0,1,0,0,0,1|1,0,1]=4 1916 B20R2.65910 O=[N+]([O-])c1ccc(cc1F)COCCn2ccnc2 7a_100011219895_100000702546 [0,1,0,0,0,1|1,0,1]=4 1917 B20R2.65910 O=[N+]([O-])c1ccc(cc1F)OCCCn2ccnc2 7a_100000745333_100000756272 [0,1,0,0,0,1|1,0,1]=4 1918 B20R2.65910 O=[N+]([O-])c1ccc(cc1I)OCCCn2ccnc2 7a_100010243554_100000756272 [0,1,0,0,0,1|1,0,1]=4 1919 B20R2.67371 CC(=O)c1ccc(cc1)COCCn2cc[n+](c2)C 34a_100000070320_100000756337 [0,1,0,0,0,1|1,0,1]=4 1920 B20R2.67371 C[n+]1ccn(c1)CCOCc2ccc(cc2)C(=O)N 34a_100000070320_100000231043 [0,1,0,0,0,1|1,0,1]=4 1921 B20R2.77192 C=C(C)c1ccc(cc1)OCCCn2ccnc2C 34a_100009880102_100000690325 [0,1,0,0,0,1|2,0,0]=4 1922 B20R2.77192 C=C(C)c1ccc(cc1)OCCCn2ccnc2C 7a_100009880102_100000690325 [0,1,0,0,0,1|2,0,0]=4 1923 B20R2.77192 CC(=O)c1ccc(cc1)CNCCn2ccnc2C 34a_100015184736_100000756337 [0,1,0,0,0,1|2,0,0]=4 1924 B20R2.77192 CC(=O)c1ccc(cc1)COCCn2ccnc2C 34a_100000702865_100000756337 [0,1,0,0,0,1|1,0,0]=3 1925 B20R2.77192 CC(=O)c1ccc(cc1)COCCn2ccnc2C 7a_100000082505_100000742477 [0,1,0,0,0,1|1,0,0]=3 1926 B20R2.77192 CC(=O)c1ccc(cc1)COCCn2ccnc2C 7a_100000702865_100000756337 [0,1,0,0,0,1|1,0,0]=3 1927 B20R2.77192 CC(=O)c1ccc(cc1)CSCCn2ccnc2C 62a_100000742477_100000756337 [0,1,0,0,0,1|1,1,0]=4 1928 B20R2.77192 CC(=O)c1ccc(cc1)CSCCn2ccnc2C 62a_100000756337_100000742477 [0,1,0,0,0,1|1,1,0]=4 1929 B20R2.77192 CC(=O)c1ccc(cc1)OCCCn2ccnc2C 34a_100000185113_100000690325 [0,1,0,0,0,1|1,0,0]=3 1930 B20R2.77192 CC(=O)c1ccc(cc1)OCCCn2ccnc2C 7a_100000185113_100000690325 [0,1,0,0,0,1|1,0,0]=3 1931 B20R2.77192 CC(=O)c1ccc(cc1)SCCCn2ccnc2C 62a_100000185465_100000690325 [0,1,0,0,0,1|1,1,0]=4 1932 B20R2.77192 CC(=O)c1ccc(cc1)SCCCn2ccnc2C 62a_100000690325_100000185465 [0,1,0,0,0,1|1,1,0]=4 1933 B20R2.77192 CC(=O)c1ccc(cn1)OCCCn2ccnc2C 34a_100012001710_100000690325 [0,1,0,0,0,1|2,0,0]=4 1934 B20R2.77192 CC(=O)c1ccc(cn1)OCCCn2ccnc2C 7a_100012001710_100000690325 [0,1,0,0,0,1|2,0,0]=4 1935 B20R2.77192 Cc1nccn1CCCNc2ccc(cc2)C(=O)N 27a_100000728124_100000162191 [0,1,0,0,0,1|2,0,0]=4 1936 B20R2.77192 Cc1nccn1CCCNc2ccc(cc2)C(=O)N 34a_100000210537_100000690325 [0,1,0,0,0,1|2,0,0]=4 1937 B20R2.77192 Cc1nccn1CCCOc2ccc(cc2)C(=O)N 34a_100000746352_100000690325 [0,1,0,0,0,1|1,0,0]=3 1938 B20R2.77192 Cc1nccn1CCCOc2ccc(cc2)C(=O)N 7a_100000746352_100000690325 [0,1,0,0,0,1|1,0,0]=3 1939 B20R2.77192 Cc1nccn1CCCOc2ccc(cc2)C(C)O 34a_100000754508_100000690325 [0,1,0,0,0,1|1,0,1]=4 1940 B20R2.77192 Cc1nccn1CCCOc2ccc(cc2)C(C)O 7a_100000754508_100000690325 [0,1,0,0,0,1|1,0,1]=4 1941 B20R2.77192 Cc1nccn1CCCOc2ccc(cc2)S(=O)C 34a_200000064373_100000690325 [0,1,0,0,0,1|2,0,0]=4 1942 B20R2.77192 Cc1nccn1CCCOc2ccc(cc2)S(=O)C 7a_200000064373_100000690325 [0,1,0,0,0,1|2,0,0]=4 1943 B20R2.77192 Cc1nccn1CCCOc2ccc(cc2)[N+](=O)[O-] 34a_100000185810_100000690325 [0,1,0,0,0,1|1,0,1]=4 1944 B20R2.77192 Cc1nccn1CCCOc2ccc(cc2)[N+](=O)[O-] 7a_100000185810_100000690325 [0,1,0,0,0,1|1,0,1]=4 1945 B20R2.77192 Cc1nccn1CCCSc2ccc(cc2)C(=O)N 62a_100000162191_100000690325 [0,1,0,0,0,1|1,1,0]=4 1946 B20R2.77192 Cc1nccn1CCCSc2ccc(cc2)C(=O)N 62a_100000690325_100000162191 [0,1,0,0,0,1|1,1,0]=4 1947 B20R2.77192 Cc1nccn1CCNCc2ccc(cc2)C(=O)N 207a_100015184736_100000038677 [0,1,0,0,0,1|2,0,0]=4 1948 B20R2.77192 Cc1nccn1CCNCc2ccc(cc2)C(=O)N 270004a_100015184736_100000038677 [0,1,0,0,0,1|2,0,0]=4 1949 B20R2.77192 Cc1nccn1CCNCc2ccc(cc2)C(=O)N 34a_100015184736_100000231043 [0,1,0,0,0,1|2,0,0]=4 1950 B20R2.77192 Cc1nccn1CCNCc2ccc(cc2)C(=O)O 269956a_100000181780_100000742477 [0,1,0,0,0,1|1,0,0]=3 1951 B20R2.77192 Cc1nccn1CCNCc2ccc(nc2)C(=O)O 269956a_100000762669_100000742477 [0,1,0,0,0,1|2,0,0]=4 1952 B20R2.77192 Cc1nccn1CCOCc2ccc(cc2)B(O)O 34a_100000702865_100009813762 [0,1,0,0,0,1|1,0,1]=4 1953 B20R2.77192 Cc1nccn1CCOCc2ccc(cc2)B(O)O 7a_100000702865_100009813762 [0,1,0,0,0,1|1,0,1]=4 1954 B20R2.77192 Cc1nccn1CCOCc2ccc(cc2)C(=O)N 34a_100000702865_100000231043 [0,1,0,0,0,1|1,0,0]=3 1955 B20R2.77192 Cc1nccn1CCOCc2ccc(cc2)C(=O)N 7a_100000162016_100000742477 [0,1,0,0,0,1|1,0,0]=3 1956 B20R2.77192 Cc1nccn1CCOCc2ccc(cc2)C(=O)N 7a_100000702865_100000231043 [0,1,0,0,0,1|1,0,0]=3 1957 B20R2.77192 Cc1nccn1CCOCc2ccc(cc2)[N+](=O)[O-] 34a_100000702865_100000181861 [0,1,0,0,0,1|1,0,1]=4 1958 B20R2.77192 Cc1nccn1CCOCc2ccc(cc2)[N+](=O)[O-] 7a_100000702865_100000181861 [0,1,0,0,0,1|1,0,1]=4 1959 B20R2.77192 Cc1nccn1CCSCc2ccc(cc2)C(=O)N 62a_100000231043_100000742477 [0,1,0,0,0,1|1,1,0]=4 1960 B20R2.77192 Cc1nccn1CCSCc2ccc(cc2)C(=O)N 62a_100000742477_100000231043 [0,1,0,0,0,1|1,1,0]=4 1961 B20R2.172135 CC(=O)c1ccc(cc1)CC(=O)CCn2ccnc2 1458a_100000176952_100000756337 [0,1,0,0,0,1|2,0,0]=4 1962 B20R2.172135 NC(=O)c1ccc(cc1)CC(=O)CCn2ccnc2 1458a_100000176952_100000231043 [0,1,0,0,0,1|2,0,0]=4 1963 B20R2.172135 NC(=O)c1ccc(cc1)NC(=O)CCn2ccnc2 11a_100000210537_100000176952 [0,1,0,0,0,1|2,0,0]=4 1964 B20R2.172135 NC(=O)c1ccc(cc1)NC(=O)CCn2ccnc2 1626a_100000210537_100000176952 [0,1,0,0,0,1|2,0,0]=4 1965 B20R2.172135 NC(=O)c1ccc(cc1)NC(=O)CCn2ccnc2 22a_100000210537_100000176952 [0,1,0,0,0,1|2,0,0]=4 1966 B20R2.172135 NC(=O)c1ccc(cc1)NC(=O)CCn2ccnc2 527a_100000210537_100000176952 [0,1,0,0,0,1|2,0,0]=4 1967 B20R2.172225 CC(OCCn1cccc1)c2ccc(cc2)C(=O)N 7a_200010363529_200000035178 [0,1,0,0,0,1|2,0,0]=4 1968 B20R2.172225 CC(OCCn1ccnc1)c2ccc(cc2)C(=O)N 7a_200010363529_100000702546 [0,1,0,0,0,1|1,0,0]=3 1969 B20R2.172225 CC(OCCn1ccnc1)c2ccc(cc2)[N+](=O)[O-] 7a_100000246459_100000702546 [0,1,0,0,0,1|1,0,1]=4 1970 B20R2.172225 CC(OCCn1cncn1)c2ccc(cc2)C(=O)N 7a_200010363529_100000731791 [0,1,0,0,0,1|2,0,0]=4 1971 B20R2.172225 C[C@H](NCCn1cccc1)c2ccc(cc2)C(=O)O 269956a_100020638929_200000035178 [0,1,0,0,0,1|2,0,0]=4 1972 B20R2.172225 C[C@H](NCCn1ccnc1)c2ccc(cc2)C(=O)O 269956a_100020638929_100000702546 [0,1,0,0,0,1|1,0,0]=3 1973 B20R2.172225 C[C@H](NCCn1cncn1)c2ccc(cc2)C(=O)O 269956a_100020638929_100000731791 [0,1,0,0,0,1|2,0,0]=4 1974 B20R2.172225 NC(=O)c1ccc(cc1)C(=O)CCCn2ccnc2 1458a_100000230133_100000756272 [0,1,0,0,0,1|2,0,0]=4 1975 B20R2.172225 NC(=O)c1ccc(cc1)C(=O)NCCn2ccnc2 11a_100000230061_100000230133 [0,1,0,0,0,1|2,0,0]=4 1976 B20R2.172225 NC(=O)c1ccc(cc1)C(=O)NCCn2ccnc2 240690a_100000230061_100000230133 [0,1,0,0,0,1|2,0,0]=4 1977 B20R2.17720 CC(=O)Cc1ccc(cc1)OCC(C)n2cncn2 34a_100011218180_200015185000 [0,1,0,0,0,1|2,0,0]=4 1978 B20R2.17720 CC(=O)Cc1ccc(cc1)OCC(C)n2cncn2 7a_100011218180_200015185000 [0,1,0,0,0,1|2,0,0]=4 1979 B20R2.17720 CC(=O)Nc1ccc(cc1)OCC(C)n2cncn2 34a_100000184395_200015185000 [0,1,0,0,0,1|2,0,0]=4 1980 B20R2.17720 CC(=O)Nc1ccc(cc1)OCC(C)n2cncn2 7a_100000184395_200015185000 [0,1,0,0,0,1|2,0,0]=4 1981 B20R2.17720 CC(COc1ccc(cc1)CC(=O)N)n2cncn2 34a_100000020825_200015185000 [0,1,0,0,0,1|2,0,0]=4 1982 B20R2.17728 CC(=O)Nc1ccc(cc1)C(=O)CCn2ccnc2 1458a_100000185149_100000702546 [0,1,0,0,0,1|2,0,0]=4 1983 B20R2.17728 CC(=O)Nc1ccc(cc1)N(C)CCn2ccnc2 269982a_100000219403_100000702546 [0,1,0,0,0,1|2,0,0]=4 1984 B20R2.24660 CC(=C(C)c1ccc(cc1)OCCn2ccnc2)C 271570a_200000049429_100015186965 [0,1,0,0,0,1|2,0,0]=4 1985 B20R2.24660 CC(=O)N(C)c1ccc(cc1)OCCn2cncn2 34a_100000743460_200000749826 [0,1,0,0,0,1|2,0,0]=4 1986 B20R2.24660 CC(=O)N(C)c1ccc(cc1)SCCn2ccnc2 62a_200009816415_100000702546 [0,1,0,0,0,1|1,1,0]=4 1987 B20R2.24660 NC(=O)C(=O)c1ccc(cc1)SCCn2ccnc2 62a_200009822167_100000702546 [0,1,0,0,0,1|1,1,0]=4 1988 B20R2.65743 CC(=O)Cc1ccc(cc1Cl)OCCn2cccc2 7a_200000084595_200000035178 [0,1,0,0,0,1|2,0,0]=4 1989 B20R2.65743 CC(=O)Cc1ccc(cc1Cl)OCCn2ccnc2 7a_200000084595_100000702546 [0,1,0,0,0,1|1,0,0]=3 1990 B20R2.65743 CC(=O)Cc1ccc(cc1Cl)OCCn2cncn2 34a_200000084595_200000749826 [0,1,0,0,0,1|2,0,0]=4 1991 B20R2.65743 CC(=O)Cc1ccc(cc1Cl)OCCn2cncn2 7a_200000084595_100000731791 [0,1,0,0,0,1|2,0,0]=4 1992 B20R2.65743 CC(=O)Nc1ccc(cc1C)NCCn2ccnc2 7a_100000736504_100000702546 [0,1,0,0,0,1|2,0,0]=4 1993 B20R2.65743 CC(=O)Nc1ccc(cc1C)SCCn2ccnc2 62a_100000702546_100000152120 [0,1,0,0,0,1|1,1,0]=4 1994 B20R2.65743 CC(=O)Nc1ccc(cc1Cl)NCCn2ccnc2 7a_100000244014_100000702546 [0,1,0,0,0,1|2,0,0]=4 1995 B20R2.65743 CC(=O)Nc1ccc(cc1Cl)SCCn2ccnc2 62a_100000702546_100011273303 [0,1,0,0,0,1|1,1,0]=4 1996 B20R2.65743 CC(=O)Nc1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100000155584 [0,1,0,0,0,1|1,1,0]=4 1997 B20R2.65743 CC(=O)Oc1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100009811628 [0,1,0,0,0,1|1,1,0]=4 1998 B20R2.65743 CC(=O)Oc1ccc(cc1F)SCCn2ccnc2 62a_100009811628_100000702546 [0,1,0,0,0,1|1,1,0]=4 1999 B20R2.65746 CC(=O)Cc1ccc(c(c1)Br)OCCn2cccc2 7a_100010141077_200000035178 [0,1,0,0,0,1|2,0,0]=4 2000 B20R2.65746 CC(=O)Cc1ccc(c(c1)Br)OCCn2ccnc2 7a_100010141077_100000702546 [0,1,0,0,0,1|1,0,0]=3 2001 B20R2.65746 CC(=O)Cc1ccc(c(c1)Br)OCCn2cncn2 34a_100010141077_200000749826 [0,1,0,0,0,1|2,0,0]=4 2002 B20R2.65746 CC(=O)Cc1ccc(c(c1)Br)OCCn2cncn2 7a_100010141077_100000731791 [0,1,0,0,0,1|2,0,0]=4 2003 B20R2.65746 CC(=O)Cc1ccc(c(c1)C)OCCn2cccc2 7a_200000080089_200000035178 [0,1,0,0,0,1|2,0,0]=4 2004 B20R2.65746 CC(=O)Cc1ccc(c(c1)C)OCCn2ccnc2 7a_200000080089_100000702546 [0,1,0,0,0,1|1,0,0]=3 2005 B20R2.65746 CC(=O)Cc1ccc(c(c1)C)OCCn2cncn2 34a_200000080089_200000749826 [0,1,0,0,0,1|2,0,0]=4 2006 B20R2.65746 CC(=O)Cc1ccc(c(c1)C)OCCn2cncn2 7a_200000080089_100000731791 [0,1,0,0,0,1|2,0,0]=4 2007 B20R2.65746 CC(=O)Cc1ccc(c(c1)Cl)OCCn2cccc2 7a_200000080078_200000035178 [0,1,0,0,0,1|2,0,0]=4 2008 B20R2.65746 CC(=O)Cc1ccc(c(c1)Cl)OCCn2ccnc2 7a_200000080078_100000702546 [0,1,0,0,0,1|1,0,0]=3 2009 B20R2.65746 CC(=O)Cc1ccc(c(c1)Cl)OCCn2cncn2 34a_200000080078_200000749826 [0,1,0,0,0,1|2,0,0]=4 2010 B20R2.65746 CC(=O)Cc1ccc(c(c1)Cl)OCCn2cncn2 7a_200000080078_100000731791 [0,1,0,0,0,1|2,0,0]=4 2011 B20R2.65746 CC(=O)Nc1ccc(c(c1)C)OCCn2cccc2 7a_100012186693_200000035178 [0,1,0,0,0,1|2,0,0]=4 2012 B20R2.65746 CC(=O)Nc1ccc(c(c1)C)OCCn2ccnc2 7a_100012186693_100000702546 [0,1,0,0,0,1|1,0,0]=3 2013 B20R2.65746 CC(=O)Nc1ccc(c(c1)C)OCCn2cncn2 34a_100012186693_200000749826 [0,1,0,0,0,1|2,0,0]=4 2014 B20R2.65746 CC(=O)Nc1ccc(c(c1)C)OCCn2cncn2 7a_100012186693_100000731791 [0,1,0,0,0,1|2,0,0]=4 2015 B20R2.65746 CC(=O)Nc1ccc(c(c1)C)SCCn2ccnc2 62a_100000702546_100000155607 [0,1,0,0,0,1|1,1,0]=4 2016 B20R2.65746 CC(=O)Nc1ccc(c(c1)Cl)OCCn2cccc2 7a_100011215158_200000035178 [0,1,0,0,0,1|2,0,0]=4 2017 B20R2.65746 CC(=O)Nc1ccc(c(c1)Cl)OCCn2ccnc2 7a_100011215158_100000702546 [0,1,0,0,0,1|1,0,0]=3 2018 B20R2.65746 CC(=O)Nc1ccc(c(c1)Cl)OCCn2cncn2 34a_100011215158_200000749826 [0,1,0,0,0,1|2,0,0]=4 2019 B20R2.65746 CC(=O)Nc1ccc(c(c1)Cl)OCCn2cncn2 7a_100011215158_100000731791 [0,1,0,0,0,1|2,0,0]=4 2020 B20R2.65746 CC(=O)Nc1ccc(c(c1)F)SCCn2ccnc2 62a_100000702546_100011219590 [0,1,0,0,0,1|1,1,0]=4 2021 B20R2.65746 Cc1cc(ccc1SCCn2ccnc2)NC(=O)N 62a_100000702546_100000238934 [0,1,0,0,0,1|1,1,0]=4 2022 B20R2.76995 CC(=O)Cc1ccc(cc1)OCCn2ccnc2C 7a_100011218180_100000742477 [0,1,0,0,0,1|1,0,0]=3 2023 B20R2.76995 CC(=O)Cc1ccc(cc1)SCCn2ccnc2C 62a_100000691760_100000742477 [0,1,0,0,0,1|1,1,0]=4 2024 B20R2.76995 CC(=O)Cc1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000691760 [0,1,0,0,0,1|1,1,0]=4 2025 B20R2.76995 CC(=O)Nc1ccc(cc1)OCCn2ccnc2C 7a_100000184395_100000742477 [0,1,0,0,0,1|1,0,0]=3 2026 B20R2.76995 CC(=O)Nc1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000155215 [0,1,0,0,0,1|1,1,0]=4 2027 B20R2.76995 CC(=O)Nc1ccc(cn1)OCCn2ccnc2C 7a_200000094647_100000742477 [0,1,0,0,0,1|2,0,0]=4 2028 B20R2.76995 CC(=O)Oc1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000002173 [0,1,0,0,0,1|1,1,0]=4 2029 B20R2.76995 CC(=O)Sc1ccc(cc1)SCCn2ccnc2C 62a_200009995050_100000742477 [0,1,0,0,0,1|1,1,0]=4 2030 B20R2.76995 Cc1nccn1CCNc2ccc(cc2)CC(=O)N 2230a_100000738315_100000742477 [0,1,0,0,0,1|2,0,0]=4 2031 B20R2.76995 Cc1nccn1CCSc2ccc(cc2)CC(=O)N 62a_100000162331_100000742477 [0,1,0,0,0,1|1,1,0]=4 2032 B20R2.76995 Cc1nccn1CCSc2ccc(cc2)CC(=O)N 62a_100000742477_100000162331 [0,1,0,0,0,1|1,1,0]=4 2033 B20R2.76995 Cc1nccn1CCSc2ccc(cc2)NC(=O)N 62a_100000742477_100000198584 [0,1,0,0,0,1|1,1,0]=4 2034 B20R2.331097 C=CC(=O)Nc1ccc(cc1)OCCn2cncn2 34a_100011235904_200000749826 [0,1,0,0,0,1|2,0,0]=4 2035 B20R2.331097 CC(CO)Sc1ccc(cc1)OCCn2ccnc2 62a_100012180447_100015186965 [0,1,0,0,0,1|1,0,1]=4 2036 B20R2.331097 CCC(=O)Nc1ccc(cc1)OCCn2cccc2 7a_200000243810_200000035178 [0,1,0,0,0,1|2,0,0]=4 2037 B20R2.331097 CCC(=O)Nc1ccc(cc1)OCCn2ccnc2 7a_200000243810_100000702546 [0,1,0,0,0,1|1,0,0]=3 2038 B20R2.331097 CCC(=O)Nc1ccc(cc1)OCCn2cncn2 34a_200000243810_200000749826 [0,1,0,0,0,1|2,0,0]=4 2039 B20R2.331097 CCC(=O)Nc1ccc(cc1)OCCn2cncn2 7a_200000243810_100000731791 [0,1,0,0,0,1|2,0,0]=4 2040 B20R2.331097 CCC(=O)Oc1ccc(cc1)SCCn2ccnc2 62a_100000702546_200009811598 [0,1,0,0,0,1|1,1,0]=4 2041 B20R2.331097 CNC(=O)Cc1ccc(cc1)OCCn2cncn2 34a_200000020795_200000749826 [0,1,0,0,0,1|2,0,0]=4 2042 B20R2.331097 CNC(=O)Cc1ccc(cc1)SCCn2ccnc2 62a_100000155101_100000702546 [0,1,0,0,0,1|1,1,0]=4 2043 B20R2.331097 CNC(=O)Cc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000155101 [0,1,0,0,0,1|1,1,0]=4 2044 B20R2.331097 COC(=O)Cc1ccc(cc1)OCCn2cccn2 34a_100000211648_100015204718 [0,1,0,0,0,1|2,0,0]=4 2045 B20R2.331097 COC(=O)Cc1ccc(cc1)OCCn2cncn2 34a_100000211648_200000749826 [0,1,0,0,0,1|1,0,0]=3 2046 B20R2.331097 COC(=O)Cc1ccc(cc1)SCCn2cccc2 62a_100000149743_200000035178 [0,1,0,0,0,1|1,1,0]=4 2047 B20R2.331097 COC(=O)Cc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000149743 [0,1,0,0,0,1|1,1,0]=4 2048 B20R2.331097 COC(=O)Cc1ccc(cc1)SCCn2ccnc2 62a_100000149743_100000702546 [0,1,0,0,0,1|0,1,0]=3 2049 B20R2.331097 COC(=O)Cc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000149743 [0,1,0,0,0,1|0,1,0]=3 2050 B20R2.331097 COC(=O)Cc1ccc(cc1)SCCn2cncn2 62a_100000149743_100000731791 [0,1,0,0,0,1|1,1,0]=4 2051 B20R2.331097 COC(=O)Cc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000149743 [0,1,0,0,0,1|1,1,0]=4 2052 B20R2.331097 COC(=O)Cc1ccc(cn1)SCCn2ccnc2 62a_100000702546_100012362609 [0,1,0,0,0,1|1,1,0]=4 2053 B20R2.331097 COC(=O)Cc1ccc(cn1)SCCn2ccnc2 62a_100012362609_100000702546 [0,1,0,0,0,1|1,1,0]=4 2054 B20R2.331097 COC(=O)Cc1ccc(nc1)SCCn2ccnc2 62a_100000071674_100000702546 [0,1,0,0,0,1|1,1,0]=4 2055 B20R2.331097 COC(=O)Cc1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000071674 [0,1,0,0,0,1|1,1,0]=4 2056 B20R2.331097 COC(=O)Nc1ccc(cc1)OCCn2cccn2 34a_100011235918_100015204718 [0,1,0,0,0,1|2,0,0]=4 2057 B20R2.331097 COC(=O)Nc1ccc(cc1)OCCn2cncn2 34a_100011235918_200000749826 [0,1,0,0,0,1|1,0,0]=3 2058 B20R2.331097 COC(=O)Nc1ccc(cc1)SCCn2cccc2 62a_200009811947_100000181880 [0,1,0,0,0,1|1,1,0]=4 2059 B20R2.331097 COC(=O)Nc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000181880 [0,1,0,0,0,1|0,1,0]=3 2060 B20R2.331097 COC(=O)Nc1ccc(cc1)SCCn2cncn2 62a_100000731791_100000181880 [0,1,0,0,0,1|1,1,0]=4 2061 B20R2.331097 COC(=O)Nc1ccc(cn1)SCCn2ccnc2 62a_100000702546_100000188976 [0,1,0,0,0,1|1,1,0]=4 2062 B20R2.331097 COC(C)Sc1ccc(cc1)OCCn2ccnc2 62a_100009879195_100015186965 [0,1,0,0,0,1|1,0,1]=4 2063 B20R2.331097 COC(C)Sc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100009879195 [0,1,0,0,0,1|1,0,1]=4 2064 B20R2.331097 C[C@H](CO)Sc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100016084084 [0,1,0,0,0,1|1,0,1]=4 2065 B20R2.331097 C[C@H](CO)Sc1ccc(cc1)OCCn2ccnc2 62a_100016084084_100015186965 [0,1,0,0,0,1|1,0,1]=4 2066 B20R2.331097 NCC(=O)Nc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000741985 [0,1,0,0,0,1|1,1,0]=4 2067 B20R2.331097 NNC(=O)Cc1ccc(cc1)OCCn2cncn2 34a_100000020777_200000749826 [0,1,0,0,0,1|2,0,0]=4 2068 B20R2.331097 O=C(CCl)Nc1ccc(cc1)OCCn2cncn2 34a_100000233757_200000749826 [0,1,0,0,0,1|2,0,0]=4 2069 B20R2.331097 O=C(CO)Nc1ccc(cc1)NCCn2cncn2 34a_100011269904_200000749826 [0,1,0,0,0,1|2,0,0]=4 2070 B20R2.16356 CC(=NO)c1ccc(cc1)OCC(C)n2cncn2 34a_100000164205_200015185000 [0,2,0,0,0,0|2,0,0]=4 2071 B20R2.16356 CC(COc1ccc(cc1)C(=NO)N)n2cncn2 34a_100000231063_200015185000 [0,2,0,0,0,0|2,0,0]=4 2072 B20R2.16356 CC(COc1ccc(cc1)C(=O)CBr)n2cncn2 7a_100009814261_200015185000 [0,2,0,0,0,0|2,0,0]=4 2073 B20R2.16356 CC(COc1ccc(cc1)C(=O)CCl)n2cncn2 7a_100000018856_200015185000 [0,2,0,0,0,0|2,0,0]=4 2074 B20R2.16356 CC(COc1ccc(cc1)C(=O)CF)n2cncn2 34a_200010654591_200015185000 [0,2,0,0,0,0|2,0,0]=4 2075 B20R2.16356 CC(COc1ccc(cc1)C(=O)CF)n2cncn2 7a_200010654591_200015185000 [0,2,0,0,0,0|2,0,0]=4 2076 B20R2.16356 CC(COc1ccc(cc1)C(=O)NN)n2cncn2 34a_100000185078_200015185000 [0,2,0,0,0,0|2,0,0]=4 2077 B20R2.16356 CC(CSc1ccc(cc1)C(=O)CO)n2cncn2 62a_100011219529_200015185000 [0,2,0,0,0,0|1,1,0]=4 2078 B20R2.16356 CC(CSc1ccc(cc1)C(=O)CO)n2cncn2 62a_200015185000_100011219529 [0,2,0,0,0,0|1,1,0]=4 2079 B20R2.16356 CCC(=O)c1ccc(cc1)OCC(C)n2cncn2 34a_100000212119_200015185000 [0,2,0,0,0,0|2,0,0]=4 2080 B20R2.16356 CCC(=O)c1ccc(cc1)OCC(C)n2cncn2 7a_100000212119_200015185000 [0,2,0,0,0,0|2,0,0]=4 2081 B20R2.16356 CNC(=O)c1ccc(cc1)OCC(C)n2cncn2 34a_100000192141_200015185000 [0,2,0,0,0,0|2,0,0]=4 2082 B20R2.16356 CNC(=O)c1ccc(cc1)OCC(C)n2cncn2 7a_100000192141_200015185000 [0,2,0,0,0,0|2,0,0]=4 2083 B20R2.16356 COC(=O)c1ccc(cc1)OCC(C)n2cncn2 34a_100000150123_200015185000 [0,2,0,0,0,0|1,0,0]=3 2084 B20R2.16356 COC(=O)c1ccc(cc1)OCC(C)n2cncn2 7a_100000150123_200015185000 [0,2,0,0,0,0|1,0,0]=3 2085 B20R2.16356 COC(=O)c1ccc(cc1)SCC(C)n2cncn2 62a_100000150774_200015185000 [0,2,0,0,0,0|1,1,0]=4 2086 B20R2.16356 COC(=O)c1ccc(cc1)SCC(C)n2cncn2 62a_200015185000_100000150774 [0,2,0,0,0,0|1,1,0]=4 2087 B20R2.16356 COC(=O)c1ccc(cn1)OCC(C)n2cncn2 34a_100011997255_200015185000 [0,2,0,0,0,0|2,0,0]=4 2088 B20R2.16356 COC(=O)c1ccc(cn1)OCC(C)n2cncn2 7a_100011997255_200015185000 [0,2,0,0,0,0|2,0,0]=4 2089 B20R2.65812 CC(=O)c1ccc(c(c1)Br)OCC(C)n2cncn2 34a_100011772453_200015185000 [0,2,0,0,0,0|2,0,0]=4 2090 B20R2.65812 CC(=O)c1ccc(c(c1)Br)OCC(C)n2cncn2 7a_100011772453_200015185000 [0,2,0,0,0,0|2,0,0]=4 2091 B20R2.65812 CC(=O)c1ccc(c(c1)C)OCC(C)n2cncn2 34a_100000188726_200015185000 [0,2,0,0,0,0|2,0,0]=4 2092 B20R2.65812 CC(=O)c1ccc(c(c1)C)OCC(C)n2cncn2 7a_100000188726_200015185000 [0,2,0,0,0,0|2,0,0]=4 2093 B20R2.65812 CC(=O)c1ccc(c(c1)Cl)OCC(C)n2cncn2 34a_100000188625_200015185000 [0,2,0,0,0,0|2,0,0]=4 2094 B20R2.65812 CC(=O)c1ccc(c(c1)Cl)OCC(C)n2cncn2 7a_100000188625_200015185000 [0,2,0,0,0,0|2,0,0]=4 2095 B20R2.65812 CC(=O)c1ccc(c(c1)F)OCC(C)n2cncn2 34a_100000751691_200015185000 [0,2,0,0,0,0|2,0,0]=4 2096 B20R2.65812 CC(=O)c1ccc(c(c1)F)OCC(C)n2cncn2 7a_100000751691_200015185000 [0,2,0,0,0,0|2,0,0]=4 2097 B20R2.65812 CC(=O)c1ccc(c(c1)N)OCC(C)n2cncn2 34a_100000117292_200015185000 [0,2,0,0,0,0|2,0,0]=4 2098 B20R2.65812 CC(=O)c1ccc(c(c1)N)OCC(C)n2cncn2 7a_100000117292_200015185000 [0,2,0,0,0,0|2,0,0]=4 2099 B20R2.65812 CC(COc1ccc(cc1Cl)C(=O)N)n2cncn2 34a_200000192832_200015185000 [0,2,0,0,0,0|2,0,0]=4 2100 B20R2.65812 CC(COc1ccc(cc1Cl)C(=O)N)n2cncn2 7a_200000192832_200015185000 [0,2,0,0,0,0|2,0,0]=4 2101 B20R2.65832 CC(=O)c1ccc(cc1Br)OCC(C)n2cncn2 34a_100012340537_200015185000 [0,2,0,0,0,0|2,0,0]=4 2102 B20R2.65832 CC(=O)c1ccc(cc1Br)OCC(C)n2cncn2 7a_100012340537_200015185000 [0,2,0,0,0,0|2,0,0]=4 2103 B20R2.65832 CC(=O)c1ccc(cc1C)OCC(C)n2cncn2 34a_100000702595_200015185000 [0,2,0,0,0,0|2,0,0]=4 2104 B20R2.65832 CC(=O)c1ccc(cc1C)OCC(C)n2cncn2 7a_100000702595_200015185000 [0,2,0,0,0,0|2,0,0]=4 2105 B20R2.65832 CC(=O)c1ccc(cc1Cl)OCC(C)n2cncn2 34a_100011933989_200015185000 [0,2,0,0,0,0|2,0,0]=4 2106 B20R2.65832 CC(=O)c1ccc(cc1Cl)OCC(C)n2cncn2 7a_100011933989_200015185000 [0,2,0,0,0,0|2,0,0]=4 2107 B20R2.65832 CC(=O)c1ccc(cc1F)OCC(C)n2cncn2 34a_100000752407_200015185000 [0,2,0,0,0,0|2,0,0]=4 2108 B20R2.65832 CC(=O)c1ccc(cc1F)OCC(C)n2cncn2 7a_100000752407_200015185000 [0,2,0,0,0,0|2,0,0]=4 2109 B20R2.65832 CC(COc1ccc(c(c1)Cl)C(=O)N)n2cncn2 34a_100011997949_200015185000 [0,2,0,0,0,0|2,0,0]=4 2110 B20R2.65832 CC(COc1ccc(c(c1)Cl)C(=O)N)n2cncn2 7a_100011997949_200015185000 [0,2,0,0,0,0|2,0,0]=4 2111 B20R2.65832 CC(COc1ccc(c(c1)F)C(=O)N)n2cncn2 34a_200012186767_200015185000 [0,2,0,0,0,0|2,0,0]=4 2112 B20R2.65832 CC(COc1ccc(c(c1)F)C(=O)N)n2cncn2 7a_200012186767_200015185000 [0,2,0,0,0,0|2,0,0]=4 2113 B20R2.65832 CC(COc1ccc(c(c1)N)C(=O)N)n2cncn2 34a_100012186684_200015185000 [0,2,0,0,0,0|2,0,0]=4 2114 B20R2.65832 CC(COc1ccc(c(c1)N)C(=O)N)n2cncn2 7a_100012186684_200015185000 [0,2,0,0,0,0|2,0,0]=4 2115 B20R2.16367 COC(=O)c1ccc(cc1)CC(=O)Cn2ccnc2 1458a_100000739072_100000735637 [0,2,0,0,0,0|1,0,1]=4 2116 B20R2.16367 COC(=O)c1ccc(cc1)NC(=O)Cn2ccnc2 188690a_100016994500_100000739072 [0,2,0,0,0,0|1,0,1]=4 2117 B20R2.196438 CCC(Cn1ccnc1)Nc2ccc(cc2)C(=O)N 27a_200015184670_100000162191 [0,2,0,0,0,0|2,0,0]=4 2118 B20R2.16374 CNC(=O)c1ccc(cc1)C(=O)CCn2ccnc2 1458a_100011298788_100000702546 [0,2,0,0,0,0|2,0,0]=4 2119 B20R2.16374 COC(=O)c1ccc(cc1)C(=O)CCn2cccc2 1458a_100000211811_200000035178 [0,2,0,0,0,0|2,0,0]=4 2120 B20R2.16374 COC(=O)c1ccc(cc1)C(=O)CCn2ccnc2 1458a_100000211811_100000702546 [0,2,0,0,0,0|1,0,0]=3 2121 B20R2.16374 COC(=O)c1ccc(cc1)C(=O)CCn2cncn2 1458a_100000211811_100000731791 [0,2,0,0,0,0|2,0,0]=4 2122 B20R2.16374 COC(=O)c1ccc(cc1)N(C)CCn2cccc2 2230a_100000220287_200009811947 [0,2,0,0,0,0|2,0,0]=4 2123 B20R2.16374 COC(=O)c1ccc(cc1)N(C)CCn2cccc2 269982a_100000220287_200000035178 [0,2,0,0,0,0|2,0,0]=4 2124 B20R2.16374 COC(=O)c1ccc(cc1)N(C)CCn2ccnc2 269982a_100000220287_100000702546 [0,2,0,0,0,0|1,0,0]=3 2125 B20R2.16374 COC(=O)c1ccc(cc1)N(C)CCn2cncn2 2230a_100000220287_100000731791 [0,2,0,0,0,0|2,0,0]=4 2126 B20R2.16374 COC(=O)c1ccc(cc1)N(C)CCn2cncn2 269982a_100000220287_100000731791 [0,2,0,0,0,0|2,0,0]=4 2127 B20R2.16374 COC(=O)c1ccc(cc1)N(C)CCn2cncn2 34a_100000220287_200000749826 [0,2,0,0,0,0|2,0,0]=4 2128 B20R2.64501 CCN(CCn1cccc1)c2ccc(cc2)C(=O)O 269956a_100011218868_200000035178 [0,2,0,0,0,0|2,0,0]=4 2129 B20R2.64501 CCN(CCn1ccnc1)c2ccc(cc2)C(=O)O 269956a_100011218868_100000702546 [0,2,0,0,0,0|1,0,0]=3 2130 B20R2.64501 CCN(CCn1cncn1)c2ccc(cc2)C(=O)O 269956a_100011218868_100000731791 [0,2,0,0,0,0|2,0,0]=4 2131 B20R2.65944 Cc1cc(ccc1C(=O)CCn2ccnc2)C(=O)N 1458a_100009913687_100000702546 [0,2,0,0,0,0|2,0,0]=4 2132 B20R2.77161 Cc1nccn1CCC(=O)c2ccc(cc2)C(=O)N 1458a_100000230133_100000742477 [0,2,0,0,0,0|2,0,0]=4 2133 B20R2.77161 Cc1nccn1CCN(C)c2ccc(cc2)C(=O)N 27a_103624766747_100000162191 [0,2,0,0,0,0|2,0,0]=4 2134 B20R2.10159 CCC(=NO)c1ccc(cc1)OCCn2cncn2 34a_100000740173_200000749826 [0,2,0,0,0,0|2,0,0]=4 2135 B20R2.13620 CC#CC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100153741113 [0,2,0,0,0,0|1,1,0]=4 2136 B20R2.13620 CCCC(=O)c1ccc(cc1)OCCn2cccc2 7a_100011216482_200000035178 [0,2,0,0,0,0|2,0,0]=4 2137 B20R2.13620 CCCC(=O)c1ccc(cc1)OCCn2ccnc2 7a_100011216482_100000702546 [0,2,0,0,0,0|1,0,0]=3 2138 B20R2.13620 CCCC(=O)c1ccc(cc1)OCCn2cncn2 34a_100011216482_200000749826 [0,2,0,0,0,0|2,0,0]=4 2139 B20R2.13620 CCCC(=O)c1ccc(cc1)OCCn2cncn2 7a_100011216482_100000731791 [0,2,0,0,0,0|2,0,0]=4 2140 B20R2.13620 CCCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100011267722 [0,2,0,0,0,0|1,1,0]=4 2141 B20R2.13620 CCCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100011267722_100000702546 [0,2,0,0,0,0|1,1,0]=4 2142 B20R2.13620 CCNC(=O)c1ccc(cc1)NCCn2ccnc2 27a_100000230061_100000155177 [0,2,0,0,0,0|2,0,0]=4 2143 B20R2.13620 CCNC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000155177_100000702546 [0,2,0,0,0,0|1,1,0]=4 2144 B20R2.13620 CCNC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000155177 [0,2,0,0,0,0|1,1,0]=4 2145 B20R2.13620 CCOC(=O)c1ccc(cc1)OCCc2cn[nH]c2 7a_100000169885_100000743252 [0,2,0,0,0,0|2,0,0]=4 2146 B20R2.13620 CCOC(=O)c1ccc(cc1)OCCn2cccc2 7a_100000169885_200000035178 [0,2,0,0,0,0|1,0,0]=3 2147 B20R2.13620 CCOC(=O)c1ccc(cc1)OCCn2cccn2 34a_100000169885_100015204718 [0,2,0,0,0,0|2,0,0]=4 2148 B20R2.13620 CCOC(=O)c1ccc(cc1)OCCn2cccn2 7a_100000169885_100000685285 [0,2,0,0,0,0|2,0,0]=4 2149 B20R2.13620 CCOC(=O)c1ccc(cc1)OCCn2ccnc2 7a_100000169885_100000702546 [0,2,0,0,0,0|0,0,0]=2 2150 B20R2.13620 CCOC(=O)c1ccc(cc1)OCCn2cncn2 34a_100000169885_200000749826 [0,2,0,0,0,0|1,0,0]=3 2151 B20R2.13620 CCOC(=O)c1ccc(cc1)OCCn2cncn2 7a_100000169885_100000731791 [0,2,0,0,0,0|1,0,0]=3 2152 B20R2.13620 CCOC(=O)c1ccc(cc1)SCCn2cccc2 62a_100000169895_200000035178 [0,2,0,0,0,0|1,1,0]=4 2153 B20R2.13620 CCOC(=O)c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000169919 [0,2,0,0,0,0|1,1,0]=4 2154 B20R2.13620 CCOC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000169895_100000702546 [0,2,0,0,0,0|0,1,0]=3 2155 B20R2.13620 CCOC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000169919 [0,2,0,0,0,0|0,1,0]=3 2156 B20R2.13620 CCOC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000169895_100000731791 [0,2,0,0,0,0|1,1,0]=4 2157 B20R2.13620 CCOC(=O)c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000169919 [0,2,0,0,0,0|1,1,0]=4 2158 B20R2.13620 CCOC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100000702546_100011781174 [0,2,0,0,0,0|1,1,0]=4 2159 B20R2.13620 CCOC(=O)c1ccc(cn1)SCCn2ccnc2 62a_100011781174_100000702546 [0,2,0,0,0,0|1,1,0]=4 2160 B20R2.13620 CCOC(=O)c1ccc(nc1)NCCn2ccnc2 27a_100000230061_100000170224 [0,2,0,0,0,0|2,0,0]=4 2161 B20R2.13620 CCOC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100000702546_100000170224 [0,2,0,0,0,0|1,1,0]=4 2162 B20R2.13620 CCOC(=O)c1ccc(nc1)SCCn2ccnc2 62a_100011291635_100000702546 [0,2,0,0,0,0|1,1,0]=4 2163 B20R2.13620 COCC(=O)c1ccc(cc1)OCCc2cn[nH]c2 7a_200009861119_100000743252 [0,2,0,0,0,0|2,0,0]=4 2164 B20R2.13620 COCC(=O)c1ccc(cc1)OCCn2cccc2 7a_200009861119_200000035178 [0,2,0,0,0,0|1,0,0]=3 2165 B20R2.13620 COCC(=O)c1ccc(cc1)OCCn2cccn2 34a_200009861119_100015204718 [0,2,0,0,0,0|2,0,0]=4 2166 B20R2.13620 COCC(=O)c1ccc(cc1)OCCn2cccn2 7a_200009861119_100000685285 [0,2,0,0,0,0|2,0,0]=4 2167 B20R2.13620 COCC(=O)c1ccc(cc1)OCCn2ccnc2 7a_200009861119_100000702546 [0,2,0,0,0,0|0,0,0]=2 2168 B20R2.13620 COCC(=O)c1ccc(cc1)OCCn2cncn2 34a_200009861119_200000749826 [0,2,0,0,0,0|1,0,0]=3 2169 B20R2.13620 COCC(=O)c1ccc(cc1)OCCn2cncn2 7a_200009861119_100000731791 [0,2,0,0,0,0|1,0,0]=3 2170 B20R2.13620 COCC(=O)c1ccc(cc1)SCCn2cccc2 62a_200011343064_200000035178 [0,2,0,0,0,0|1,1,0]=4 2171 B20R2.13620 COCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_200011343064_100000702546 [0,2,0,0,0,0|0,1,0]=3 2172 B20R2.13620 COCC(=O)c1ccc(cc1)SCCn2cncn2 62a_200011343064_100000731791 [0,2,0,0,0,0|1,1,0]=4 2173 B20R2.13620 N#CCC(=O)c1ccc(cc1)OCCn2cccc2 7a_100009871544_200000035178 [0,2,0,0,0,0|2,0,0]=4 2174 B20R2.13620 N#CCC(=O)c1ccc(cc1)OCCn2ccnc2 7a_100009871544_100000702546 [0,2,0,0,0,0|1,0,0]=3 2175 B20R2.13620 N#CCC(=O)c1ccc(cc1)OCCn2cncn2 7a_100009871544_100000731791 [0,2,0,0,0,0|2,0,0]=4 2176 B20R2.13620 N#CCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000740217 [0,2,0,0,0,0|1,1,0]=4 2177 B20R2.13620 N#CCC(=O)c1ccc(cc1)SCCn2ccnc2 62a_100000740217_100000702546 [0,2,0,0,0,0|1,1,0]=4 2178 B20R2.13620 O=C(CCCl)c1ccc(cc1)OCCn2cccc2 7a_100009879949_200000035178 [0,2,0,0,0,0|2,0,0]=4 2179 B20R2.13620 O=C(CCCl)c1ccc(cc1)OCCn2ccnc2 7a_100009879949_100000702546 [0,2,0,0,0,0|1,0,0]=3 2180 B20R2.13620 O=C(CCCl)c1ccc(cc1)OCCn2cncn2 7a_100009879949_100000731791 [0,2,0,0,0,0|2,0,0]=4 2181 B20R2.13620 O=C/C=C(/Cl)\c1ccc(cc1)SCCn2ccnc2 62a_100000702546_200020603514 [0,2,0,0,0,0|1,1,0]=4 2182 B20R2.13620 O=C/C=C(/Cl)\c1ccc(cc1)SCCn2ccnc2 62a_200020603514_100000702546 [0,2,0,0,0,0|1,1,0]=4 2183 B20R2.16341 COC(=O)c1ccc(cc1)CCCn2cc(nn2)C 274090a_100010192279_200000242740 [0,2,0,0,0,0|2,0,0]=4 2184 B20R2.16341 COC(=O)c1ccc(cc1)OCCn2cc(cn2)Cl 7a_100000150123_100011353933 [0,2,0,0,0,0|2,0,0]=4 2185 B20R2.16341 COC(=O)c1ccc(cc1)OCCn2cc(nn2)C 274090a_100000742590_200000242740 [0,2,0,0,0,0|1,0,0]=3 2186 B20R2.16341 COC(=O)c1ccc(cc1)OCCn2ccc(n2)C 7a_100000150123_200011934056 [0,2,0,0,0,0|2,0,0]=4 2187 B20R2.16368 CCC(=O)c1ccc(cc1)OCCn2ccnc2C 7a_100000212119_100000742477 [0,2,0,0,0,0|1,0,0]=3 2188 B20R2.16368 CCC(=O)c1ccc(cc1)SCCn2ccnc2C 62a_100000211647_100000742477 [0,2,0,0,0,0|1,1,0]=4 2189 B20R2.16368 CCC(=O)c1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000211647 [0,2,0,0,0,0|1,1,0]=4 2190 B20R2.16368 CNC(=O)c1ccc(cc1)NCCn2ccnc2C 2230a_100000184841_100000742477 [0,2,0,0,0,0|2,0,0]=4 2191 B20R2.16368 CNC(=O)c1ccc(cc1)NCCn2ccnc2C 27a_100015184736_100000155074 [0,2,0,0,0,0|2,0,0]=4 2192 B20R2.16368 CNC(=O)c1ccc(cc1)OCCn2ccnc2C 7a_100000192141_100000742477 [0,2,0,0,0,0|1,0,0]=3 2193 B20R2.16368 CNC(=O)c1ccc(cc1)SCCn2ccnc2C 62a_100000155074_100000742477 [0,2,0,0,0,0|1,1,0]=4 2194 B20R2.16368 CNC(=O)c1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000155074 [0,2,0,0,0,0|1,1,0]=4 2195 B20R2.16368 CNC(=O)c1ccc(cn1)OCCn2ccnc2C 7a_100009861314_100000742477 [0,2,0,0,0,0|2,0,0]=4 2196 B20R2.16368 COC(=O)c1ccc(cc1)OCCc2scnc2C 34a_100000150123_100000057103 [0,2,0,0,0,0|2,0,0]=4 2197 B20R2.16368 COC(=O)c1ccc(cc1)OCCc2scnc2C 7a_100000150123_100000057103 [0,2,0,0,0,0|2,0,0]=4 2198 B20R2.16368 COC(=O)c1ccc(cc1)OCCn2ccnc2C 7a_100000150123_100000742477 [0,2,0,0,0,0|0,0,0]=2 2199 B20R2.16368 COC(=O)c1ccc(cc1)OCCn2nccc2C 7a_100000150123_100011934269 [0,2,0,0,0,0|2,0,0]=4 2200 B20R2.16368 COC(=O)c1ccc(cc1)SCCn2ccnc2C 62a_100000150774_100000742477 [0,2,0,0,0,0|0,1,0]=3 2201 B20R2.16368 COC(=O)c1ccc(cc1)SCCn2ccnc2C 62a_100000742477_100000150774 [0,2,0,0,0,0|0,1,0]=3 2202 B20R2.16368 COC(=O)c1ccc(cn1)OCCn2ccnc2C 7a_100011997255_100000742477 [0,2,0,0,0,0|1,0,0]=3 2203 B20R2.16368 COC(=O)c1ccc(cn1)SCCn2ccnc2C 62a_100000742477_100102712061 [0,2,0,0,0,0|1,1,0]=4 2204 B20R2.16368 COC(=O)c1ccc(cn1)SCCn2ccnc2C 62a_100102712061_100000742477 [0,2,0,0,0,0|1,1,0]=4 2205 B20R2.16368 COC(=O)c1ccc(nc1)NCCn2ccnc2C 27a_100015184736_100000733799 [0,2,0,0,0,0|2,0,0]=4 2206 B20R2.16368 COC(=O)c1ccc(nc1)SCCn2ccnc2C 62a_100000733799_100000742477 [0,2,0,0,0,0|1,1,0]=4 2207 B20R2.16368 COC(=O)c1ccc(nc1)SCCn2ccnc2C 62a_100000742477_100000733799 [0,2,0,0,0,0|1,1,0]=4 2208 B20R2.16368 COC(C)c1ccc(cc1)OCCn2ccnc2C 7a_200010658654_100000742477 [0,2,0,0,0,0|1,0,1]=4 2209 B20R2.16368 Cc1nccn1CCNc2ccc(cc2)C(=O)NN 27a_100015184736_100000183614 [0,2,0,0,0,0|2,0,0]=4 2210 B20R2.16368 Cc1nccn1CCOc2ccc(cc2)C(=O)CBr 7a_100009814261_100000742477 [0,2,0,0,0,0|1,0,0]=3 2211 B20R2.16368 Cc1nccn1CCOc2ccc(cc2)C(=O)CCl 7a_100000018856_100000742477 [0,2,0,0,0,0|1,0,0]=3 2212 B20R2.16368 Cc1nccn1CCOc2ccc(cc2)C(=O)CF 7a_200010654591_100000742477 [0,2,0,0,0,0|1,0,0]=3 2213 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)C#N 62a_100000742477_100009994572 [0,2,0,0,0,0|1,1,0]=4 2214 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)C=O 62a_100000725942_100000742477 [0,2,0,0,0,0|0,1,1]=4 2215 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)C=O 62a_100000742477_100000725942 [0,2,0,0,0,0|0,1,1]=4 2216 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)CN 62a_100000017248_100000742477 [0,2,0,0,0,0|1,1,0]=4 2217 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)CN 62a_100000742477_100000017248 [0,2,0,0,0,0|1,1,0]=4 2218 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)CO 62a_100000742477_100011219529 [0,2,0,0,0,0|0,1,0]=3 2219 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)CO 62a_100011219529_100000742477 [0,2,0,0,0,0|0,1,0]=3 2220 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)NN 62a_100000183614_100000742477 [0,2,0,0,0,0|1,1,0]=4 2221 B20R2.16368 Cc1nccn1CCSc2ccc(cc2)C(=O)NN 62a_100000742477_100000183614 [0,2,0,0,0,0|1,1,0]=4 2222 B20R2.16782 CCC(=O)c1ccc(c(c1)C)SCCn2ccnc2 62a_100000702546_200012349626 [0,2,0,0,0,0|1,1,0]=4 2223 B20R2.16782 CCC(=O)c1ccc(c(c1)C)SCCn2ccnc2 62a_200012349626_100000702546 [0,2,0,0,0,0|1,1,0]=4 2224 B20R2.16782 CCC(=O)c1ccc(c(c1)Cl)OCCn2cccc2 7a_100011218862_200000035178 [0,2,0,0,0,0|2,0,0]=4 2225 B20R2.16782 CCC(=O)c1ccc(c(c1)Cl)OCCn2ccnc2 7a_100011218862_100000702546 [0,2,0,0,0,0|1,0,0]=3 2226 B20R2.16782 CCC(=O)c1ccc(c(c1)Cl)OCCn2cncn2 34a_100011218862_200000749826 [0,2,0,0,0,0|2,0,0]=4 2227 B20R2.16782 CCC(=O)c1ccc(c(c1)Cl)OCCn2cncn2 7a_100011218862_100000731791 [0,2,0,0,0,0|2,0,0]=4 2228 B20R2.16782 CNC(=O)c1ccc(c(c1)C)NCCn2ccnc2 27a_100000230061_200013065384 [0,2,0,0,0,0|2,0,0]=4 2229 B20R2.16782 CNC(=O)c1ccc(c(c1)C)NCCn2ccnc2 7a_100000739472_100000702546 [0,2,0,0,0,0|2,0,0]=4 2230 B20R2.16782 CNC(=O)c1ccc(c(c1)C)SCCn2ccnc2 62a_100000702546_200013065384 [0,2,0,0,0,0|1,1,0]=4 2231 B20R2.16782 CNC(=O)c1ccc(c(c1)C)SCCn2ccnc2 62a_200013065384_100000702546 [0,2,0,0,0,0|1,1,0]=4 2232 B20R2.16782 COC(=O)c1cc(c(cn1)SCCn2ccnc2)C 62a_100000702546_100010080863 [0,2,0,0,0,0|1,1,0]=4 2233 B20R2.16782 COC(=O)c1cc(c(cn1)SCCn2ccnc2)C 62a_100010080863_100000702546 [0,2,0,0,0,0|1,1,0]=4 2234 B20R2.16782 COC(=O)c1cc(c(cn1)SCCn2ccnc2)N 62a_100000702546_100016001589 [0,2,0,0,0,0|1,1,0]=4 2235 B20R2.16782 COC(=O)c1cc(c(cn1)SCCn2ccnc2)N 62a_100016001589_100000702546 [0,2,0,0,0,0|1,1,0]=4 2236 B20R2.16782 COC(=O)c1ccc(c(c1)Br)OCCc2cn[nH]c2 7a_100000216328_100000743252 [0,2,0,0,0,0|2,0,0]=4 2237 B20R2.16782 COC(=O)c1ccc(c(c1)Br)OCCn2cccc2 7a_100000216328_200000035178 [0,2,0,0,0,0|1,0,0]=3 2238 B20R2.16782 COC(=O)c1ccc(c(c1)Br)OCCn2cccn2 34a_100000216328_100015204718 [0,2,0,0,0,0|2,0,0]=4 2239 B20R2.16782 COC(=O)c1ccc(c(c1)Br)OCCn2cccn2 7a_100000216328_100000685285 [0,2,0,0,0,0|2,0,0]=4 2240 B20R2.16782 COC(=O)c1ccc(c(c1)Br)OCCn2ccnc2 7a_100000216328_100000702546 [0,2,0,0,0,0|0,0,0]=2 2241 B20R2.16782 COC(=O)c1ccc(c(c1)Br)OCCn2cncn2 34a_100000216328_200000749826 [0,2,0,0,0,0|1,0,0]=3 2242 B20R2.16782 COC(=O)c1ccc(c(c1)Br)OCCn2cncn2 7a_100000216328_100000731791 [0,2,0,0,0,0|1,0,0]=3 2243 B20R2.16782 COC(=O)c1ccc(c(c1)Br)SCCn2cccc2 62a_100011294788_200000035178 [0,2,0,0,0,0|1,1,0]=4 2244 B20R2.16782 COC(=O)c1ccc(c(c1)Br)SCCn2cccc2 62a_200009811947_100011294788 [0,2,0,0,0,0|1,1,0]=4 2245 B20R2.16782 COC(=O)c1ccc(c(c1)Br)SCCn2ccnc2 62a_100000702546_100011294788 [0,2,0,0,0,0|0,1,0]=3 2246 B20R2.16782 COC(=O)c1ccc(c(c1)Br)SCCn2ccnc2 62a_100011294788_100000702546 [0,2,0,0,0,0|0,1,0]=3 2247 B20R2.16782 COC(=O)c1ccc(c(c1)Br)SCCn2cncn2 62a_100000731791_100011294788 [0,2,0,0,0,0|1,1,0]=4 2248 B20R2.16782 COC(=O)c1ccc(c(c1)Br)SCCn2cncn2 62a_100011294788_100000731791 [0,2,0,0,0,0|1,1,0]=4 2249 B20R2.16782 COC(=O)c1ccc(c(c1)C)OCCc2cn[nH]c2 7a_100011997373_100000743252 [0,2,0,0,0,0|2,0,0]=4 2250 B20R2.16782 COC(=O)c1ccc(c(c1)C)OCCn2cccc2 7a_100011997373_200000035178 [0,2,0,0,0,0|1,0,0]=3 2251 B20R2.16782 COC(=O)c1ccc(c(c1)C)OCCn2cccn2 34a_100011997373_100015204718 [0,2,0,0,0,0|2,0,0]=4 2252 B20R2.16782 COC(=O)c1ccc(c(c1)C)OCCn2cccn2 7a_100011997373_100000685285 [0,2,0,0,0,0|2,0,0]=4 2253 B20R2.16782 COC(=O)c1ccc(c(c1)C)OCCn2ccnc2 7a_100011997373_100000702546 [0,2,0,0,0,0|0,0,0]=2 2254 B20R2.16782 COC(=O)c1ccc(c(c1)C)OCCn2cncn2 34a_100011997373_200000749826 [0,2,0,0,0,0|1,0,0]=3 2255 B20R2.16782 COC(=O)c1ccc(c(c1)C)OCCn2cncn2 7a_100011997373_100000731791 [0,2,0,0,0,0|1,0,0]=3 2256 B20R2.16782 COC(=O)c1ccc(c(c1)C)SCCn2cccc2 62a_100011215878_200000035178 [0,2,0,0,0,0|1,1,0]=4 2257 B20R2.16782 COC(=O)c1ccc(c(c1)C)SCCn2cccc2 62a_200009811947_100011215878 [0,2,0,0,0,0|1,1,0]=4 2258 B20R2.16782 COC(=O)c1ccc(c(c1)C)SCCn2ccnc2 62a_100000702546_100011215878 [0,2,0,0,0,0|0,1,0]=3 2259 B20R2.16782 COC(=O)c1ccc(c(c1)C)SCCn2ccnc2 62a_100011215878_100000702546 [0,2,0,0,0,0|0,1,0]=3 2260 B20R2.16782 COC(=O)c1ccc(c(c1)C)SCCn2cncn2 62a_100000731791_100011215878 [0,2,0,0,0,0|1,1,0]=4 2261 B20R2.16782 COC(=O)c1ccc(c(c1)C)SCCn2cncn2 62a_100011215878_100000731791 [0,2,0,0,0,0|1,1,0]=4 2262 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)OCCc2cn[nH]c2 7a_100000151454_100000743252 [0,2,0,0,0,0|2,0,0]=4 2263 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)OCCn2cccc2 7a_100000151454_200000035178 [0,2,0,0,0,0|1,0,0]=3 2264 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)OCCn2cccn2 34a_100000151454_100015204718 [0,2,0,0,0,0|2,0,0]=4 2265 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)OCCn2cccn2 7a_100000151454_100000685285 [0,2,0,0,0,0|2,0,0]=4 2266 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)OCCn2ccnc2 7a_100000151454_100000702546 [0,2,0,0,0,0|0,0,0]=2 2267 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)OCCn2cncn2 34a_100000151454_200000749826 [0,2,0,0,0,0|1,0,0]=3 2268 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)OCCn2cncn2 7a_100000151454_100000731791 [0,2,0,0,0,0|1,0,0]=3 2269 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)SCCn2cccc2 62a_100012356344_200000035178 [0,2,0,0,0,0|1,1,0]=4 2270 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)SCCn2cccc2 62a_200009811947_100012356344 [0,2,0,0,0,0|1,1,0]=4 2271 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)SCCn2ccnc2 62a_100000702546_100012356344 [0,2,0,0,0,0|0,1,0]=3 2272 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)SCCn2ccnc2 62a_100012356344_100000702546 [0,2,0,0,0,0|0,1,0]=3 2273 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)SCCn2cncn2 62a_100000731791_100012356344 [0,2,0,0,0,0|1,1,0]=4 2274 B20R2.16782 COC(=O)c1ccc(c(c1)Cl)SCCn2cncn2 62a_100012356344_100000731791 [0,2,0,0,0,0|1,1,0]=4 2275 B20R2.16782 COC(=O)c1ccc(c(c1)F)OCCc2cn[nH]c2 7a_100000075456_100000743252 [0,2,0,0,0,0|2,0,0]=4 2276 B20R2.16782 COC(=O)c1ccc(c(c1)F)OCCn2cccc2 7a_100000075456_200000035178 [0,2,0,0,0,0|1,0,0]=3 2277 B20R2.16782 COC(=O)c1ccc(c(c1)F)OCCn2cccn2 34a_100000075456_100015204718 [0,2,0,0,0,0|2,0,0]=4 2278 B20R2.16782 COC(=O)c1ccc(c(c1)F)OCCn2cccn2 7a_100000075456_100000685285 [0,2,0,0,0,0|2,0,0]=4 2279 B20R2.16782 COC(=O)c1ccc(c(c1)F)OCCn2ccnc2 7a_100000075456_100000702546 [0,2,0,0,0,0|0,0,0]=2 2280 B20R2.16782 COC(=O)c1ccc(c(c1)F)OCCn2cncn2 34a_100000075456_200000749826 [0,2,0,0,0,0|1,0,0]=3 2281 B20R2.16782 COC(=O)c1ccc(c(c1)F)OCCn2cncn2 7a_100000075456_100000731791 [0,2,0,0,0,0|1,0,0]=3 2282 B20R2.16782 COC(=O)c1ccc(c(c1)F)SCCn2cccc2 62a_100000703229_200000035178 [0,2,0,0,0,0|1,1,0]=4 2283 B20R2.16782 COC(=O)c1ccc(c(c1)F)SCCn2cccc2 62a_200009811947_100000703229 [0,2,0,0,0,0|1,1,0]=4 2284 B20R2.16782 COC(=O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100000702546_100000703229 [0,2,0,0,0,0|0,1,0]=3 2285 B20R2.16782 COC(=O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100000703229_100000702546 [0,2,0,0,0,0|0,1,0]=3 2286 B20R2.16782 COC(=O)c1ccc(c(c1)F)SCCn2cncn2 62a_100000703229_100000731791 [0,2,0,0,0,0|1,1,0]=4 2287 B20R2.16782 COC(=O)c1ccc(c(c1)F)SCCn2cncn2 62a_100000731791_100000703229 [0,2,0,0,0,0|1,1,0]=4 2288 B20R2.16782 COC(=O)c1ccc(c(c1)I)OCCc2cn[nH]c2 7a_100010162523_100000743252 [0,2,0,0,0,0|2,0,0]=4 2289 B20R2.16782 COC(=O)c1ccc(c(c1)I)OCCn2cccc2 7a_100010162523_200000035178 [0,2,0,0,0,0|1,0,0]=3 2290 B20R2.16782 COC(=O)c1ccc(c(c1)I)OCCn2cccn2 34a_100010162523_100015204718 [0,2,0,0,0,0|2,0,0]=4 2291 B20R2.16782 COC(=O)c1ccc(c(c1)I)OCCn2cccn2 7a_100010162523_100000685285 [0,2,0,0,0,0|2,0,0]=4 2292 B20R2.16782 COC(=O)c1ccc(c(c1)I)OCCn2ccnc2 7a_100010162523_100000702546 [0,2,0,0,0,0|0,0,0]=2 2293 B20R2.16782 COC(=O)c1ccc(c(c1)I)OCCn2cncn2 34a_100010162523_200000749826 [0,2,0,0,0,0|1,0,0]=3 2294 B20R2.16782 COC(=O)c1ccc(c(c1)I)OCCn2cncn2 7a_100010162523_100000731791 [0,2,0,0,0,0|1,0,0]=3 2295 B20R2.16782 COC(=O)c1ccc(c(c1)N)OCCc2cn[nH]c2 7a_100000724433_100000743252 [0,2,0,0,0,0|2,0,0]=4 2296 B20R2.16782 COC(=O)c1ccc(c(c1)N)OCCn2cccc2 7a_100000724433_200000035178 [0,2,0,0,0,0|1,0,0]=3 2297 B20R2.16782 COC(=O)c1ccc(c(c1)N)OCCn2cccn2 34a_100000724433_100015204718 [0,2,0,0,0,0|2,0,0]=4 2298 B20R2.16782 COC(=O)c1ccc(c(c1)N)OCCn2cccn2 7a_100000724433_100000685285 [0,2,0,0,0,0|2,0,0]=4 2299 B20R2.16782 COC(=O)c1ccc(c(c1)N)OCCn2ccnc2 7a_100000724433_100000702546 [0,2,0,0,0,0|0,0,0]=2 2300 B20R2.16782 COC(=O)c1ccc(c(c1)N)OCCn2cncn2 34a_100000724433_200000749826 [0,2,0,0,0,0|1,0,0]=3 2301 B20R2.16782 COC(=O)c1ccc(c(c1)N)OCCn2cncn2 7a_100000724433_100000731791 [0,2,0,0,0,0|1,0,0]=3 2302 B20R2.16782 COC(=O)c1ccc(c(c1)N)SCCn2cccc2 62a_100011450966_200000035178 [0,2,0,0,0,0|1,1,0]=4 2303 B20R2.16782 COC(=O)c1ccc(c(c1)N)SCCn2cccc2 62a_200009811947_100011450966 [0,2,0,0,0,0|1,1,0]=4 2304 B20R2.16782 COC(=O)c1ccc(c(c1)N)SCCn2ccnc2 62a_100000702546_100011450966 [0,2,0,0,0,0|0,1,0]=3 2305 B20R2.16782 COC(=O)c1ccc(c(c1)N)SCCn2ccnc2 62a_100011450966_100000702546 [0,2,0,0,0,0|0,1,0]=3 2306 B20R2.16782 COC(=O)c1ccc(c(c1)N)SCCn2cncn2 62a_100000731791_100011450966 [0,2,0,0,0,0|1,1,0]=4 2307 B20R2.16782 COC(=O)c1ccc(c(c1)N)SCCn2cncn2 62a_100011450966_100000731791 [0,2,0,0,0,0|1,1,0]=4 2308 B20R2.16782 COC(=O)c1ccc(c(c1)O)SCCn2cccc2 62a_100012350776_200000035178 [0,2,0,0,0,0|1,1,0]=4 2309 B20R2.16782 COC(=O)c1ccc(c(c1)O)SCCn2cccc2 62a_200009811947_100012350776 [0,2,0,0,0,0|1,1,0]=4 2310 B20R2.16782 COC(=O)c1ccc(c(c1)O)SCCn2ccnc2 62a_100000702546_100012350776 [0,2,0,0,0,0|0,1,0]=3 2311 B20R2.16782 COC(=O)c1ccc(c(c1)O)SCCn2ccnc2 62a_100012350776_100000702546 [0,2,0,0,0,0|0,1,0]=3 2312 B20R2.16782 COC(=O)c1ccc(c(c1)O)SCCn2cncn2 62a_100000731791_100012350776 [0,2,0,0,0,0|1,1,0]=4 2313 B20R2.16782 COC(=O)c1ccc(c(c1)O)SCCn2cncn2 62a_100012350776_100000731791 [0,2,0,0,0,0|1,1,0]=4 2314 B20R2.16782 COC(=O)c1ccc(c(n1)Br)OCCn2cccc2 7a_200009815348_200000035178 [0,2,0,0,0,0|2,0,0]=4 2315 B20R2.16782 COC(=O)c1ccc(c(n1)Br)OCCn2ccnc2 7a_200009815348_100000702546 [0,2,0,0,0,0|1,0,0]=3 2316 B20R2.16782 COC(=O)c1ccc(c(n1)Br)OCCn2cncn2 34a_200009815348_200000749826 [0,2,0,0,0,0|2,0,0]=4 2317 B20R2.16782 COC(=O)c1ccc(c(n1)Br)OCCn2cncn2 7a_200009815348_100000731791 [0,2,0,0,0,0|2,0,0]=4 2318 B20R2.16782 COC(=O)c1ccc(c(n1)C)SCCn2ccnc2 62a_100000702546_100010207261 [0,2,0,0,0,0|1,1,0]=4 2319 B20R2.16782 COC(=O)c1ccc(c(n1)C)SCCn2ccnc2 62a_100010207261_100000702546 [0,2,0,0,0,0|1,1,0]=4 2320 B20R2.16782 COC(=O)c1ccc(c(n1)F)NCCn2ccnc2 27a_100000230061_100010189630 [0,2,0,0,0,0|2,0,0]=4 2321 B20R2.16782 COC(=O)c1ccc(c(n1)F)SCCn2ccnc2 62a_100000702546_100010189630 [0,2,0,0,0,0|1,1,0]=4 2322 B20R2.16782 COC(=O)c1ccc(c(n1)F)SCCn2ccnc2 62a_100010189630_100000702546 [0,2,0,0,0,0|1,1,0]=4 2323 B20R2.16782 COC(=O)c1ccc(c(n1)N)SCCn2ccnc2 62a_100010187631_100000702546 [0,2,0,0,0,0|1,1,0]=4 2324 B20R2.16782 COC(=O)c1ccc(c(n1)O)SCCn2ccnc2 62a_100000702546_100010189637 [0,2,0,0,0,0|1,1,0]=4 2325 B20R2.16782 COC(=O)c1cnc(c(c1)Br)NCCn2ccnc2 27a_100000230061_100010114297 [0,2,0,0,0,0|2,0,0]=4 2326 B20R2.16782 COC(=O)c1cnc(c(c1)Br)OCCn2cncn2 34a_100015192546_200000749826 [0,2,0,0,0,0|2,0,0]=4 2327 B20R2.16782 COC(=O)c1cnc(c(c1)Br)SCCn2ccnc2 62a_100000702546_100010114297 [0,2,0,0,0,0|1,1,0]=4 2328 B20R2.16782 COC(=O)c1cnc(c(c1)Br)SCCn2ccnc2 62a_100010114297_100000702546 [0,2,0,0,0,0|1,1,0]=4 2329 B20R2.16782 COC(=O)c1cnc(c(c1)C)NCCn2ccnc2 27a_100000230061_100009862495 [0,2,0,0,0,0|2,0,0]=4 2330 B20R2.16782 COC(=O)c1cnc(c(c1)C)SCCn2ccnc2 62a_100000702546_100009862495 [0,2,0,0,0,0|1,1,0]=4 2331 B20R2.16782 COC(=O)c1cnc(c(c1)C)SCCn2ccnc2 62a_200010136688_100000702546 [0,2,0,0,0,0|1,1,0]=4 2332 B20R2.16782 COC(=O)c1cnc(c(c1)F)NCCn2ccnc2 27a_100000230061_100009877320 [0,2,0,0,0,0|2,0,0]=4 2333 B20R2.16782 COC(=O)c1cnc(c(c1)F)SCCn2ccnc2 62a_100000702546_100010189625 [0,2,0,0,0,0|1,1,0]=4 2334 B20R2.16782 COC(=O)c1cnc(c(c1)F)SCCn2ccnc2 62a_100010189625_100000702546 [0,2,0,0,0,0|1,1,0]=4 2335 B20R2.16782 COC(=O)c1cnc(c(c1)N)NCCn2ccnc2 27a_100000230061_100000079130 [0,2,0,0,0,0|2,0,0]=4 2336 B20R2.16782 COC(=O)c1cnc(c(c1)N)SCCn2ccnc2 62a_100000702546_100000079130 [0,2,0,0,0,0|1,1,0]=4 2337 B20R2.16782 COC(=O)c1cnc(c(c1)O)SCCn2ccnc2 62a_100000702546_100010999399 [0,2,0,0,0,0|1,1,0]=4 2338 B20R2.16782 COC(=O)c1cnc(c(c1)O)SCCn2ccnc2 62a_100010999399_100000702546 [0,2,0,0,0,0|1,1,0]=4 2339 B20R2.16782 Cc1cc(ccc1NCCn2ccnc2)C(=O)NN 27a_100000230061_100012339724 [0,2,0,0,0,0|2,0,0]=4 2340 B20R2.16782 Cc1cc(ccc1SCCn2ccnc2)C(=O)NN 62a_100000702546_100012339724 [0,2,0,0,0,0|1,1,0]=4 2341 B20R2.16782 Cc1cc(ccc1SCCn2ccnc2)C(=O)NN 62a_100012339724_100000702546 [0,2,0,0,0,0|1,1,0]=4 2342 B20R2.16782 NCC(=O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100000702546_100016989600 [0,2,0,0,0,0|1,1,0]=4 2343 B20R2.16782 NCC(=O)c1ccc(c(c1)F)SCCn2ccnc2 62a_100016989600_100000702546 [0,2,0,0,0,0|1,1,0]=4 2344 B20R2.16782 NNC(=O)c1ccc(c(c1)N)OCCn2cncn2 34a_200000039609_200000749826 [0,2,0,0,0,0|2,0,0]=4 2345 B20R2.16782 O=C(CCl)c1ccc(c(c1)Cl)OCCn2cccc2 7a_200010170092_200000035178 [0,2,0,0,0,0|2,0,0]=4 2346 B20R2.16782 O=C(CCl)c1ccc(c(c1)Cl)OCCn2ccnc2 7a_200010170092_100000702546 [0,2,0,0,0,0|1,0,0]=3 2347 B20R2.16782 O=C(CCl)c1ccc(c(c1)Cl)OCCn2cncn2 7a_200010170092_100000731791 [0,2,0,0,0,0|2,0,0]=4 2348 B20R2.247931 CCC(=O)c1ccc(cc1C)SCCn2ccnc2 62a_100000702546_200012361375 [0,2,0,0,0,0|1,1,0]=4 2349 B20R2.247931 CCC(=O)c1ccc(cc1C)SCCn2ccnc2 62a_200012361375_100000702546 [0,2,0,0,0,0|1,1,0]=4 2350 B20R2.247931 CCC(=O)c1ccc(cc1F)NCCn2ccnc2 27a_100000230061_100012360378 [0,2,0,0,0,0|2,0,0]=4 2351 B20R2.247931 CCC(=O)c1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100012360378 [0,2,0,0,0,0|1,1,0]=4 2352 B20R2.247931 CCC(=O)c1ccc(cc1F)SCCn2ccnc2 62a_100012360378_100000702546 [0,2,0,0,0,0|1,1,0]=4 2353 B20R2.247931 CNC(=O)c1ccc(cc1Cl)NCCn2ccnc2 7a_100000742945_100000702546 [0,2,0,0,0,0|2,0,0]=4 2354 B20R2.247931 CNC(=O)c1ccc(cc1F)NCCn2ccnc2 27a_100000230061_100000233932 [0,2,0,0,0,0|2,0,0]=4 2355 B20R2.247931 CNC(=O)c1ccc(cc1F)NCCn2ccnc2 7a_100011533607_100000702546 [0,2,0,0,0,0|2,0,0]=4 2356 B20R2.247931 CNC(=O)c1ccc(cc1F)SCCn2ccnc2 62a_100000233932_100000702546 [0,2,0,0,0,0|1,1,0]=4 2357 B20R2.247931 CNC(=O)c1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100000233932 [0,2,0,0,0,0|1,1,0]=4 2358 B20R2.247931 COC(=O)c1ccc(cc1Br)OCCc2cn[nH]c2 7a_100010150825_100000743252 [0,2,0,0,0,0|2,0,0]=4 2359 B20R2.247931 COC(=O)c1ccc(cc1Br)OCCn2cccc2 7a_100010150825_200000035178 [0,2,0,0,0,0|1,0,0]=3 2360 B20R2.247931 COC(=O)c1ccc(cc1Br)OCCn2cccn2 34a_100010150825_100015204718 [0,2,0,0,0,0|2,0,0]=4 2361 B20R2.247931 COC(=O)c1ccc(cc1Br)OCCn2cccn2 7a_100010150825_100000685285 [0,2,0,0,0,0|2,0,0]=4 2362 B20R2.247931 COC(=O)c1ccc(cc1Br)OCCn2ccnc2 7a_100010150825_100000702546 [0,2,0,0,0,0|0,0,0]=2 2363 B20R2.247931 COC(=O)c1ccc(cc1Br)OCCn2cncn2 34a_100010150825_200000749826 [0,2,0,0,0,0|1,0,0]=3 2364 B20R2.247931 COC(=O)c1ccc(cc1Br)OCCn2cncn2 7a_100010150825_100000731791 [0,2,0,0,0,0|1,0,0]=3 2365 B20R2.247931 COC(=O)c1ccc(cc1Br)SCCn2cccc2 62a_100010247156_200000035178 [0,2,0,0,0,0|1,1,0]=4 2366 B20R2.247931 COC(=O)c1ccc(cc1Br)SCCn2cccc2 62a_200009811947_100010247156 [0,2,0,0,0,0|1,1,0]=4 2367 B20R2.247931 COC(=O)c1ccc(cc1Br)SCCn2ccnc2 62a_100000702546_100010247156 [0,2,0,0,0,0|0,1,0]=3 2368 B20R2.247931 COC(=O)c1ccc(cc1Br)SCCn2ccnc2 62a_100010247156_100000702546 [0,2,0,0,0,0|0,1,0]=3 2369 B20R2.247931 COC(=O)c1ccc(cc1Br)SCCn2cncn2 62a_100000731791_100010247156 [0,2,0,0,0,0|1,1,0]=4 2370 B20R2.247931 COC(=O)c1ccc(cc1Br)SCCn2cncn2 62a_100010247156_100000731791 [0,2,0,0,0,0|1,1,0]=4 2371 B20R2.247931 COC(=O)c1ccc(cc1C)OCCc2cn[nH]c2 7a_100012000157_100000743252 [0,2,0,0,0,0|2,0,0]=4 2372 B20R2.247931 COC(=O)c1ccc(cc1C)OCCn2cccc2 7a_100012000157_200000035178 [0,2,0,0,0,0|1,0,0]=3 2373 B20R2.247931 COC(=O)c1ccc(cc1C)OCCn2cccn2 34a_100012000157_100015204718 [0,2,0,0,0,0|2,0,0]=4 2374 B20R2.247931 COC(=O)c1ccc(cc1C)OCCn2cccn2 7a_100012000157_100000685285 [0,2,0,0,0,0|2,0,0]=4 2375 B20R2.247931 COC(=O)c1ccc(cc1C)OCCn2ccnc2 7a_100012000157_100000702546 [0,2,0,0,0,0|0,0,0]=2 2376 B20R2.247931 COC(=O)c1ccc(cc1C)OCCn2cncn2 34a_100012000157_200000749826 [0,2,0,0,0,0|1,0,0]=3 2377 B20R2.247931 COC(=O)c1ccc(cc1C)OCCn2cncn2 7a_100012000157_100000731791 [0,2,0,0,0,0|1,0,0]=3 2378 B20R2.247931 COC(=O)c1ccc(cc1C)SCCn2cccc2 62a_100000747612_200000035178 [0,2,0,0,0,0|1,1,0]=4 2379 B20R2.247931 COC(=O)c1ccc(cc1C)SCCn2cccc2 62a_200009811947_100000747612 [0,2,0,0,0,0|1,1,0]=4 2380 B20R2.247931 COC(=O)c1ccc(cc1C)SCCn2ccnc2 62a_100000702546_100000747612 [0,2,0,0,0,0|0,1,0]=3 2381 B20R2.247931 COC(=O)c1ccc(cc1C)SCCn2ccnc2 62a_100000747612_100000702546 [0,2,0,0,0,0|0,1,0]=3 2382 B20R2.247931 COC(=O)c1ccc(cc1C)SCCn2cncn2 62a_100000731791_100000747612 [0,2,0,0,0,0|1,1,0]=4 2383 B20R2.247931 COC(=O)c1ccc(cc1C)SCCn2cncn2 62a_100000747612_100000731791 [0,2,0,0,0,0|1,1,0]=4 2384 B20R2.247931 COC(=O)c1ccc(cc1Cl)OCCc2cn[nH]c2 7a_100000081488_100000743252 [0,2,0,0,0,0|2,0,0]=4 2385 B20R2.247931 COC(=O)c1ccc(cc1Cl)OCCn2cccc2 7a_100000081488_200000035178 [0,2,0,0,0,0|1,0,0]=3 2386 B20R2.247931 COC(=O)c1ccc(cc1Cl)OCCn2cccn2 34a_100000081488_100015204718 [0,2,0,0,0,0|2,0,0]=4 2387 B20R2.247931 COC(=O)c1ccc(cc1Cl)OCCn2cccn2 7a_100000081488_100000685285 [0,2,0,0,0,0|2,0,0]=4 2388 B20R2.247931 COC(=O)c1ccc(cc1Cl)OCCn2ccnc2 7a_100000081488_100000702546 [0,2,0,0,0,0|0,0,0]=2 2389 B20R2.247931 COC(=O)c1ccc(cc1Cl)OCCn2cncn2 34a_100000081488_200000749826 [0,2,0,0,0,0|1,0,0]=3 2390 B20R2.247931 COC(=O)c1ccc(cc1Cl)OCCn2cncn2 7a_100000081488_100000731791 [0,2,0,0,0,0|1,0,0]=3 2391 B20R2.247931 COC(=O)c1ccc(cc1Cl)SCCn2cccc2 62a_100000060724_200000035178 [0,2,0,0,0,0|1,1,0]=4 2392 B20R2.247931 COC(=O)c1ccc(cc1Cl)SCCn2cccc2 62a_200009811947_100000060724 [0,2,0,0,0,0|1,1,0]=4 2393 B20R2.247931 COC(=O)c1ccc(cc1Cl)SCCn2ccnc2 62a_100000060724_100000702546 [0,2,0,0,0,0|0,1,0]=3 2394 B20R2.247931 COC(=O)c1ccc(cc1Cl)SCCn2ccnc2 62a_100000702546_100000060724 [0,2,0,0,0,0|0,1,0]=3 2395 B20R2.247931 COC(=O)c1ccc(cc1Cl)SCCn2cncn2 62a_100000060724_100000731791 [0,2,0,0,0,0|1,1,0]=4 2396 B20R2.247931 COC(=O)c1ccc(cc1Cl)SCCn2cncn2 62a_100000731791_100000060724 [0,2,0,0,0,0|1,1,0]=4 2397 B20R2.247931 COC(=O)c1ccc(cc1F)OCCc2cn[nH]c2 7a_100011999631_100000743252 [0,2,0,0,0,0|2,0,0]=4 2398 B20R2.247931 COC(=O)c1ccc(cc1F)OCCn2cccc2 7a_100011999631_200000035178 [0,2,0,0,0,0|1,0,0]=3 2399 B20R2.247931 COC(=O)c1ccc(cc1F)OCCn2cccn2 34a_100011999631_100015204718 [0,2,0,0,0,0|2,0,0]=4 2400 B20R2.247931 COC(=O)c1ccc(cc1F)OCCn2cccn2 7a_100011999631_100000685285 [0,2,0,0,0,0|2,0,0]=4 2401 B20R2.247931 COC(=O)c1ccc(cc1F)OCCn2ccnc2 7a_100011999631_100000702546 [0,2,0,0,0,0|0,0,0]=2 2402 B20R2.247931 COC(=O)c1ccc(cc1F)OCCn2cncn2 34a_100011999631_200000749826 [0,2,0,0,0,0|1,0,0]=3 2403 B20R2.247931 COC(=O)c1ccc(cc1F)OCCn2cncn2 7a_100011999631_100000731791 [0,2,0,0,0,0|1,0,0]=3 2404 B20R2.247931 COC(=O)c1ccc(cc1F)SCCn2cccc2 62a_100000216654_200000035178 [0,2,0,0,0,0|1,1,0]=4 2405 B20R2.247931 COC(=O)c1ccc(cc1F)SCCn2cccc2 62a_200009811947_100000216654 [0,2,0,0,0,0|1,1,0]=4 2406 B20R2.247931 COC(=O)c1ccc(cc1F)SCCn2ccnc2 62a_100000216654_100000702546 [0,2,0,0,0,0|0,1,0]=3 2407 B20R2.247931 COC(=O)c1ccc(cc1F)SCCn2ccnc2 62a_100000702546_100000216654 [0,2,0,0,0,0|0,1,0]=3 2408 B20R2.247931 COC(=O)c1ccc(cc1F)SCCn2cncn2 62a_100000216654_100000731791 [0,2,0,0,0,0|1,1,0]=4 2409 B20R2.247931 COC(=O)c1ccc(cc1F)SCCn2cncn2 62a_100000731791_100000216654 [0,2,0,0,0,0|1,1,0]=4 2410 B20R2.247931 COC(=O)c1ccc(cc1N)OCCc2cn[nH]c2 7a_100000701581_100000743252 [0,2,0,0,0,0|2,0,0]=4 2411 B20R2.247931 COC(=O)c1ccc(cc1N)OCCn2cccc2 7a_100000701581_200000035178 [0,2,0,0,0,0|1,0,0]=3 2412 B20R2.247931 COC(=O)c1ccc(cc1N)OCCn2cccn2 34a_100000701581_100015204718 [0,2,0,0,0,0|2,0,0]=4 2413 B20R2.247931 COC(=O)c1ccc(cc1N)OCCn2cccn2 7a_100000701581_100000685285 [0,2,0,0,0,0|2,0,0]=4 2414 B20R2.247931 COC(=O)c1ccc(cc1N)OCCn2ccnc2 7a_100000701581_100000702546 [0,2,0,0,0,0|0,0,0]=2 2415 B20R2.247931 COC(=O)c1ccc(cc1N)OCCn2cncn2 34a_100000701581_200000749826 [0,2,0,0,0,0|1,0,0]=3 2416 B20R2.247931 COC(=O)c1ccc(cc1N)OCCn2cncn2 7a_100000701581_100000731791 [0,2,0,0,0,0|1,0,0]=3 2417 B20R2.247931 COC(=O)c1ccc(cc1N)SCCn2cccc2 62a_100011373473_200000035178 [0,2,0,0,0,0|1,1,0]=4 2418 B20R2.247931 COC(=O)c1ccc(cc1N)SCCn2ccnc2 62a_100011373473_100000702546 [0,2,0,0,0,0|0,1,0]=3 2419 B20R2.247931 COC(=O)c1ccc(cc1N)SCCn2cncn2 62a_100011373473_100000731791 [0,2,0,0,0,0|1,1,0]=4 2420 B20R2.247931 COC(=O)c1ccc(cc1O)SCCn2cccc2 62a_200009811947_100000062286 [0,2,0,0,0,0|1,1,0]=4 2421 B20R2.247931 COC(=O)c1ccc(cc1O)SCCn2ccnc2 62a_100000702546_100000062286 [0,2,0,0,0,0|0,1,0]=3 2422 B20R2.247931 COC(=O)c1ccc(cc1O)SCCn2cncn2 62a_100000731791_100000062286 [0,2,0,0,0,0|1,1,0]=4 2423 B20R2.247931 COC(=O)c1ccc(nc1C)NCCn2ccnc2 27a_100000230061_100000692007 [0,2,0,0,0,0|2,0,0]=4 2424 B20R2.247931 COC(=O)c1ccc(nc1C)SCCn2ccnc2 62a_100000692007_100000702546 [0,2,0,0,0,0|1,1,0]=4 2425 B20R2.247931 COC(=O)c1ccc(nc1C)SCCn2ccnc2 62a_100000702546_100000692007 [0,2,0,0,0,0|1,1,0]=4 2426 B20R2.247931 COC(=O)c1ccc(nc1F)SCCn2ccnc2 62a_100000702546_100010189635 [0,2,0,0,0,0|1,1,0]=4 2427 B20R2.247931 COC(=O)c1ccc(nc1F)SCCn2ccnc2 62a_100010189635_100000702546 [0,2,0,0,0,0|1,1,0]=4 2428 B20R2.247931 COC(=O)c1ccc(nc1N)SCCn2ccnc2 62a_100000142702_100000702546 [0,2,0,0,0,0|1,1,0]=4 2429 B20R2.247931 COC(=O)c1cnc(cc1C)NCCn2ccnc2 27a_100000230061_100009871181 [0,2,0,0,0,0|2,0,0]=4 2430 B20R2.247931 COC(=O)c1cnc(cc1C)SCCn2ccnc2 62a_100000702546_100009871181 [0,2,0,0,0,0|1,1,0]=4 2431 B20R2.247931 COC(=O)c1cnc(cc1C)SCCn2ccnc2 62a_100009871181_100000702546 [0,2,0,0,0,0|1,1,0]=4 2432 B20R2.247931 COC(=O)c1cnc(cc1N)SCCn2ccnc2 62a_100000702546_100009862510 [0,2,0,0,0,0|1,1,0]=4 2433 B20R2.247931 COC(=O)c1cnc(cc1N)SCCn2ccnc2 62a_100009862510_100000702546 [0,2,0,0,0,0|1,1,0]=4 2434 B20R2.247931 COC(=O)c1ncc(cc1C)SCCn2ccnc2 62a_100000702546_100010178714 [0,2,0,0,0,0|1,1,0]=4 2435 B20R2.247931 COC(=O)c1ncc(cc1C)SCCn2ccnc2 62a_100010178714_100000702546 [0,2,0,0,0,0|1,1,0]=4 2436 B20R2.247931 COC(=O)c1ncc(cc1Cl)OCCn2cccc2 7a_100009855505_200000035178 [0,2,0,0,0,0|2,0,0]=4 2437 B20R2.247931 COC(=O)c1ncc(cc1Cl)OCCn2ccnc2 7a_100009855505_100000702546 [0,2,0,0,0,0|1,0,0]=3 2438 B20R2.247931 COC(=O)c1ncc(cc1Cl)OCCn2cncn2 34a_100009855505_200000749826 [0,2,0,0,0,0|2,0,0]=4 2439 B20R2.247931 COC(=O)c1ncc(cc1Cl)OCCn2cncn2 7a_100009855505_100000731791 [0,2,0,0,0,0|2,0,0]=4 2440 B20R2.247931 COC(=O)c1ncc(cc1F)SCCn2ccnc2 62a_100000695675_100000702546 [0,2,0,0,0,0|1,1,0]=4 2441 B20R2.247931 COC(=O)c1ncc(cc1F)SCCn2ccnc2 62a_100000702546_100000695675 [0,2,0,0,0,0|1,1,0]=4 2442 B20R2.247931 COC(=O)c1ncc(cc1N)SCCn2ccnc2 62a_100000702546_100010090751 [0,2,0,0,0,0|1,1,0]=4 2443 B20R2.247931 COC(=O)c1ncc(cc1N)SCCn2ccnc2 62a_100010090751_100000702546 [0,2,0,0,0,0|1,1,0]=4 2444 B20R2.247931 COC(=O)c1ncc(cc1O)SCCn2ccnc2 62a_100000702546_100010071521 [0,2,0,0,0,0|1,1,0]=4 2445 B20R2.247931 NC(=NO)c1ccc(cc1F)OCCn2cncn2 34a_200015222041_200000749826 [0,2,0,0,0,0|2,0,0]=4 2446 B20R2.65745 CS(=O)(=O)c1ccc(c(c1)F)OCCn2ccnc2 7a_100000069939_100000702546 [0,2,0,0,0,0|1,0,1]=4 2447 B20R2.65745 CS(=O)(=O)c1ccc(c(c1)N)OCCn2ccnc2 7a_100000186253_100000702546 [0,2,0,0,0,0|1,0,1]=4 2448 B20R2.65745 Nc1cc(ccc1OCCn2ccnc2)S(=O)(=O)N 7a_100000182321_100000702546 [0,2,0,0,0,0|1,0,1]=4 2449 B20R2.76994 Cc1nccn1CCOc2ccc(cc2)C(C)(C)O 7a_100000695648_100000742477 [0,2,0,0,0,0|1,0,1]=4 2450 B20R2.76994 Cc1nccn1CCOc2ccc(cc2)S(=O)(=O)C 7a_100000230201_100000742477 [0,2,0,0,0,0|1,0,1]=4 2451 B20R2.76994 Cc1nccn1CCOc2ccc(cc2)S(=O)(=O)N 7a_100000738502_100000742477 [0,2,0,0,0,0|1,0,1]=4 2452 B20R2.76994 Cc1nccn1CCOc2ccc(cc2)S(=O)(=O)[O-] 7a_100000698548_100000742477 [0,2,0,0,0,0|1,0,1]=4 2453 B20R2.30472 CC(=O)c1ccc(c(c1)C#N)NCCn2ccnc2 27a_100000230061_100010125495 [0,2,0,0,0,0|2,0,0]=4 2454 B20R2.30472 CC(=O)c1ccc(c(c1)C#N)SCCn2ccnc2 62a_100000702546_100010125495 [0,2,0,0,0,0|1,1,0]=4 2455 B20R2.30472 CC(=O)c1ccc(c(c1)CCl)OCCn2cccc2 7a_100000010293_200000035178 [0,2,0,0,0,0|2,0,0]=4 2456 B20R2.30472 CC(=O)c1ccc(c(c1)CCl)OCCn2ccnc2 7a_100000010293_100000702546 [0,2,0,0,0,0|1,0,0]=3 2457 B20R2.30472 CC(=O)c1ccc(c(c1)CCl)OCCn2cncn2 34a_100000010293_200000749826 [0,2,0,0,0,0|2,0,0]=4 2458 B20R2.30472 CC(=O)c1ccc(c(c1)CCl)OCCn2cncn2 7a_100000010293_100000731791 [0,2,0,0,0,0|2,0,0]=4 2459 B20R2.30472 CC(=O)c1ccc(c(c1)CO)OCCn2cccc2 7a_100000025453_200000035178 [0,2,0,0,0,0|2,0,0]=4 2460 B20R2.30472 CC(=O)c1ccc(c(c1)CO)OCCn2ccnc2 7a_100000025453_100000702546 [0,2,0,0,0,0|1,0,0]=3 2461 B20R2.30472 CC(=O)c1ccc(c(c1)CO)OCCn2cncn2 7a_100000025453_100000731791 [0,2,0,0,0,0|2,0,0]=4 2462 B20R2.30472 COc1cc(ccc1NCCn2ccnc2)C(=O)N 27a_100000230061_100009817049 [0,2,0,0,0,0|2,0,0]=4 2463 B20R2.30472 COc1cc(ccc1OCCn2cccc2)C(=O)C 7a_100000186468_200000035178 [0,2,0,0,0,0|2,0,0]=4 2464 B20R2.30472 COc1cc(ccc1OCCn2ccnc2)C(=O)C 7a_100000186468_100000702546 [0,2,0,0,0,0|1,0,0]=3 2465 B20R2.30472 COc1cc(ccc1OCCn2ccnc2)C(C)O 7a_100000246512_100000702546 [0,2,0,0,0,0|1,0,1]=4 2466 B20R2.30472 COc1cc(ccc1OCCn2ccnc2)[N+](=O)[O-] 7a_100000742293_100000702546 [0,2,0,0,0,0|1,0,1]=4 2467 B20R2.30472 COc1cc(ccc1OCCn2cncn2)C(=O)C 34a_100000186468_200000749826 [0,2,0,0,0,0|2,0,0]=4 2468 B20R2.30472 COc1cc(ccc1OCCn2cncn2)C(=O)C 7a_100000186468_100000731791 [0,2,0,0,0,0|2,0,0]=4 2469 B20R2.30472 COc1cc(ccc1SCCn2ccnc2)C(=O)C 62a_100010110075_100000702546 [0,2,0,0,0,0|1,1,0]=4 2470 B20R2.30472 COc1cc(ccc1SCCn2ccnc2)C(=O)N 62a_100009817049_100000702546 [0,2,0,0,0,0|1,1,0]=4 2471 B20R2.30472 N#Cc1cc(ccc1OCCn2ccnc2)[N+](=O)[O-] 7a_100000742360_100000702546 [0,2,0,0,0,0|1,0,1]=4 2472 B20R2.30472 O=[N+]([O-])c1ccc(c(c1)CBr)OCCn2ccnc2 7a_200009813932_100000702546 [0,2,0,0,0,0|1,0,1]=4 2473 B20R2.30472 O=[N+]([O-])c1ccc(c(c1)CO)OCCn2ccnc2 7a_100011215696_100000702546 [0,2,0,0,0,0|1,0,1]=4 2474 B20R2.76996 CC(=O)c1ccc(c(c1)Br)OCCn2ccnc2C 7a_100011772453_100000742477 [0,2,0,0,0,0|1,0,0]=3 2475 B20R2.76996 CC(=O)c1ccc(c(c1)Br)SCCn2ccnc2C 62a_100000742477_100010146554 [0,2,0,0,0,0|1,1,0]=4 2476 B20R2.76996 CC(=O)c1ccc(c(c1)Br)SCCn2ccnc2C 62a_100010146554_100000742477 [0,2,0,0,0,0|1,1,0]=4 2477 B20R2.76996 CC(=O)c1ccc(c(c1)C)OCCn2ccnc2C 7a_100000188726_100000742477 [0,2,0,0,0,0|1,0,0]=3 2478 B20R2.76996 CC(=O)c1ccc(c(c1)C)SCCn2ccnc2C 62a_100000697869_100000742477 [0,2,0,0,0,0|1,1,0]=4 2479 B20R2.76996 CC(=O)c1ccc(c(c1)C)SCCn2ccnc2C 62a_100000742477_100000697869 [0,2,0,0,0,0|1,1,0]=4 2480 B20R2.76996 CC(=O)c1ccc(c(c1)Cl)OCCn2ccnc2C 7a_100000188625_100000742477 [0,2,0,0,0,0|1,0,0]=3 2481 B20R2.76996 CC(=O)c1ccc(c(c1)F)OCCn2ccnc2C 7a_100000751691_100000742477 [0,2,0,0,0,0|1,0,0]=3 2482 B20R2.76996 CC(=O)c1ccc(c(c1)F)SCCn2ccnc2C 62a_100000690002_100000742477 [0,2,0,0,0,0|1,1,0]=4 2483 B20R2.76996 CC(=O)c1ccc(c(c1)F)SCCn2ccnc2C 62a_100000742477_100000690002 [0,2,0,0,0,0|1,1,0]=4 2484 B20R2.76996 CC(=O)c1ccc(c(c1)N)OCCn2ccnc2C 7a_100000117292_100000742477 [0,2,0,0,0,0|1,0,0]=3 2485 B20R2.76996 CC(=O)c1ccc(c(c1)N)SCCn2ccnc2C 62a_100009816534_100000742477 [0,2,0,0,0,0|1,1,0]=4 2486 B20R2.76996 Cc1cc(ccc1NCCn2ccnc2C)C(=O)N 27a_100015184736_100011218126 [0,2,0,0,0,0|2,0,0]=4 2487 B20R2.76996 Cc1cc(ccc1NCCn2ccnc2C)C(=O)N 7a_100000746439_100000742477 [0,2,0,0,0,0|2,0,0]=4 2488 B20R2.76996 Cc1cc(ccc1OCCn2ccnc2C)[N+](=O)[O-] 7a_100000744956_100000742477 [0,2,0,0,0,0|1,0,1]=4 2489 B20R2.76996 Cc1cc(ccc1SCCn2ccnc2C)C(=O)N 62a_100000742477_100011218126 [0,2,0,0,0,0|1,1,0]=4 2490 B20R2.76996 Cc1cc(ccc1SCCn2ccnc2C)C(=O)N 62a_100011218126_100000742477 [0,2,0,0,0,0|1,1,0]=4 2491 B20R2.76996 Cc1nccn1CCNc2ccc(cc2Br)C(=O)N 27a_100015184736_100009814583 [0,2,0,0,0,0|2,0,0]=4 2492 B20R2.76996 Cc1nccn1CCNc2ccc(cc2F)C(=O)N 27a_100015184736_100000686215 [0,2,0,0,0,0|2,0,0]=4 2493 B20R2.76996 Cc1nccn1CCOc2ccc(cc2Br)[N+](=O)[O-] 7a_100000756651_100000742477 [0,2,0,0,0,0|1,0,1]=4 2494 B20R2.76996 Cc1nccn1CCOc2ccc(cc2Cl)C(=O)N 7a_200000192832_100000742477 [0,2,0,0,0,0|1,0,0]=3 2495 B20R2.76996 Cc1nccn1CCOc2ccc(cc2Cl)[N+](=O)[O-] 7a_100000206008_100000742477 [0,2,0,0,0,0|1,0,1]=4 2496 B20R2.76996 Cc1nccn1CCOc2ccc(cc2F)[N+](=O)[O-] 7a_100000739697_100000742477 [0,2,0,0,0,0|1,0,1]=4 2497 B20R2.76996 Cc1nccn1CCOc2ccc(cc2I)[N+](=O)[O-] 7a_100012047213_100000742477 [0,2,0,0,0,0|1,0,1]=4 2498 B20R2.76996 Cc1nccn1CCOc2ccc(cc2N)[N+](=O)[O-] 7a_100000181223_100000742477 [0,2,0,0,0,0|1,0,1]=4 2499 B20R2.76996 Cc1nccn1CCSc2ccc(cc2Br)C(=O)N 62a_100000742477_100009814583 [0,2,0,0,0,0|1,1,0]=4 2500 B20R2.76996 Cc1nccn1CCSc2ccc(cc2Br)C(=O)N 62a_100009814583_100000742477 [0,2,0,0,0,0|1,1,0]=4 2501 B20R2.76996 Cc1nccn1CCSc2ccc(cc2F)C(=O)N 62a_100000686215_100000742477 [0,2,0,0,0,0|1,1,0]=4 2502 B20R2.76996 Cc1nccn1CCSc2ccc(cc2F)C(=O)N 62a_100000742477_100000686215 [0,2,0,0,0,0|1,1,0]=4 2503 B20R2.76996 Cc1nccn1CCSc2ccc(cc2O)C(=O)N 62a_100000742477_100012344895 [0,2,0,0,0,0|1,1,0]=4 2504 B20R2.76996 Cc1nccn1CCSc2ccc(cc2O)C(=O)N 62a_100012344895_100000742477 [0,2,0,0,0,0|1,1,0]=4 2505 B20R2.155736 CC(=O)c1cc(c(cc1F)SCCn2ccnc2)F 62a_100012024335_100000702546 [0,2,0,0,0,0|1,1,0]=4 2506 B20R2.155736 CC(=O)c1cc(c(cc1O)SCCn2ccnc2)C 62a_100009816031_100000702546 [0,2,0,0,0,0|1,1,0]=4 2507 B20R2.155736 CC(=O)c1cc(c(cc1O)SCCn2ccnc2)F 62a_200010245088_100000702546 [0,2,0,0,0,0|1,1,0]=4 2508 B20R2.155736 Cc1cc(c(cc1OCCn2ccnc2)C)[N+](=O)[O-] 7a_100000736305_100000702546 [0,2,0,0,0,0|1,0,1]=4 2509 B20R2.155736 Cc1cc(c(cc1[N+](=O)[O-])Br)OCCn2ccnc2 7a_200012359939_100000702546 [0,2,0,0,0,0|1,0,1]=4 2510 B20R2.155736 Cc1cc(c(cc1[N+](=O)[O-])Cl)OCCn2ccnc2 7a_200000693809_100000702546 [0,2,0,0,0,0|1,0,1]=4 2511 B20R2.155736 NC(=O)c1cc(c(cc1F)NCCn2ccnc2)F 27a_100000230061_100010244962 [0,2,0,0,0,0|2,0,0]=4 2512 B20R2.155736 NC(=O)c1cc(c(cc1F)SCCn2ccnc2)F 62a_100000702546_100010244962 [0,2,0,0,0,0|1,1,0]=4 2513 B20R2.155736 NC(=O)c1cc(c(cc1F)SCCn2ccnc2)F 62a_100010244962_100000702546 [0,2,0,0,0,0|1,1,0]=4 2514 B20R2.155736 Nc1cc(c(cc1OCCn2ccnc2)F)[N+](=O)[O-] 7a_200015898590_100000702546 [0,2,0,0,0,0|1,0,1]=4 2515 B20R2.155736 O=[N+]([O-])c1cc(c(cc1Cl)OCCn2ccnc2)Cl 7a_100012354867_100000702546 [0,2,0,0,0,0|1,0,1]=4 2516 B20R2.155736 O=[N+]([O-])c1cc(c(cc1Cl)OCCn2ccnc2)F 7a_100015761126_100000702546 [0,2,0,0,0,0|1,0,1]=4 2517 B20R2.155736 O=[N+]([O-])c1cc(c(cc1F)OCCn2ccnc2)F 7a_100000042863_100000702546 [0,2,0,0,0,0|1,0,1]=4 2518 B20R2.493383 CC(=O)c1cc(c(c(c1)Br)OCCn2cccc2)Br 7a_100000186470_200000035178 [0,2,0,0,0,0|2,0,0]=4 2519 B20R2.493383 CC(=O)c1cc(c(c(c1)Br)OCCn2ccnc2)Br 7a_100000186470_100000702546 [0,2,0,0,0,0|1,0,0]=3 2520 B20R2.493383 CC(=O)c1cc(c(c(c1)Br)OCCn2cncn2)Br 7a_100000186470_100000731791 [0,2,0,0,0,0|2,0,0]=4 2521 B20R2.493383 CC(=O)c1cc(c(c(c1)C)OCCn2cccc2)C 7a_100011934020_200000035178 [0,2,0,0,0,0|2,0,0]=4 2522 B20R2.493383 CC(=O)c1cc(c(c(c1)C)OCCn2ccnc2)C 7a_100011934020_100000702546 [0,2,0,0,0,0|1,0,0]=3 2523 B20R2.493383 CC(=O)c1cc(c(c(c1)C)OCCn2cncn2)C 34a_100011934020_200000749826 [0,2,0,0,0,0|2,0,0]=4 2524 B20R2.493383 CC(=O)c1cc(c(c(c1)C)OCCn2cncn2)C 7a_100011934020_100000731791 [0,2,0,0,0,0|2,0,0]=4 2525 B20R2.493383 CC(=O)c1cc(c(c(c1)Cl)OCCn2cccc2)Cl 7a_100012337704_200000035178 [0,2,0,0,0,0|2,0,0]=4 2526 B20R2.493383 CC(=O)c1cc(c(c(c1)Cl)OCCn2ccnc2)Cl 7a_100012337704_100000702546 [0,2,0,0,0,0|1,0,0]=3 2527 B20R2.493383 CC(=O)c1cc(c(c(c1)Cl)OCCn2cncn2)Cl 34a_100012337704_200000749826 [0,2,0,0,0,0|2,0,0]=4 2528 B20R2.493383 CC(=O)c1cc(c(c(c1)Cl)OCCn2cncn2)Cl 7a_100012337704_100000731791 [0,2,0,0,0,0|2,0,0]=4 2529 B20R2.493383 CC(=O)c1cc(c(c(c1)F)SCCn2ccnc2)F 62a_100000702546_100010371124 [0,2,0,0,0,0|1,1,0]=4 2530 B20R2.493383 CC(=O)c1cc(c(c(c1)F)SCCn2ccnc2)F 62a_100010371124_100000702546 [0,2,0,0,0,0|1,1,0]=4 2531 B20R2.493383 Cc1cc(cc(c1NCCn2ccnc2)C)C(=O)N 7a_100000068766_100000702546 [0,2,0,0,0,0|2,0,0]=4 2532 B20R2.493383 Cc1cc(cc(c1OCCn2ccnc2)Br)[N+](=O)[O-] 7a_100010889268_100000702546 [0,2,0,0,0,0|1,0,1]=4 2533 B20R2.493383 Cc1cc(cc(c1OCCn2ccnc2)C)[N+](=O)[O-] 7a_100011217877_100000702546 [0,2,0,0,0,0|1,0,1]=4 2534 B20R2.493383 Cc1cc(cc(c1SCCn2ccnc2)C)C(=O)N 62a_100000702546_200009816865 [0,2,0,0,0,0|1,1,0]=4 2535 B20R2.493383 Cc1cc(cc(c1SCCn2ccnc2)C)C(=O)N 62a_200009816865_100000702546 [0,2,0,0,0,0|1,1,0]=4 2536 B20R2.493383 NC(=O)c1cc(c(c(c1)O)SCCn2ccnc2)O 62a_100000702546_200009814324 [0,2,0,0,0,0|1,1,0]=4 2537 B20R2.493383 NC(=O)c1cc(c(c(c1)O)SCCn2ccnc2)O 62a_200009814324_100000702546 [0,2,0,0,0,0|1,1,0]=4 2538 B20R2.493383 Nc1cc(cc(c1OCCn2ccnc2)Cl)[N+](=O)[O-] 7a_100000029776_100000702546 [0,2,0,0,0,0|1,0,1]=4 2539 B20R2.493383 O=[N+]([O-])c1cc(c(c(c1)Br)OCCn2ccnc2)Br 7a_100000184107_100000702546 [0,2,0,0,0,0|1,0,1]=4 2540 B20R2.493383 O=[N+]([O-])c1cc(c(c(c1)Br)OCCn2ccnc2)Cl 7a_100010769427_100000702546 [0,2,0,0,0,0|1,0,1]=4 2541 B20R2.493383 O=[N+]([O-])c1cc(c(c(c1)Br)OCCn2ccnc2)F 7a_200011830256_100000702546 [0,2,0,0,0,0|1,0,1]=4 2542 B20R2.493383 O=[N+]([O-])c1cc(c(c(c1)Cl)OCCn2ccnc2)Cl 7a_100000211554_100000702546 [0,2,0,0,0,0|1,0,1]=4 2543 B20R2.493383 O=[N+]([O-])c1cc(c(c(c1)F)OCCn2ccnc2)F 7a_100011219396_100000702546 [0,2,0,0,0,0|1,0,1]=4 2544 B20R2.493383 O=[N+]([O-])c1cc(c(c(c1)I)OCCn2ccnc2)I 7a_100000032127_100000702546 [0,2,0,0,0,0|1,0,1]=4 2545 B20R2.2904377 CC(=O)c1ccc(c(c1F)F)SCCn2ccnc2 62a_100000702546_100010174444 [0,2,0,0,0,0|1,1,0]=4 2546 B20R2.2904377 CC(=O)c1ccc(c(c1F)F)SCCn2ccnc2 62a_100010174444_100000702546 [0,2,0,0,0,0|1,1,0]=4 2547 B20R2.2904377 Cc1c(ccc(c1C)[N+](=O)[O-])OCCn2ccnc2 7a_100011217262_100000702546 [0,2,0,0,0,0|1,0,1]=4 2548 B20R2.2904377 O=[N+]([O-])c1ccc(c(c1Cl)Cl)OCCn2ccnc2 7a_200012362477_100000702546 [0,2,0,0,0,0|1,0,1]=4 2549 B20R2.2904377 O=[N+]([O-])c1ccc(c(c1Cl)F)OCCn2ccnc2 7a_100015974733_100000702546 [0,2,0,0,0,0|1,0,1]=4 2550 B20R2.2904377 O=[N+]([O-])c1ccc(c(c1F)F)OCCn2ccnc2 7a_100012186193_100000702546 [0,2,0,0,0,0|1,0,1]=4 2551 B20R2.30808 COc1cc(ccc1C(=O)C)OCCn2cccc2 7a_100000116857_200000035178 [0,2,0,0,0,0|2,0,0]=4 2552 B20R2.30808 COc1cc(ccc1C(=O)C)OCCn2ccnc2 7a_100000116857_100000702546 [0,2,0,0,0,0|1,0,0]=3 2553 B20R2.30808 COc1cc(ccc1C(=O)C)OCCn2cncn2 34a_100000116857_200000749826 [0,2,0,0,0,0|2,0,0]=4 2554 B20R2.30808 COc1cc(ccc1C(=O)C)OCCn2cncn2 7a_100000116857_100000731791 [0,2,0,0,0,0|2,0,0]=4 2555 B20R2.30808 COc1cc(ccc1C(=O)C)SCCn2ccnc2 62a_100000709911_100000702546 [0,2,0,0,0,0|1,1,0]=4 2556 B20R2.30808 COc1cc(ccc1C(=O)N)SCCn2ccnc2 62a_100000748320_100000702546 [0,2,0,0,0,0|1,1,0]=4 2557 B20R2.30808 COc1cc(ccc1[N+](=O)[O-])OCCn2ccnc2 7a_100000723347_100000702546 [0,2,0,0,0,0|1,0,1]=4 2558 B20R2.30808 O=[N+]([O-])c1ccc(cc1CO)OCCn2ccnc2 7a_100000032882_100000702546 [0,2,0,0,0,0|1,0,1]=4 2559 B20R2.67036 CC(=O)c1ccc(cc1O)OCCn2cc(nn2)C 274090a_200010192467_200000242740 [0,2,0,0,0,0|2,0,0]=4 2560 B20R2.77001 CC(=O)c1ccc(cc1Br)OCCn2ccnc2C 7a_100012340537_100000742477 [0,2,0,0,0,0|1,0,0]=3 2561 B20R2.77001 CC(=O)c1ccc(cc1C)OCCn2ccnc2C 7a_100000702595_100000742477 [0,2,0,0,0,0|1,0,0]=3 2562 B20R2.77001 CC(=O)c1ccc(cc1C)SCCn2ccnc2C 62a_100000742477_100012360112 [0,2,0,0,0,0|1,1,0]=4 2563 B20R2.77001 CC(=O)c1ccc(cc1C)SCCn2ccnc2C 62a_100012360112_100000742477 [0,2,0,0,0,0|1,1,0]=4 2564 B20R2.77001 CC(=O)c1ccc(cc1Cl)OCCn2ccnc2C 7a_100011933989_100000742477 [0,2,0,0,0,0|1,0,0]=3 2565 B20R2.77001 CC(=O)c1ccc(cc1F)NCCn2ccnc2C 27a_100015184736_100000690205 [0,2,0,0,0,0|2,0,0]=4 2566 B20R2.77001 CC(=O)c1ccc(cc1F)OCCn2ccnc2C 7a_100000752407_100000742477 [0,2,0,0,0,0|1,0,0]=3 2567 B20R2.77001 CC(=O)c1ccc(cc1F)SCCn2ccnc2C 62a_100000690205_100000742477 [0,2,0,0,0,0|1,1,0]=4 2568 B20R2.77001 CC(=O)c1ccc(cc1N)SCCn2ccnc2C 62a_100011590516_100000742477 [0,2,0,0,0,0|1,1,0]=4 2569 B20R2.77001 Cc1cc(ccc1C(=O)N)NCCn2ccnc2C 27a_100015184736_100011327924 [0,2,0,0,0,0|2,0,0]=4 2570 B20R2.77001 Cc1cc(ccc1C(=O)N)NCCn2ccnc2C 7a_200000751758_100000742477 [0,2,0,0,0,0|2,0,0]=4 2571 B20R2.77001 Cc1cc(ccc1C(=O)N)SCCn2ccnc2C 62a_100000742477_100011327924 [0,2,0,0,0,0|1,1,0]=4 2572 B20R2.77001 Cc1cc(ccc1C(=O)N)SCCn2ccnc2C 62a_100011327924_100000742477 [0,2,0,0,0,0|1,1,0]=4 2573 B20R2.77001 Cc1cc(ccc1[N+](=O)[O-])OCCn2ccnc2C 7a_100000195451_100000742477 [0,2,0,0,0,0|1,0,1]=4 2574 B20R2.77001 Cc1nccn1CCNc2ccc(c(c2)Br)C(=O)N 27a_100015184736_200010146565 [0,2,0,0,0,0|2,0,0]=4 2575 B20R2.77001 Cc1nccn1CCNc2ccc(c(c2)Cl)C(=O)N 7a_100000737725_100000742477 [0,2,0,0,0,0|2,0,0]=4 2576 B20R2.77001 Cc1nccn1CCNc2ccc(c(c2)F)C(=O)N 27a_100015184736_100000216903 [0,2,0,0,0,0|2,0,0]=4 2577 B20R2.77001 Cc1nccn1CCNc2ccc(c(c2)F)C(=O)N 7a_100000749959_100000742477 [0,2,0,0,0,0|2,0,0]=4 2578 B20R2.77001 Cc1nccn1CCNc2ccc(c(c2)O)C(=O)N 7a_100000223280_100000742477 [0,2,0,0,0,0|2,0,0]=4 2579 B20R2.77001 Cc1nccn1CCOc2ccc(c(c2)Br)[N+](=O)[O-] 7a_100012356988_100000742477 [0,2,0,0,0,0|1,0,1]=4 2580 B20R2.77001 Cc1nccn1CCOc2ccc(c(c2)Cl)C(=O)N 7a_100011997949_100000742477 [0,2,0,0,0,0|1,0,0]=3 2581 B20R2.77001 Cc1nccn1CCOc2ccc(c(c2)Cl)[N+](=O)[O-] 7a_100000746235_100000742477 [0,2,0,0,0,0|1,0,1]=4 2582 B20R2.77001 Cc1nccn1CCOc2ccc(c(c2)F)C(=O)N 7a_200012186767_100000742477 [0,2,0,0,0,0|1,0,0]=3 2583 B20R2.77001 Cc1nccn1CCOc2ccc(c(c2)F)[N+](=O)[O-] 7a_100000745333_100000742477 [0,2,0,0,0,0|1,0,1]=4 2584 B20R2.77001 Cc1nccn1CCOc2ccc(c(c2)I)[N+](=O)[O-] 7a_100010243554_100000742477 [0,2,0,0,0,0|1,0,1]=4 2585 B20R2.77001 Cc1nccn1CCOc2ccc(c(c2)N)C(=O)N 7a_100012186684_100000742477 [0,2,0,0,0,0|1,0,0]=3 2586 B20R2.77001 Cc1nccn1CCOc2ccc(c(c2)N)[N+](=O)[O-] 7a_100000729835_100000742477 [0,2,0,0,0,0|1,0,1]=4 2587 B20R2.77001 Cc1nccn1CCSc2ccc(c(c2)Br)C(=O)N 62a_200010146565_100000742477 [0,2,0,0,0,0|1,1,0]=4 2588 B20R2.77001 Cc1nccn1CCSc2ccc(c(c2)F)C(=O)N 62a_100000216903_100000742477 [0,2,0,0,0,0|1,1,0]=4 2589 B20R2.77001 Cc1nccn1CCSc2ccc(c(c2)N)C(=O)N 62a_100012349972_100000742477 [0,2,0,0,0,0|1,1,0]=4 2590 B20R2.77001 Cc1nccn1CCSc2ccc(c(c2)O)C(=O)N 62a_100011550861_100000742477 [0,2,0,0,0,0|1,1,0]=4 2591 B20R2.493413 CC(=O)c1c(cc(cc1F)SCCn2ccnc2)F 62a_100000702546_100012706838 [0,2,0,0,0,0|1,1,0]=4 2592 B20R2.493413 CC(=O)c1c(cc(cc1F)SCCn2ccnc2)F 62a_100012706838_100000702546 [0,2,0,0,0,0|1,1,0]=4 2593 B20R2.493413 CC(=O)c1c(cc(cc1F)SCCn2ccnc2)O 62a_100000702546_100010734142 [0,2,0,0,0,0|1,1,0]=4 2594 B20R2.493413 Cc1cc(cc(c1C(=O)N)F)NCCn2ccnc2 27a_100000230061_100016096366 [0,2,0,0,0,0|2,0,0]=4 2595 B20R2.493413 Cc1cc(cc(c1C(=O)N)F)SCCn2ccnc2 62a_100000702546_100016096366 [0,2,0,0,0,0|1,1,0]=4 2596 B20R2.493413 Cc1cc(cc(c1C(=O)N)F)SCCn2ccnc2 62a_100016096366_100000702546 [0,2,0,0,0,0|1,1,0]=4 2597 B20R2.493413 Cc1cc(cc(c1[N+](=O)[O-])C)OCCn2ccnc2 7a_100012186654_100000702546 [0,2,0,0,0,0|1,0,1]=4 2598 B20R2.493413 NC(=O)c1c(cc(cc1F)NCCn2ccnc2)F 27a_100000230061_100000695656 [0,2,0,0,0,0|2,0,0]=4 2599 B20R2.493413 NC(=O)c1c(cc(cc1F)SCCn2ccnc2)F 62a_100000695656_100000702546 [0,2,0,0,0,0|1,1,0]=4 2600 B20R2.493413 NC(=O)c1c(cc(cc1F)SCCn2ccnc2)F 62a_100000702546_100000695656 [0,2,0,0,0,0|1,1,0]=4 2601 B20R2.2699775 Cc1ncn(c1C)CCNc2ccc(cc2)C(=O)N 27a_100015187747_100000162191 [0,2,0,0,0,0|2,0,0]=4 2602 B20R2.45802 C=C(C)c1ccc(cc1)OCCn2ccnc2CC 34a_100009880102_100015185934 [0,2,0,0,0,0|2,0,0]=4 2603 B20R2.45802 C=C(C)c1ccc(cc1)OCCn2ccnc2CC 7a_100009880102_100015185934 [0,2,0,0,0,0|2,0,0]=4 2604 B20R2.45802 CCc1nccn1CCNc2ccc(cc2)C(=O)N 27a_100020604629_100000162191 [0,2,0,0,0,0|2,0,0]=4 2605 B20R2.45802 CCc1nccn1CCNc2ccc(cc2)C(=O)N 34a_100000210537_100015185934 [0,2,0,0,0,0|2,0,0]=4 2606 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)C(=O)C 34a_100000185113_100015185934 [0,2,0,0,0,0|1,0,0]=3 2607 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)C(=O)C 7a_100000185113_100015185934 [0,2,0,0,0,0|1,0,0]=3 2608 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)C(=O)N 34a_100000746352_100015185934 [0,2,0,0,0,0|1,0,0]=3 2609 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)C(=O)N 7a_100000746352_100015185934 [0,2,0,0,0,0|1,0,0]=3 2610 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)C(C)O 34a_100000754508_100015185934 [0,2,0,0,0,0|1,0,1]=4 2611 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)C(C)O 7a_100000754508_100015185934 [0,2,0,0,0,0|1,0,1]=4 2612 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)S(=O)C 34a_200000064373_100015185934 [0,2,0,0,0,0|2,0,0]=4 2613 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)S(=O)C 7a_200000064373_100015185934 [0,2,0,0,0,0|2,0,0]=4 2614 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)[N+](=O)[O-] 34a_100000185810_100015185934 [0,2,0,0,0,0|1,0,1]=4 2615 B20R2.45802 CCc1nccn1CCOc2ccc(cc2)[N+](=O)[O-] 7a_100000185810_100015185934 [0,2,0,0,0,0|1,0,1]=4 2616 B20R2.45802 CCc1nccn1CCOc2ccc(nc2)C(=O)C 34a_100012001710_100015185934 [0,2,0,0,0,0|2,0,0]=4 2617 B20R2.45802 CCc1nccn1CCOc2ccc(nc2)C(=O)C 7a_100012001710_100015185934 [0,2,0,0,0,0|2,0,0]=4 2618 B20R2.45802 CCc1nccn1CCSc2ccc(cc2)C(=O)C 62a_100000185465_100015185934 [0,2,0,0,0,0|1,1,0]=4 2619 B20R2.45802 CCc1nccn1CCSc2ccc(cc2)C(=O)C 62a_100015185934_100000185465 [0,2,0,0,0,0|1,1,0]=4 2620 B20R2.45802 CCc1nccn1CCSc2ccc(cc2)C(=O)N 62a_100000162191_100015185934 [0,2,0,0,0,0|1,1,0]=4 2621 B20R2.45802 CCc1nccn1CCSc2ccc(cc2)C(=O)N 62a_100015185934_100000162191 [0,2,0,0,0,0|1,1,0]=4 2622 B20R2.74150 CC(=O)c1ccc(cc1)OCCn2c(csc2=O)C 7a_100000185113_100000204612 [0,2,0,0,0,0|2,0,0]=4 2623 B20R2.74150 Cc1csc(=O)n1CCOc2ccc(cc2)C(=O)N 7a_100000746352_100000204612 [0,2,0,0,0,0|2,0,0]=4 2624 B20R3.12030 Brc1nc2ccc(cc2s1)OCCn3ccnc3 7a_100010063415_100000702546 [0,0,0,1,0,1|1,1,0]=4 2625 B20R3.12030 Cc1cc2cc(ccc2[nH]1)OCCn3ccnc3 7a_100000073708_100000702546 [0,0,0,1,0,1|2,0,0]=4 2626 B20R3.12030 Cc1cc2ccc(cc2o1)OCCn3cccc3 7a_100000095638_200000035178 [0,0,0,1,0,1|2,0,0]=4 2627 B20R3.12030 Cc1cc2ccc(cc2o1)OCCn3ccnc3 7a_100000095638_100000702546 [0,0,0,1,0,1|1,0,0]=3 2628 B20R3.12030 Cc1cc2ccc(cc2o1)OCCn3cncn3 34a_100000095638_200000749826 [0,0,0,1,0,1|2,0,0]=4 2629 B20R3.12030 Cc1cc2ccc(cc2o1)OCCn3cncn3 7a_100000095638_100000731791 [0,0,0,1,0,1|2,0,0]=4 2630 B20R3.12030 Cc1nc2cc(ccc2o1)OCCn3ccnc3 7a_100000102623_100000702546 [0,0,0,1,0,1|2,0,0]=4 2631 B20R3.12030 Cc1nc2cc(ccc2s1)OCCn3ccnc3 7a_100000031546_100000702546 [0,0,0,1,0,1|2,0,0]=4 2632 B20R3.12030 Cc1nc2ccc(cc2o1)OCCn3cccc3 7a_100000116946_200000035178 [0,0,0,1,0,1|2,0,0]=4 2633 B20R3.12030 Cc1nc2ccc(cc2o1)OCCn3ccnc3 7a_100000116946_100000702546 [0,0,0,1,0,1|1,0,0]=3 2634 B20R3.12030 Cc1nc2ccc(cc2o1)OCCn3cncn3 34a_100000116946_200000749826 [0,0,0,1,0,1|2,0,0]=4 2635 B20R3.12030 Cc1nc2ccc(cc2o1)OCCn3cncn3 7a_100000116946_100000731791 [0,0,0,1,0,1|2,0,0]=4 2636 B20R3.12030 Cc1nc2ccc(cc2o1)SCCn3ccnc3 62a_100000702546_100010171164 [0,0,0,1,0,1|1,1,0]=4 2637 B20R3.12030 Cc1nc2ccc(cc2s1)OCCn3ccnc3 7a_100000008955_100000702546 [0,0,0,1,0,1|1,1,0]=4 2638 B20R3.12030 Clc1nc2cc(ccc2o1)OCCn3ccnc3 7a_100010673232_100000702546 [0,0,0,1,0,1|2,0,0]=4 2639 B20R3.12030 Nc1nc2cc(ccc2s1)OCCn3ccnc3 7a_100000066538_100000702546 [0,0,0,1,0,1|2,0,0]=4 2640 B20R3.12030 Nc1nc2ccc(cc2s1)OCCn3ccnc3 7a_100000012012_100000702546 [0,0,0,1,0,1|1,1,0]=4 2641 B20R3.12030 O=C1Cc2cc(ccc2N1)SCCn3ccnc3 62a_100000702546_100000754858 [0,0,0,1,0,1|1,1,0]=4 2642 B20R3.12030 O=C1Cc2cc(ccc2O1)OCCn3cccc3 7a_100000035078_200000035178 [0,0,0,1,0,1|2,0,0]=4 2643 B20R3.12030 O=C1Cc2cc(ccc2O1)OCCn3ccnc3 7a_100000035078_100000702546 [0,0,0,1,0,1|1,0,0]=3 2644 B20R3.12030 O=C1Cc2cc(ccc2O1)OCCn3cncn3 34a_100000035078_200000749826 [0,0,0,1,0,1|2,0,0]=4 2645 B20R3.12030 O=C1Cc2cc(ccc2O1)OCCn3cncn3 7a_100000035078_100000731791 [0,0,0,1,0,1|2,0,0]=4 2646 B20R3.12030 O=C1Cc2ccc(cc2C1)SCCn3ccnc3 62a_100010185598_100000702546 [0,0,0,1,0,1|1,1,0]=4 2647 B20R3.12030 O=C1Cc2ccc(cc2N1)SCCn3ccnc3 62a_100000702546_100000760487 [0,0,0,1,0,1|1,1,0]=4 2648 B20R3.12030 O=c1[nH]c2ccc(cc2[nH]1)SCCn3ccnc3 62a_100000702546_200011356815 [0,0,0,1,0,1|1,1,0]=4 2649 B20R3.12030 O=c1[nH]c2ccc(cc2o1)OCCc3cn[nH]c3 7a_200000068749_100000743252 [0,0,0,1,0,1|2,0,0]=4 2650 B20R3.12030 O=c1[nH]c2ccc(cc2o1)OCCn3cccc3 7a_200000068749_200000035178 [0,0,0,1,0,1|1,0,0]=3 2651 B20R3.12030 O=c1[nH]c2ccc(cc2o1)OCCn3cccn3 7a_200000068749_100000685285 [0,0,0,1,0,1|2,0,0]=4 2652 B20R3.12030 O=c1[nH]c2ccc(cc2o1)OCCn3ccnc3 7a_200000068749_100000702546 [0,0,0,1,0,1|0,0,0]=2 2653 B20R3.12030 O=c1[nH]c2ccc(cc2o1)OCCn3cncn3 7a_200000068749_100000731791 [0,0,0,1,0,1|1,0,0]=3 2654 B20R3.12030 O=c1[nH]c2ccc(cc2o1)SCCn3cccc3 62a_200009811947_100000697996 [0,0,0,1,0,1|1,1,0]=4 2655 B20R3.12030 O=c1[nH]c2ccc(cc2o1)SCCn3ccnc3 62a_100000702546_100000697996 [0,0,0,1,0,1|0,1,0]=3 2656 B20R3.12030 O=c1[nH]c2ccc(cc2o1)SCCn3cncn3 62a_100000731791_100000697996 [0,0,0,1,0,1|1,1,0]=4 2657 B20R3.12030 O=c1[nH]c2ncc(cc2o1)SCCn3ccnc3 62a_100000702546_100000721845 [0,0,0,1,0,1|1,1,0]=4 2658 B20R3.15716 NC(=O)c1ccc(cc1)N2CC(C2)n3ccnc3 27a_100020592337_100000162191 [0,1,0,1,0,0|2,0,0]=4 2659 B20R3.15729 NC(=O)c1ccc(cc1)N2CCn3ccnc3C2 27a_100000749140_100000162191 [0,1,0,1,0,0|2,0,0]=4 2660 B20R3.15729 NC(=O)c1ccc(cc1)N2CCn3cncc3C2 27a_100000058933_100000162191 [0,1,0,1,0,0|2,0,0]=4 2661 B20R3.145862 Cc1coc2c1ccc(c2)SCCn3ccnc3 62a_100000702546_100010775837 [0,1,0,1,0,0|1,1,0]=4 2662 B20R3.145862 Cc1noc2c1ccc(c2)OCCn3cncn3 34a_200000076027_200000749826 [0,1,0,1,0,0|2,0,0]=4 2663 B20R3.145862 Cc1noc2c1ccc(c2)SCCn3ccnc3 62a_100000702546_100009815287 [0,1,0,1,0,0|1,1,0]=4 2664 B20R3.145862 Cc1noc2c1ccc(c2)SCCn3ccnc3 62a_100009815287_100000702546 [0,1,0,1,0,0|1,1,0]=4 2665 B20R3.145862 Nc1noc2c1ccc(c2)SCCn3ccnc3 62a_100000702546_100012356334 [0,1,0,1,0,0|1,1,0]=4 2666 B20R3.145862 Nc1noc2c1ccc(c2)SCCn3ccnc3 62a_100012356334_100000702546 [0,1,0,1,0,0|1,1,0]=4 2667 B20R3.145862 O=C1C=Cc2c1ccc(c2)SCCn3ccnc3 62a_100000702546_100010210589 [0,1,0,1,0,0|1,1,0]=4 2668 B20R3.145862 O=C1C=Cc2c1ccc(c2)SCCn3ccnc3 62a_100010210589_100000702546 [0,1,0,1,0,0|1,1,0]=4 2669 B20R3.145862 O=C1CCc2c1ccc(c2)OCCn3cccc3 7a_100000708912_200000035178 [0,1,0,1,0,0|2,0,0]=4 2670 B20R3.145862 O=C1CCc2c1ccc(c2)OCCn3ccnc3 7a_100000708912_100000702546 [0,1,0,1,0,0|1,0,0]=3 2671 B20R3.145862 O=C1CCc2c1ccc(c2)OCCn3cncn3 34a_100000708912_200000749826 [0,1,0,1,0,0|2,0,0]=4 2672 B20R3.145862 O=C1CCc2c1ccc(c2)OCCn3cncn3 7a_100000708912_100000731791 [0,1,0,1,0,0|2,0,0]=4 2673 B20R3.145862 O=C1CCc2c1ccc(c2)SCCn3ccnc3 62a_100000702546_100000737041 [0,1,0,1,0,0|1,1,0]=4 2674 B20R3.145862 O=C1CCc2c1ccc(c2)SCCn3ccnc3 62a_100000737041_100000702546 [0,1,0,1,0,0|1,1,0]=4 2675 B20R3.145862 O=C1COc2c1ccc(c2)SCCn3cccc3 62a_200009811947_100000686717 [0,1,0,1,0,0|1,1,0]=4 2676 B20R3.145862 O=C1COc2c1ccc(c2)SCCn3ccnc3 62a_100000702546_100000686717 [0,1,0,1,0,0|0,1,0]=3 2677 B20R3.145862 O=C1COc2c1ccc(c2)SCCn3cncn3 62a_100000731791_100000686717 [0,1,0,1,0,0|1,1,0]=4 2678 B20R3.145862 O=C1NCc2c1ccc(c2)OCCn3cncn3 34a_100000098542_200000749826 [0,1,0,1,0,0|2,0,0]=4 2679 B20R3.145862 O=C1NCc2c1ccc(c2)SCCn3ccnc3 62a_100000692135_100000702546 [0,1,0,1,0,0|1,1,0]=4 2680 B20R3.145862 O=C1NCc2c1ccc(c2)SCCn3ccnc3 62a_100000702546_100000692135 [0,1,0,1,0,0|1,1,0]=4 2681 B20R3.145862 O=C1OCc2c1ccc(c2)OCCc3cn[nH]c3 7a_100000044543_100000743252 [0,1,0,1,0,0|2,0,0]=4 2682 B20R3.145862 O=C1OCc2c1ccc(c2)OCCn3cccc3 7a_100000044543_200000035178 [0,1,0,1,0,0|1,0,0]=3 2683 B20R3.145862 O=C1OCc2c1ccc(c2)OCCn3cccn3 7a_100000044543_100000685285 [0,1,0,1,0,0|2,0,0]=4 2684 B20R3.145862 O=C1OCc2c1ccc(c2)OCCn3ccnc3 7a_100000044543_100000702546 [0,1,0,1,0,0|0,0,0]=2 2685 B20R3.145862 O=C1OCc2c1ccc(c2)OCCn3cncn3 7a_100000044543_100000731791 [0,1,0,1,0,0|1,0,0]=3 2686 B20R3.145862 O=C1OCc2c1ccc(c2)SCCn3cccc3 62a_100009816608_200000035178 [0,1,0,1,0,0|1,1,0]=4 2687 B20R3.145862 O=C1OCc2c1ccc(c2)SCCn3ccnc3 62a_100009816608_100000702546 [0,1,0,1,0,0|0,1,0]=3 2688 B20R3.145862 O=C1OCc2c1ccc(c2)SCCn3cncn3 62a_100009816608_100000731791 [0,1,0,1,0,0|1,1,0]=4 2689 B20R3.145862 O=c1[nH][nH]c2c1ccc(c2)SCCn3ccnc3 62a_100000702546_100012353722 [0,1,0,1,0,0|1,1,0]=4 2690 B16R2.42 C=Cc1ccc(cc1)OCn2cncn2 34a_100000189437_200020645497 [1,0,0,0,1,0|2,0,0]=4 2691 B16R2.42 C=Cc1ccc(cc1)OCn2cncn2 7a_100000189437_200020645497 [1,0,0,0,1,0|2,0,0]=4 2692 B16R2.42 O=Cc1ccc(cc1)SCn2cncn2 62a_100000188517_200020645497 [1,0,0,0,1,0|1,1,0]=4 2693 B16R2.42 O=Cc1ccc(cc1)SCn2cncn2 62a_200020645497_100000188517 [1,0,0,0,1,0|1,1,0]=4 2694 B16R2.42 OCc1ccc(cc1)OCn2cncn2 34a_100000211755_200020645497 [1,0,0,0,1,0|1,0,1]=4 2695 B16R2.2338 O=Cc1c[nH]c(c1)SCCn2ccnc2 62a_100000702546_100009882863 [1,0,0,0,1,0|1,1,0]=4 2696 B16R2.2338 O=Cc1c[nH]c(c1)SCCn2ccnc2 62a_100009882863_100000702546 [1,0,0,0,1,0|1,1,0]=4 2697 B16R2.2338 O=Cc1cc(c[nH]1)SCCn2ccnc2 62a_100000702546_100000720742 [1,0,0,0,1,0|1,1,0]=4 2698 B16R2.2338 O=Cc1cc(c[nH]1)SCCn2ccnc2 62a_100000720742_100000702546 [1,0,0,0,1,0|1,1,0]=4 2699 B16R2.2338 O=Cc1cc(co1)SCCn2ccnc2 62a_100000702546_100000747035 [1,0,0,0,1,0|1,1,0]=4 2700 B16R2.2338 O=Cc1cc(co1)SCCn2ccnc2 62a_100000747035_100000702546 [1,0,0,0,1,0|1,1,0]=4 2701 B16R2.2338 O=Cc1cc(cs1)SCCn2ccnc2 62a_100000211722_100000702546 [1,0,0,0,1,0|1,1,0]=4 2702 B16R2.2338 O=Cc1cc(cs1)SCCn2ccnc2 62a_100000702546_100000211722 [1,0,0,0,1,0|1,1,0]=4 2703 B16R2.2338 O=Cc1ccc([nH]1)SCCn2ccnc2 62a_100000702546_100009875417 [1,0,0,0,1,0|1,1,0]=4 2704 B16R2.2338 O=Cc1ccc(o1)SCCn2ccnc2 62a_100000702546_100000186757 [1,0,0,0,1,0|1,1,0]=4 2705 B16R2.2338 O=Cc1ccc(s1)SCCn2ccnc2 62a_100000179771_100000702546 [1,0,0,0,1,0|1,1,0]=4 2706 B16R2.2338 O=Cc1ccc(s1)SCCn2ccnc2 62a_100000702546_100000179771 [1,0,0,0,1,0|1,1,0]=4 2707 B16R2.2338 O=Cc1csc(c1)SCCn2ccnc2 62a_100000702546_100000737087 [1,0,0,0,1,0|1,1,0]=4 2708 B16R2.2338 O=Cc1csc(c1)SCCn2ccnc2 62a_100000737087_100000702546 [1,0,0,0,1,0|1,1,0]=4 2709 B16R2.481 C=C(C)c1ccc(cc1)Cn2ccnc2 271570a_100000694244_200000188502 [0,0,0,0,2,0|2,0,0]=4 2710 B16R2.481 CC(=O)c1ccc(cc1)Cn2cncn2 1458a_100000242773_200000210301 [0,0,0,0,2,0|2,0,0]=4 2711 B16R2.481 [13CH3]C(=O)c1ccc(cc1)Cn2cncn2 1458a_100000242773_200025704644 [0,0,0,0,2,0|2,0,0]=4 2712 B18R2.61 C=Cc1ccc(cc1)OCCc2cccnc2 7a_100000189437_200011713674 [1,0,0,0,0,1|2,0,0]=4 2713 B18R2.61 C=Cc1ccc(cc1)OCCc2ccncc2 7a_100000189437_100000723409 [1,0,0,0,0,1|2,0,0]=4 2714 B18R2.61 O=Cc1ccc(cc1)OCCN2CC=CCC2 2230a_100000698166_100000040479 [1,0,0,0,0,1|1,0,1]=4 2715 B18R2.61 O=Cc1ccc(cc1)OCCN2CC=CCC2 269982a_100000698166_100000040479 [1,0,0,0,0,1|1,0,1]=4 2716 B18R2.61 O=Cc1ccc(cc1)OCCN2CC=CCC2 34a_100000698166_100000040479 [1,0,0,0,0,1|1,0,1]=4 2717 B18R2.61 O=Cc1ccc(cc1)SCCc2cccnc2 62a_100000188517_200011713674 [1,0,0,0,0,1|1,1,0]=4 2718 B18R2.61 O=Cc1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000188517 [1,0,0,0,0,1|1,1,0]=4 2719 B18R2.61 O=Cc1ccc(cc1)SCCc2ccncc2 62a_100000188517_100000723409 [1,0,0,0,0,1|1,1,0]=4 2720 B18R2.61 O=Cc1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000188517 [1,0,0,0,0,1|1,1,0]=4 2721 B18R2.79 BrCc1ccc(cc1)COCCn2ccnc2 7a_100012353999_100000702546 [1,0,0,0,0,1|1,0,1]=4 2722 B18R2.79 C#Cc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000140223 [1,0,0,0,0,1|1,0,1]=4 2723 B18R2.79 C#Cc1ccc(cc1)COCCn2ccnc2 7a_100000054647_100000702546 [1,0,0,0,0,1|1,0,1]=4 2724 B18R2.79 C=Cc1ccc(cc1)CNCCn2ccnc2 270004a_100000230061_100011361436 [1,0,0,0,0,1|2,0,0]=4 2725 B18R2.79 C=Cc1ccc(cc1)COCCn2cccc2 34a_100000179382_100000034074 [1,0,0,0,0,1|2,0,0]=4 2726 B18R2.79 C=Cc1ccc(cc1)COCCn2cccc2 7a_100000073583_200000035178 [1,0,0,0,0,1|2,0,0]=4 2727 B18R2.79 C=Cc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000034074 [1,0,0,0,0,1|1,0,0]=3 2728 B18R2.79 C=Cc1ccc(cc1)COCCn2ccnc2 7a_100000073583_100000702546 [1,0,0,0,0,1|1,0,0]=3 2729 B18R2.79 C=Cc1ccc(cc1)COCCn2ccnn2 34a_100000080814_100000034074 [1,0,0,0,0,1|2,0,0]=4 2730 B18R2.79 C=Cc1ccc(cc1)COCCn2cncn2 34a_100000073583_200000749826 [1,0,0,0,0,1|2,0,0]=4 2731 B18R2.79 C=Cc1ccc(cc1)COCCn2cncn2 34a_100000745309_100000034074 [1,0,0,0,0,1|2,0,0]=4 2732 B18R2.79 C=Cc1ccc(cc1)COCCn2cncn2 7a_100000073583_100000731791 [1,0,0,0,0,1|2,0,0]=4 2733 B18R2.79 C=Cc1ccc(cc1)COCCn2cnnc2 34a_200011637517_100000034074 [1,0,0,0,0,1|2,0,0]=4 2734 B18R2.79 C=Cc1ccc(cc1)CSCCn2ccnc2 62a_100000034074_100000702546 [1,0,0,0,0,1|1,1,0]=4 2735 B18R2.79 C=Cc1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000034074 [1,0,0,0,0,1|1,1,0]=4 2736 B18R2.79 C=Cc1ccc(cc1)NCCCn2ccnc2 34a_100011218248_100000756272 [1,0,0,0,0,1|2,0,0]=4 2737 B18R2.79 C=Cc1ccc(cc1)OCCCn2cccc2 34a_100000189437_200009814367 [1,0,0,0,0,1|2,0,0]=4 2738 B18R2.79 C=Cc1ccc(cc1)OCCCn2cccc2 7a_100000189437_200009814367 [1,0,0,0,0,1|2,0,0]=4 2739 B18R2.79 C=Cc1ccc(cc1)OCCCn2ccnc2 34a_100000189437_100000756272 [1,0,0,0,0,1|1,0,0]=3 2740 B18R2.79 C=Cc1ccc(cc1)OCCCn2ccnc2 7a_100000189437_100000756272 [1,0,0,0,0,1|1,0,0]=3 2741 B18R2.79 C=Cc1ccc(cc1)OCCCn2cncn2 34a_100000189437_100102700105 [1,0,0,0,0,1|2,0,0]=4 2742 B18R2.79 C=Cc1ccc(cc1)OCCCn2cncn2 7a_100000189437_100102700105 [1,0,0,0,0,1|2,0,0]=4 2743 B18R2.79 C=Cc1ccc(cc1)SCCCn2ccnc2 62a_100000748128_100000756272 [1,0,0,0,0,1|1,1,0]=4 2744 B18R2.79 C=Cc1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000748128 [1,0,0,0,0,1|1,1,0]=4 2745 B18R2.79 CCc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000747183 [1,0,0,0,0,1|1,0,1]=4 2746 B18R2.79 CCc1ccc(cc1)COCCn2ccnc2 7a_100000702245_100000702546 [1,0,0,0,0,1|1,0,1]=4 2747 B18R2.79 CCc1ccc(cc1)OCCCn2ccnc2 34a_100000211359_100000756272 [1,0,0,0,0,1|1,0,1]=4 2748 B18R2.79 CCc1ccc(cc1)OCCCn2ccnc2 7a_100000211359_100000756272 [1,0,0,0,0,1|1,0,1]=4 2749 B18R2.79 CNc1ccc(cc1)OCCCn2ccnc2 34a_100000182112_100000756272 [1,0,0,0,0,1|2,0,0]=4 2750 B18R2.79 COc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000742318 [1,0,0,0,0,1|2,0,0]=4 2751 B18R2.79 COc1ccc(cc1)OCCCn2ccnc2 34a_100000210503_100000756272 [1,0,0,0,0,1|2,0,0]=4 2752 B18R2.79 CSc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000181263 [1,0,0,0,0,1|2,0,0]=4 2753 B18R2.79 CSc1ccc(cc1)COCCn2ccnc2 7a_100011215404_100000702546 [1,0,0,0,0,1|2,0,0]=4 2754 B18R2.79 CSc1ccc(cc1)OCCCn2ccnc2 34a_100000211864_100000756272 [1,0,0,0,0,1|2,0,0]=4 2755 B18R2.79 ClCc1ccc(cc1)COCCn2ccnc2 7a_100000067286_100000702546 [1,0,0,0,0,1|1,0,1]=4 2756 B18R2.79 N#Cc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000184898 [1,0,0,0,0,1|1,0,1]=4 2757 B18R2.79 N#Cc1ccc(cc1)COCCn2ccnc2 7a_100000238739_100000702546 [1,0,0,0,0,1|1,0,1]=4 2758 B18R2.79 N#Cc1ccc(cc1)OCCCn2ccnc2 34a_100000210344_100000756272 [1,0,0,0,0,1|1,0,1]=4 2759 B18R2.79 N#Cc1ccc(cc1)OCCCn2ccnc2 7a_100000210344_100000756272 [1,0,0,0,0,1|1,0,1]=4 2760 B18R2.79 NCc1ccc(cc1)OCCCn2ccnc2 34a_100000185549_100000756272 [1,0,0,0,0,1|1,0,1]=4 2761 B18R2.79 O=Cc1ccc(cc1)CNCCn2cccc2 34a_100011368172_100009816848 [1,0,0,0,0,1|2,0,0]=4 2762 B18R2.79 O=Cc1ccc(cc1)CNCCn2cncn2 2230a_200000738561_100009816848 [1,0,0,0,0,1|2,0,0]=4 2763 B18R2.79 O=Cc1ccc(cc1)COCC[n+]2ccsc2 34a_200000100414_100009816848 [1,0,0,0,0,1|1,0,1]=4 2764 B18R2.79 O=Cc1ccc(cc1)COCCc2ccsc2 34a_100000748821_100009816848 [1,0,0,0,0,1|2,0,0]=4 2765 B18R2.79 O=Cc1ccc(cc1)COCCc2cn[nH]c2 34a_100000766553_100009816848 [1,0,0,0,0,1|2,0,0]=4 2766 B18R2.79 O=Cc1ccc(cc1)COCCc2cnoc2 34a_100000732699_100009816848 [1,0,0,0,0,1|2,0,0]=4 2767 B18R2.79 O=Cc1ccc(cc1)COCCn2cccc2 34a_100000179382_100009816848 [1,0,0,0,0,1|1,0,0]=3 2768 B18R2.79 O=Cc1ccc(cc1)COCCn2cccn2 34a_100000743371_100009816848 [1,0,0,0,0,1|2,0,0]=4 2769 B18R2.79 O=Cc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100009816848 [1,0,0,0,0,1|0,0,0]=2 2770 B18R2.79 O=Cc1ccc(cc1)COCCn2ccnn2 34a_100000080814_100009816848 [1,0,0,0,0,1|1,0,0]=3 2771 B18R2.79 O=Cc1ccc(cc1)COCCn2cncn2 34a_100000745309_100009816848 [1,0,0,0,0,1|1,0,0]=3 2772 B18R2.79 O=Cc1ccc(cc1)COCCn2cnnc2 34a_200011637517_100009816848 [1,0,0,0,0,1|1,0,0]=3 2773 B18R2.79 O=Cc1ccc(cc1)CSCCn2cccc2 62a_100009816848_200000035178 [1,0,0,0,0,1|1,1,0]=4 2774 B18R2.79 O=Cc1ccc(cc1)CSCCn2cccc2 62a_200009811947_100009816848 [1,0,0,0,0,1|1,1,0]=4 2775 B18R2.79 O=Cc1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100009816848 [1,0,0,0,0,1|0,1,0]=3 2776 B18R2.79 O=Cc1ccc(cc1)CSCCn2ccnc2 62a_100009816848_100000702546 [1,0,0,0,0,1|0,1,0]=3 2777 B18R2.79 O=Cc1ccc(cc1)CSCCn2cncn2 62a_100000731791_100009816848 [1,0,0,0,0,1|1,1,0]=4 2778 B18R2.79 O=Cc1ccc(cc1)CSCCn2cncn2 62a_100009816848_100000731791 [1,0,0,0,0,1|1,1,0]=4 2779 B18R2.79 O=Cc1ccc(cc1)OCCOc2ccsc2 34a_100000106738_100000040479 [1,0,0,0,0,1|2,0,0]=4 2780 B18R2.79 O=Cc1ccc(cc1)OCCOc2ccsc2 7a_100000106738_100000040479 [1,0,0,0,0,1|2,0,0]=4 2781 B18R2.79 O=Cc1ccc(cc1)OCCSc2ccoc2 62a_100000040479_100011215275 [1,0,0,0,0,1|2,0,0]=4 2782 B18R2.79 O=Cc1ccc(cc1)OCCSc2ccoc2 62a_100011215275_100000040479 [1,0,0,0,0,1|2,0,0]=4 2783 B18R2.79 O=Cc1ccc(cc1)OCCSc2ccsc2 62a_100000040479_100000738268 [1,0,0,0,0,1|2,0,0]=4 2784 B18R2.79 O=Cc1ccc(cc1)OCCSc2ccsc2 62a_100000738268_100000040479 [1,0,0,0,0,1|2,0,0]=4 2785 B18R2.79 O=Cc1ccc(cc1)OCCSc2cn[nH]c2 62a_100000040479_100000238712 [1,0,0,0,0,1|2,0,0]=4 2786 B18R2.79 O=Cc1ccc(cc1)OCCSc2cn[nH]c2 62a_100000238712_100000040479 [1,0,0,0,0,1|2,0,0]=4 2787 B18R2.79 O=Cc1ccc(cc1)OCCSc2cnco2 62a_100000040479_100020591547 [1,0,0,0,0,1|2,0,0]=4 2788 B18R2.79 O=Cc1ccc(cc1)OCCSc2cnco2 62a_100020591547_100000040479 [1,0,0,0,0,1|2,0,0]=4 2789 B18R2.79 O=Cc1ccc(cc1)OCCSc2cncs2 62a_100000040479_100011934649 [1,0,0,0,0,1|2,0,0]=4 2790 B18R2.79 O=Cc1ccc(cc1)OCCSc2cncs2 62a_100011934649_100000040479 [1,0,0,0,0,1|2,0,0]=4 2791 B18R2.79 O=Cc1ccc(cc1)OCCSc2cnoc2 62a_100000040479_100009815712 [1,0,0,0,0,1|2,0,0]=4 2792 B18R2.79 O=Cc1ccc(cc1)OCCSc2cnoc2 62a_100009815712_100000040479 [1,0,0,0,0,1|2,0,0]=4 2793 B18R2.79 O=Cc1ccc(cc1)OCCSc2cnsc2 62a_100000040479_100009815736 [1,0,0,0,0,1|2,0,0]=4 2794 B18R2.79 O=Cc1ccc(cc1)OCCSc2cnsc2 62a_100009815736_100000040479 [1,0,0,0,0,1|2,0,0]=4 2795 B18R2.79 O=Cc1ccc(cc1)SCCCn2cccc2 62a_100000188517_200009814367 [1,0,0,0,0,1|1,1,0]=4 2796 B18R2.79 O=Cc1ccc(cc1)SCCCn2cccc2 62a_200009814367_100000188517 [1,0,0,0,0,1|1,1,0]=4 2797 B18R2.79 O=Cc1ccc(cc1)SCCCn2ccnc2 62a_100000188517_100000756272 [1,0,0,0,0,1|0,1,0]=3 2798 B18R2.79 O=Cc1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000188517 [1,0,0,0,0,1|0,1,0]=3 2799 B18R2.79 O=Cc1ccc(cc1)SCCCn2cncn2 62a_100000188517_100102700105 [1,0,0,0,0,1|1,1,0]=4 2800 B18R2.79 O=Cc1ccc(cc1)SCCCn2cncn2 62a_100102700105_100000188517 [1,0,0,0,0,1|1,1,0]=4 2801 B18R2.79 O=Cc1ccc(cn1)SCCCn2ccnc2 62a_100000754260_100000756272 [1,0,0,0,0,1|1,1,0]=4 2802 B18R2.79 O=Cc1ccc(cn1)SCCCn2ccnc2 62a_100000756272_100000754260 [1,0,0,0,0,1|1,1,0]=4 2803 B18R2.79 O=Cc1ccc(nc1)SCCCn2ccnc2 62a_100000756272_100000766901 [1,0,0,0,0,1|1,1,0]=4 2804 B18R2.79 O=Cc1ccc(nc1)SCCCn2ccnc2 62a_100000766901_100000756272 [1,0,0,0,0,1|1,1,0]=4 2805 B18R2.79 OCc1ccc(cc1)CNCCn2ccnc2 207a_100000230061_100009832023 [1,0,0,0,0,1|1,0,1]=4 2806 B18R2.79 OCc1ccc(cc1)CNCCn2ccnc2 270004a_100000230061_100009832023 [1,0,0,0,0,1|1,0,1]=4 2807 B18R2.79 OCc1ccc(cc1)COCCn2cccc2 34a_100000179382_100000067286 [1,0,0,0,0,1|1,0,1]=4 2808 B18R2.79 OCc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000067286 [1,0,0,0,0,1|0,0,1]=3 2809 B18R2.79 OCc1ccc(cc1)COCCn2ccnn2 34a_100000080814_100000067286 [1,0,0,0,0,1|1,0,1]=4 2810 B18R2.79 OCc1ccc(cc1)COCCn2cncn2 34a_100000745309_100000067286 [1,0,0,0,0,1|1,0,1]=4 2811 B18R2.79 OCc1ccc(cc1)COCCn2cnnc2 34a_200011637517_100000067286 [1,0,0,0,0,1|1,0,1]=4 2812 B18R2.79 OCc1ccc(cc1)CSCCn2ccnc2 62a_100000067286_100000702546 [1,0,0,0,0,1|0,1,1]=4 2813 B18R2.79 OCc1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000067286 [1,0,0,0,0,1|0,1,1]=4 2814 B18R2.79 OCc1ccc(cc1)NCCCn2ccnc2 2230a_100011215238_100000756272 [1,0,0,0,0,1|1,0,1]=4 2815 B18R2.79 OCc1ccc(cc1)NCCCn2ccnc2 34a_100011215238_100000756272 [1,0,0,0,0,1|1,0,1]=4 2816 B18R2.79 OCc1ccc(cc1)OCCCn2cccc2 34a_100000211755_200009814367 [1,0,0,0,0,1|1,0,1]=4 2817 B18R2.79 OCc1ccc(cc1)OCCCn2ccnc2 34a_100000211755_100000756272 [1,0,0,0,0,1|0,0,1]=3 2818 B18R2.79 OCc1ccc(cc1)OCCCn2cncn2 34a_100000211755_100102700105 [1,0,0,0,0,1|1,0,1]=4 2819 B18R2.79 OCc1ccc(cc1)SCCCn2ccnc2 62a_100000690907_100000756272 [1,0,0,0,0,1|0,1,1]=4 2820 B18R2.79 OCc1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000690907 [1,0,0,0,0,1|0,1,1]=4 2821 B18R2.79 OCc1ccc(cn1)OCCCn2ccnc2 34a_103436540053_100000756272 [1,0,0,0,0,1|1,0,1]=4 2822 B18R2.7110 C=C(C)c1cccc(c1)OCCn2ccnc2 271570a_100000694244_100000240181 [0,0,0,0,1,1|2,0,0]=4 2823 B18R2.7110 CC(=O)c1cc(ccn1)SCCn2ccnc2 62a_100000702546_100000709912 [0,0,0,0,1,1|1,1,0]=4 2824 B18R2.7110 CC(=O)c1cc(ccn1)SCCn2ccnc2 62a_100000709912_100000702546 [0,0,0,0,1,1|1,1,0]=4 2825 B18R2.7110 CC(=O)c1cccc(c1)OCCn2cccc2 7a_100000211620_200000035178 [0,0,0,0,1,1|2,0,0]=4 2826 B18R2.7110 CC(=O)c1cccc(c1)OCCn2ccnc2 7a_100000211620_100000702546 [0,0,0,0,1,1|1,0,0]=3 2827 B18R2.7110 CC(=O)c1cccc(c1)OCCn2cncn2 34a_100000211620_200000749826 [0,0,0,0,1,1|2,0,0]=4 2828 B18R2.7110 CC(=O)c1cccc(c1)OCCn2cncn2 7a_100000211620_100000731791 [0,0,0,0,1,1|2,0,0]=4 2829 B18R2.7110 CC(=O)c1cccc(c1)SCCn2ccnc2 62a_100000210093_100000702546 [0,0,0,0,1,1|1,1,0]=4 2830 B18R2.7110 CC(=O)c1cccc(c1)SCCn2ccnc2 62a_100000702546_100000210093 [0,0,0,0,1,1|1,1,0]=4 2831 B18R2.7110 CC(=O)c1ccnc(c1)SCCn2ccnc2 62a_100000685609_100000702546 [0,0,0,0,1,1|1,1,0]=4 2832 B18R2.7110 CC(=O)c1ccnc(c1)SCCn2ccnc2 62a_100000702546_100000685609 [0,0,0,0,1,1|1,1,0]=4 2833 B18R2.7110 CC(=O)c1cncc(c1)SCCn2ccnc2 62a_100000702546_100011216243 [0,0,0,0,1,1|1,1,0]=4 2834 B18R2.7110 CC(=O)c1cncc(c1)SCCn2ccnc2 62a_100011216243_100000702546 [0,0,0,0,1,1|1,1,0]=4 2835 B18R2.7110 CC(O)c1cccc(c1)OCCn2ccnc2 7a_100000748013_100000702546 [0,0,0,0,1,1|1,0,1]=4 2836 B18R2.7110 NC(=O)c1cc(ccn1)NCCn2ccnc2 27a_100000230061_100000229564 [0,0,0,0,1,1|2,0,0]=4 2837 B18R2.7110 NC(=O)c1cc(ccn1)SCCn2ccnc2 62a_100000229564_100000702546 [0,0,0,0,1,1|1,1,0]=4 2838 B18R2.7110 NC(=O)c1cc(ccn1)SCCn2ccnc2 62a_100000702546_100000229564 [0,0,0,0,1,1|1,1,0]=4 2839 B18R2.7110 NC(=O)c1cccc(c1)OCCn2cccc2 7a_100000162170_200000035178 [0,0,0,0,1,1|2,0,0]=4 2840 B18R2.7110 NC(=O)c1cccc(c1)OCCn2ccnc2 7a_100000162170_100000702546 [0,0,0,0,1,1|1,0,0]=3 2841 B18R2.7110 NC(=O)c1cccc(c1)OCCn2cncn2 34a_100000162170_200000749826 [0,0,0,0,1,1|2,0,0]=4 2842 B18R2.7110 NC(=O)c1cccc(c1)OCCn2cncn2 7a_100000162170_100000731791 [0,0,0,0,1,1|2,0,0]=4 2843 B18R2.7110 NC(=O)c1cccc(c1)SCCn2ccnc2 62a_100000162208_100000702546 [0,0,0,0,1,1|1,1,0]=4 2844 B18R2.7110 NC(=O)c1cccc(c1)SCCn2ccnc2 62a_100000702546_100000162208 [0,0,0,0,1,1|1,1,0]=4 2845 B18R2.7110 NC(=O)c1ccnc(c1)SCCn2ccnc2 62a_100000229836_100000702546 [0,0,0,0,1,1|1,1,0]=4 2846 B18R2.7110 NC(=O)c1ccnc(c1)SCCn2ccnc2 62a_100000702546_100000229836 [0,0,0,0,1,1|1,1,0]=4 2847 B18R2.7110 NC(=O)c1cncc(c1)OCCn2cccc2 7a_100000698036_200000035178 [0,0,0,0,1,1|2,0,0]=4 2848 B18R2.7110 NC(=O)c1cncc(c1)OCCn2ccnc2 7a_100000698036_100000702546 [0,0,0,0,1,1|1,0,0]=3 2849 B18R2.7110 NC(=O)c1cncc(c1)OCCn2cncn2 7a_100000698036_100000731791 [0,0,0,0,1,1|2,0,0]=4 2850 B18R2.7110 NC(=O)c1cncc(c1)SCCn2ccnc2 62a_100000162242_100000702546 [0,0,0,0,1,1|1,1,0]=4 2851 B18R2.7110 NC(=O)c1cncc(c1)SCCn2ccnc2 62a_100000702546_100000162242 [0,0,0,0,1,1|1,1,0]=4 2852 B18R2.7110 NC(=S)c1cccc(c1)OCCn2ccnc2 7a_100000738086_100000702546 [0,0,0,0,1,1|1,1,0]=4 2853 B18R2.7110 O=[N+]([O-])c1cccc(c1)OCCn2ccnc2 7a_100000185994_100000702546 [0,0,0,0,1,1|1,0,1]=4 2854 B18R2.7110 O=[N+]([O-])c1cncc(c1)OCCn2ccnc2 7a_100009862860_100000702546 [0,0,0,0,1,1|1,0,1]=4 2855 B18R2.9892 CC(=O)Cc1ccc(cc1)OCn2cncn2 34a_100011218180_200020645497 [0,0,0,0,1,1|2,0,0]=4 2856 B18R2.9892 CC(=O)Cc1ccc(cc1)OCn2cncn2 7a_100011218180_200020645497 [0,0,0,0,1,1|2,0,0]=4 2857 B18R2.9892 CC(=O)Nc1ccc(cc1)OCn2cncn2 34a_100000184395_200020645497 [0,0,0,0,1,1|2,0,0]=4 2858 B18R2.9892 CC(=O)Nc1ccc(cc1)OCn2cncn2 7a_100000184395_200020645497 [0,0,0,0,1,1|2,0,0]=4 2859 B18R2.9892 NC(=O)Cc1ccc(cc1)OCn2cncn2 34a_100000020825_200020645497 [0,0,0,0,1,1|2,0,0]=4 2860 B20R2.10595 CC(=O)c1ccc(cc1)COCCc2cccnc2 34a_100011217484_100000756337 [0,0,0,0,0,2|2,0,0]=4 2861 B20R2.10595 CC(=O)c1ccc(cc1)COCCc2cccnc2 7a_100000082505_200011713674 [0,0,0,0,0,2|2,0,0]=4 2862 B20R2.10595 CC(=O)c1ccc(cc1)COCCc2ccncc2 34a_100011216225_100000756337 [0,0,0,0,0,2|2,0,0]=4 2863 B20R2.10595 CC(=O)c1ccc(cc1)COCCc2ccncc2 7a_100000082505_100000723409 [0,0,0,0,0,2|2,0,0]=4 2864 B20R2.10595 CC(=O)c1ccc(cc1)COCCc2cnccn2 34a_100011349526_100000756337 [0,0,0,0,0,2|2,0,0]=4 2865 B20R2.10595 CC(=O)c1ccc(cc1)COCCc2cncnc2 34a_100011709255_100000756337 [0,0,0,0,0,2|2,0,0]=4 2866 B20R2.10595 NC(=O)c1ccc(cc1)COCCc2cccnc2 34a_100011217484_100000231043 [0,0,0,0,0,2|2,0,0]=4 2867 B20R2.10595 NC(=O)c1ccc(cc1)COCCc2cccnc2 7a_100000162016_200011713674 [0,0,0,0,0,2|2,0,0]=4 2868 B20R2.10595 NC(=O)c1ccc(cc1)COCCc2ccncc2 34a_100011216225_100000231043 [0,0,0,0,0,2|2,0,0]=4 2869 B20R2.10595 NC(=O)c1ccc(cc1)COCCc2ccncc2 7a_100000162016_100000723409 [0,0,0,0,0,2|2,0,0]=4 2870 B20R2.10595 NC(=O)c1ccc(cc1)COCCc2cnccn2 34a_100011349526_100000231043 [0,0,0,0,0,2|2,0,0]=4 2871 B20R2.10595 NC(=O)c1ccc(cc1)COCCc2cncnc2 34a_100011709255_100000231043 [0,0,0,0,0,2|2,0,0]=4 2872 B20R2.10595 O=C(O)c1ccc(cc1)CCNCc2cccnc2 269956a_100000704756_100000733263 [0,0,0,0,0,2|2,0,0]=4 2873 B20R2.10595 O=C(O)c1ccc(cc1)CCNCc2ccncc2 269956a_100000704756_100015193705 [0,0,0,0,0,2|2,0,0]=4 2874 B20R2.10595 O=C(O)c1ccc(cc1)CCNCc2cnccn2 269956a_100000704756_100016995436 [0,0,0,0,0,2|2,0,0]=4 2875 B20R2.10595 O=C(O)c1ccc(cc1)CCNCc2cncnc2 269956a_100000704756_100016991940 [0,0,0,0,0,2|2,0,0]=4 2876 B20R2.10595 O=C(O)c1ccc(cc1)CNCCc2cccnc2 269956a_100000181780_200011713674 [0,0,0,0,0,2|2,0,0]=4 2877 B20R2.10595 O=C(O)c1ccc(cc1)CNCCc2ccncc2 269956a_100000181780_100000723409 [0,0,0,0,0,2|2,0,0]=4 2878 B20R2.17714 CC(=O)Cc1ccc(cc1)OCCc2cccnc2 7a_100011218180_200011713674 [0,0,0,0,0,2|2,0,0]=4 2879 B20R2.17714 CC(=O)Cc1ccc(cc1)OCCc2ccncc2 7a_100011218180_100000723409 [0,0,0,0,0,2|2,0,0]=4 2880 B20R2.17714 CC(=O)Nc1ccc(cc1)OCCc2cccnc2 7a_100000184395_200011713674 [0,0,0,0,0,2|2,0,0]=4 2881 B20R2.17714 CC(=O)Nc1ccc(cc1)OCCc2ccncc2 7a_100000184395_100000723409 [0,0,0,0,0,2|2,0,0]=4 2882 B20R2.10605 CC(=O)c1ccc(cc1)CCOCCn2cccc2 34a_100000179382_200000038727 [0,0,0,0,0,2|2,0,0]=4 2883 B20R2.10605 CC(=O)c1ccc(cc1)CCOCCn2ccnc2 34a_100000719764_200000038727 [0,0,0,0,0,2|1,0,0]=3 2884 B20R2.10605 CC(=O)c1ccc(cc1)CCOCCn2ccnn2 34a_100000080814_200000038727 [0,0,0,0,0,2|2,0,0]=4 2885 B20R2.10605 CC(=O)c1ccc(cc1)CCOCCn2cncn2 34a_100000745309_200000038727 [0,0,0,0,0,2|2,0,0]=4 2886 B20R2.10605 CC(=O)c1ccc(cc1)CCOCCn2cnnc2 34a_200011637517_200000038727 [0,0,0,0,0,2|2,0,0]=4 2887 B20R2.10605 CC(=O)c1ccc(cc1)CCSCCn2ccnc2 62a_100000702546_200000038727 [0,0,0,0,0,2|1,1,0]=4 2888 B20R2.10605 CC(=O)c1ccc(cc1)CCSCCn2ccnc2 62a_200000038727_100000702546 [0,0,0,0,0,2|1,1,0]=4 2889 B20R2.10605 CC(=O)c1ccc(cc1)COCCCn2cccc2 34a_100000179399_100000756337 [0,0,0,0,0,2|2,0,0]=4 2890 B20R2.10605 CC(=O)c1ccc(cc1)COCCCn2cccc2 7a_100000082505_200009814367 [0,0,0,0,0,2|2,0,0]=4 2891 B20R2.10605 CC(=O)c1ccc(cc1)COCCCn2cccc2 7a_100000179399_100000756337 [0,0,0,0,0,2|2,0,0]=4 2892 B20R2.10605 CC(=O)c1ccc(cc1)COCCCn2ccnc2 34a_100000240236_100000756337 [0,0,0,0,0,2|1,0,0]=3 2893 B20R2.10605 CC(=O)c1ccc(cc1)COCCCn2ccnc2 7a_100000082505_100000756272 [0,0,0,0,0,2|1,0,0]=3 2894 B20R2.10605 CC(=O)c1ccc(cc1)COCCCn2cncn2 34a_100011305697_100000756337 [0,0,0,0,0,2|2,0,0]=4 2895 B20R2.10605 CC(=O)c1ccc(cc1)COCCCn2cncn2 7a_100000082505_100102700105 [0,0,0,0,0,2|2,0,0]=4 2896 B20R2.10605 CC(=O)c1ccc(cc1)COCCCn2cnnc2 34a_100011637516_100000756337 [0,0,0,0,0,2|2,0,0]=4 2897 B20R2.10605 CC(=O)c1ccc(cc1)CSCCCn2ccnc2 62a_100000756272_100000756337 [0,0,0,0,0,2|1,1,0]=4 2898 B20R2.10605 CC(=O)c1ccc(cc1)CSCCCn2ccnc2 62a_100000756337_100000756272 [0,0,0,0,0,2|1,1,0]=4 2899 B20R2.10605 NC(=O)c1ccc(cc1)CNCCCn2ccnc2 207a_100000210438_100000038677 [0,0,0,0,0,2|2,0,0]=4 2900 B20R2.10605 NC(=O)c1ccc(cc1)CNCCCn2ccnc2 270004a_100000210438_100000038677 [0,0,0,0,0,2|2,0,0]=4 2901 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2cccc2 34a_100000162016_200009814367 [0,0,0,0,0,2|2,0,0]=4 2902 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2cccc2 34a_100000179399_100000231043 [0,0,0,0,0,2|2,0,0]=4 2903 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2cccc2 7a_100000162016_200009814367 [0,0,0,0,0,2|2,0,0]=4 2904 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2cccc2 7a_100000179399_100000231043 [0,0,0,0,0,2|2,0,0]=4 2905 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2ccnc2 34a_100000162016_100000756272 [0,0,0,0,0,2|1,0,0]=3 2906 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2ccnc2 34a_100000240236_100000231043 [0,0,0,0,0,2|1,0,0]=3 2907 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2ccnc2 7a_100000162016_100000756272 [0,0,0,0,0,2|1,0,0]=3 2908 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2cncn2 34a_100000162016_100102700105 [0,0,0,0,0,2|2,0,0]=4 2909 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2cncn2 34a_100011305697_100000231043 [0,0,0,0,0,2|2,0,0]=4 2910 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2cncn2 7a_100000162016_100102700105 [0,0,0,0,0,2|2,0,0]=4 2911 B20R2.10605 NC(=O)c1ccc(cc1)COCCCn2cnnc2 34a_100011637516_100000231043 [0,0,0,0,0,2|2,0,0]=4 2912 B20R2.10605 NC(=O)c1ccc(cc1)CSCCCn2ccnc2 62a_100000231043_100000756272 [0,0,0,0,0,2|1,1,0]=4 2913 B20R2.10605 NC(=O)c1ccc(cc1)CSCCCn2ccnc2 62a_100000756272_100000231043 [0,0,0,0,0,2|1,1,0]=4 2914 B20R2.10605 O=C(O)c1ccc(cc1)CCNCCn2cccc2 269956a_100000704756_200000035178 [0,0,0,0,0,2|2,0,0]=4 2915 B20R2.10605 O=C(O)c1ccc(cc1)CCNCCn2ccnc2 269956a_100000704756_100000702546 [0,0,0,0,0,2|1,0,0]=3 2916 B20R2.10605 O=C(O)c1ccc(cc1)CCNCCn2cncn2 269956a_100000704756_100000731791 [0,0,0,0,0,2|2,0,0]=4 2917 B20R2.10605 O=C(O)c1ccc(cc1)CNCCCn2cccc2 269956a_100000181780_200009814367 [0,0,0,0,0,2|2,0,0]=4 2918 B20R2.10605 O=C(O)c1ccc(cc1)CNCCCn2ccnc2 269956a_100000181780_100000756272 [0,0,0,0,0,2|1,0,0]=3 2919 B20R2.10605 O=C(O)c1ccc(cc1)CNCCCn2cncn2 269956a_100000181780_100102700105 [0,0,0,0,0,2|2,0,0]=4 2920 B20R2.10605 O=C(O)c1ccc(cc1)OCCNCc2ccn[nH]2 269956a_100015187144_100000728653 [0,0,0,0,0,2|2,0,0]=4 2921 B20R2.10605 O=C(O)c1ccc(cc1)OCCNCc2ccsc2 269956a_100015187144_100011261437 [0,0,0,0,0,2|2,0,0]=4 2922 B20R2.10605 O=C(O)c1ccc(cc1)OCCNCc2cncs2 269956a_100015187144_100015185245 [0,0,0,0,0,2|2,0,0]=4 2923 B20R2.10605 O=C(O)c1ccc(cc1)OCCNCn2cncn2 269956a_100015187144_200020645497 [0,0,0,0,0,2|1,0,0]=3 2924 B20R2.10605 O=C(O)c1ccc(cn1)CNCCCn2ccnc2 269956a_100000762669_100000756272 [0,0,0,0,0,2|2,0,0]=4 2925 B20R2.10605 O=[N+]([O-])c1ccc(cc1)CCOCCn2ccnc2 34a_100000719764_100000736421 [0,0,0,0,0,2|1,0,1]=4 2926 B20R2.10605 O=[N+]([O-])c1ccc(cc1)CCOCCn2ccnc2 7a_100000704122_100000702546 [0,0,0,0,0,2|1,0,1]=4 2927 B20R2.10605 O=[N+]([O-])c1ccc(cc1)COCCCn2ccnc2 34a_100000211695_100000756272 [0,0,0,0,0,2|1,0,1]=4 2928 B20R2.10605 O=[N+]([O-])c1ccc(cc1)COCCCn2ccnc2 34a_100000240236_100000181861 [0,0,0,0,0,2|1,0,1]=4 2929 B20R2.10605 OB(O)c1ccc(cc1)COCCCn2ccnc2 34a_100000240236_100009813762 [0,0,0,0,0,2|1,0,1]=4 2930 B20R2.17721 CC(=O)Cc1ccc(cc1)OCCCn2cccc2 34a_100011218180_200009814367 [0,0,0,0,0,2|2,0,0]=4 2931 B20R2.17721 CC(=O)Cc1ccc(cc1)OCCCn2cccc2 7a_100011218180_200009814367 [0,0,0,0,0,2|2,0,0]=4 2932 B20R2.17721 CC(=O)Cc1ccc(cc1)OCCCn2ccnc2 34a_100011218180_100000756272 [0,0,0,0,0,2|1,0,0]=3 2933 B20R2.17721 CC(=O)Cc1ccc(cc1)OCCCn2ccnc2 7a_100011218180_100000756272 [0,0,0,0,0,2|1,0,0]=3 2934 B20R2.17721 CC(=O)Cc1ccc(cc1)OCCCn2cncn2 34a_100011218180_100102700105 [0,0,0,0,0,2|2,0,0]=4 2935 B20R2.17721 CC(=O)Cc1ccc(cc1)OCCCn2cncn2 7a_100011218180_100102700105 [0,0,0,0,0,2|2,0,0]=4 2936 B20R2.17721 CC(=O)Cc1ccc(cc1)SCCCn2ccnc2 62a_100000691760_100000756272 [0,0,0,0,0,2|1,1,0]=4 2937 B20R2.17721 CC(=O)Cc1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000691760 [0,0,0,0,0,2|1,1,0]=4 2938 B20R2.17721 CC(=O)Nc1ccc(cc1)CNCCn2ccnc2 207a_100000230061_100000210072 [0,0,0,0,0,2|2,0,0]=4 2939 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2cccc2 34a_100000179382_100000731167 [0,0,0,0,0,2|2,0,0]=4 2940 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2cccc2 7a_100000246270_200000035178 [0,0,0,0,0,2|2,0,0]=4 2941 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2ccnc2 34a_100000719764_100000731167 [0,0,0,0,0,2|1,0,0]=3 2942 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2ccnc2 7a_100000246270_100000702546 [0,0,0,0,0,2|1,0,0]=3 2943 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2ccnn2 34a_100000080814_100000731167 [0,0,0,0,0,2|2,0,0]=4 2944 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2cncn2 34a_100000246270_200000749826 [0,0,0,0,0,2|2,0,0]=4 2945 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2cncn2 34a_100000745309_100000731167 [0,0,0,0,0,2|2,0,0]=4 2946 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2cncn2 7a_100000246270_100000731791 [0,0,0,0,0,2|2,0,0]=4 2947 B20R2.17721 CC(=O)Nc1ccc(cc1)COCCn2cnnc2 34a_200011637517_100000731167 [0,0,0,0,0,2|2,0,0]=4 2948 B20R2.17721 CC(=O)Nc1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000731167 [0,0,0,0,0,2|1,1,0]=4 2949 B20R2.17721 CC(=O)Nc1ccc(cc1)NCCCn2ccnc2 34a_100000184111_100000756272 [0,0,0,0,0,2|2,0,0]=4 2950 B20R2.17721 CC(=O)Nc1ccc(cc1)OCCCn2cccc2 34a_100000184395_200009814367 [0,0,0,0,0,2|2,0,0]=4 2951 B20R2.17721 CC(=O)Nc1ccc(cc1)OCCCn2cccc2 7a_100000184395_200009814367 [0,0,0,0,0,2|2,0,0]=4 2952 B20R2.17721 CC(=O)Nc1ccc(cc1)OCCCn2ccnc2 34a_100000184395_100000756272 [0,0,0,0,0,2|1,0,0]=3 2953 B20R2.17721 CC(=O)Nc1ccc(cc1)OCCCn2ccnc2 7a_100000184395_100000756272 [0,0,0,0,0,2|1,0,0]=3 2954 B20R2.17721 CC(=O)Nc1ccc(cc1)OCCCn2cncn2 34a_100000184395_100102700105 [0,0,0,0,0,2|2,0,0]=4 2955 B20R2.17721 CC(=O)Nc1ccc(cc1)OCCCn2cncn2 7a_100000184395_100102700105 [0,0,0,0,0,2|2,0,0]=4 2956 B20R2.17721 CC(=O)Nc1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000155215 [0,0,0,0,0,2|1,1,0]=4 2957 B20R2.17721 CC(=O)Nc1ccc(cn1)OCCCn2ccnc2 34a_200000094647_100000756272 [0,0,0,0,0,2|2,0,0]=4 2958 B20R2.17721 CC(=O)Nc1ccc(cn1)OCCCn2ccnc2 7a_200000094647_100000756272 [0,0,0,0,0,2|2,0,0]=4 2959 B20R2.17721 CC(=O)Oc1ccc(cc1)CNCCn2ccnc2 207a_100000230061_100000014718 [0,0,0,0,0,2|2,0,0]=4 2960 B20R2.17721 CC(=O)Oc1ccc(cc1)CNCCn2ccnc2 270004a_100000230061_100000014718 [0,0,0,0,0,2|2,0,0]=4 2961 B20R2.17721 CC(=O)Oc1ccc(cc1)CSCCn2ccnc2 62a_100000702546_100000033664 [0,0,0,0,0,2|1,1,0]=4 2962 B20R2.17721 CC(=O)Oc1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000002173 [0,0,0,0,0,2|1,1,0]=4 2963 B20R2.17721 CC(=O)Sc1ccc(cc1)SCCCn2ccnc2 62a_200009995050_100000756272 [0,0,0,0,0,2|1,1,0]=4 2964 B20R2.17721 NC(=O)Cc1ccc(cc1)NCCCn2ccnc2 2230a_100000738315_100000756272 [0,0,0,0,0,2|2,0,0]=4 2965 B20R2.17721 NC(=O)Cc1ccc(cc1)NCCCn2ccnc2 34a_100000738315_100000756272 [0,0,0,0,0,2|2,0,0]=4 2966 B20R2.17721 NC(=O)Cc1ccc(cc1)OCCCn2cccc2 34a_100000020825_200009814367 [0,0,0,0,0,2|2,0,0]=4 2967 B20R2.17721 NC(=O)Cc1ccc(cc1)OCCCn2ccnc2 34a_100000020825_100000756272 [0,0,0,0,0,2|1,0,0]=3 2968 B20R2.17721 NC(=O)Cc1ccc(cc1)OCCCn2cncn2 34a_100000020825_100102700105 [0,0,0,0,0,2|2,0,0]=4 2969 B20R2.17721 NC(=O)Cc1ccc(cc1)SCCCn2ccnc2 62a_100000162331_100000756272 [0,0,0,0,0,2|1,1,0]=4 2970 B20R2.17721 NC(=O)Cc1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000162331 [0,0,0,0,0,2|1,1,0]=4 2971 B20R2.17721 NC(=O)Nc1ccc(cc1)SCCCn2ccnc2 62a_100000756272_100000198584 [0,0,0,0,0,2|1,1,0]=4 2972 B20R2.17721 O=C(O)Cc1ccc(cc1)CNCCn2cccc2 269956a_100016989728_200000035178 [0,0,0,0,0,2|2,0,0]=4 2973 B20R2.17721 O=C(O)Cc1ccc(cc1)CNCCn2ccnc2 269956a_100016989728_100000702546 [0,0,0,0,0,2|1,0,0]=3 2974 B20R2.17721 O=C(O)Cc1ccc(cc1)CNCCn2cncn2 269956a_100016989728_100000731791 [0,0,0,0,0,2|2,0,0]=4 2975 B20R2.10651 C=C(C)CSc1ccc(cc1)OCCn2ccnc2 62a_100000748629_100015186965 [0,0,0,0,0,2|2,0,0]=4 2976 B20R2.10651 C=C(C)CSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100000211660 [0,0,0,0,0,2|2,0,0]=4 2977 B20R2.10651 C=C(F)CSc1ccc(cc1)OCCn2ccnc2 62a_100000042424_100015186965 [0,0,0,0,0,2|2,0,0]=4 2978 B20R2.10651 C=C(F)CSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100000042424 [0,0,0,0,0,2|2,0,0]=4 2979 B20R2.10651 CC(=O)/C=C/c1ccc(cc1)OCCn2cncn2 34a_100000189429_200000749826 [0,0,0,0,0,2|2,0,0]=4 2980 B20R2.10651 CC(=O)/C=C/c1ccc(cc1)SCCn2ccnc2 62a_100000702546_200016259395 [0,0,0,0,0,2|1,1,0]=4 2981 B20R2.10651 CC(=O)/C=C/c1ccc(cc1)SCCn2ccnc2 62a_200016259395_100000702546 [0,0,0,0,0,2|1,1,0]=4 2982 B20R2.10651 CC(=O)CCc1ccc(cc1)OCCn2cccc2 7a_100000198047_200000035178 [0,0,0,0,0,2|2,0,0]=4 2983 B20R2.10651 CC(=O)CCc1ccc(cc1)OCCn2ccnc2 7a_100000198047_100000702546 [0,0,0,0,0,2|1,0,0]=3 2984 B20R2.10651 CC(=O)CCc1ccc(cc1)OCCn2cncn2 34a_100000198047_200000749826 [0,0,0,0,0,2|2,0,0]=4 2985 B20R2.10651 CC(=O)CCc1ccc(cc1)OCCn2cncn2 7a_100000198047_100000731791 [0,0,0,0,0,2|2,0,0]=4 2986 B20R2.10651 CC(=O)CCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000723691 [0,0,0,0,0,2|1,1,0]=4 2987 B20R2.10651 CC(=O)CCc1ccc(cc1)SCCn2ccnc2 62a_100000723691_100000702546 [0,0,0,0,0,2|1,1,0]=4 2988 B20R2.10651 CC(=O)NCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_200000685173 [0,0,0,0,0,2|1,1,0]=4 2989 B20R2.10651 CC(=O)NCc1ccc(cc1)SCCn2ccnc2 62a_200000685173_100000702546 [0,0,0,0,0,2|1,1,0]=4 2990 B20R2.10651 CC(=O)NNc1ccc(cc1)SCCn2ccnc2 62a_100000702546_200009815283 [0,0,0,0,0,2|1,1,0]=4 2991 B20R2.10651 CC(=O)NNc1ccc(cc1)SCCn2ccnc2 62a_200009815283_100000702546 [0,0,0,0,0,2|1,1,0]=4 2992 B20R2.10651 CC(O)C=Cc1ccc(cc1)OCCn2ccnc2 271570a_200011019289_100015186965 [0,0,0,0,0,2|1,0,1]=4 2993 B20R2.10651 CC(O)CCc1ccc(cc1)OCCn2ccnc2 7a_100000189425_100000702546 [0,0,0,0,0,2|1,0,1]=4 2994 B20R2.10651 CC(O)CSc1ccc(cc1)OCCn2ccnc2 62a_100011218427_100015186965 [0,0,0,0,0,2|1,0,1]=4 2995 B20R2.10651 CC(O)CSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100011218427 [0,0,0,0,0,2|1,0,1]=4 2996 B20R2.10651 C[C@@H](O)CSc1ccc(cc1)OCCn2ccnc2 62a_100009817552_100015186965 [0,0,0,0,0,2|1,0,1]=4 2997 B20R2.10651 C[C@@H](O)CSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100009817552 [0,0,0,0,0,2|1,0,1]=4 2998 B20R2.10651 NC(=O)CCc1ccc(cc1)SCCn2ccnc2 62a_100000702546_200010110666 [0,0,0,0,0,2|1,1,0]=4 2999 B20R2.10651 NC(=O)CCc1ccc(cc1)SCCn2ccnc2 62a_200010110666_100000702546 [0,0,0,0,0,2|1,1,0]=4 3000 B20R2.10651 NC(=O)CSc1ccc(cc1)OCCn2ccnc2 62a_100000747473_100015186965 [0,0,0,0,0,2|1,0,0]=3 3001 B20R2.10651 NC(=O)CSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100000747473 [0,0,0,0,0,2|1,0,0]=3 3002 B20R2.10651 NC(=O)CSc1ccc(cc1)SCCn2ccnc2 62a_100000149456_100000702546 [0,0,0,0,0,2|1,1,0]=4 3003 B20R2.10651 NC(=O)CSc1ccc(cc1)SCCn2ccnc2 62a_100000702546_100000149456 [0,0,0,0,0,2|1,1,0]=4 3004 B20R2.10651 O=C([O-])CSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100020667443 [0,0,0,0,0,2|0,0,1]=3 3005 B20R2.10651 O=C([O-])CSc1ccc(cc1)OCCn2ccnc2 62a_100020667443_100015186965 [0,0,0,0,0,2|0,0,1]=3 3006 B20R2.10651 O=[N+]([O-])CSc1ccc(cc1)OCCn2ccnc2 62a_100015186965_100000761209 [0,0,0,0,0,2|1,0,1]=4