0 B15R1.12378 C#CC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000211873_100000718062 [1,0,0,0,0,0|1,0,2]=4 1 B15R1.12378 C=CC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000185746_100000718062 [1,0,0,0,0,0|1,0,2]=4 2 B15R1.12378 CCC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000210414_100000718062 [1,0,0,0,0,0|1,0,0]=2 3 B15R1.12378 CCN(C)CCn1c(cnc1C)[N+](=O)[O-] 2230a_100000225621_100000718062 [1,0,0,0,0,0|2,0,0]=3 4 B15R1.12378 CCN(C)CCn1c(cnc1C)[N+](=O)[O-] 269982a_100000225621_100000718062 [1,0,0,0,0,0|2,0,0]=3 5 B15R1.12378 Cc1ncc(n1CCC(=O)CO)[N+](=O)[O-] 1458a_100000210174_100000718062 [1,0,0,0,0,0|2,0,0]=3 6 B17R1.13153 CCC(C)(C)NCCn1c(cnc1C)[N+](=O)[O-] 2230a_100000211385_100000718062 [0,0,0,0,0,1|3,0,0]=4 7 B17R1.13153 CCC(C)(C)OCCn1c(cnc1C)[N+](=O)[O-] 7a_100000182250_100000210677 [0,0,0,0,0,1|3,0,0]=4 8 B17R1.13153 CCC(C)(C)OCCn1c(cnc1C)[N+](=O)[O-] 7a_100000210230_100000718062 [0,0,0,0,0,1|3,0,0]=4 9 B17R1.13153 CCC(C)(C)SCCn1c(cnc1C)[N+](=O)[O-] 62a_100000032637_100000718062 [0,0,0,0,0,1|3,0,0]=4 10 B17R1.13153 CCS(=O)(=O)NCCn1c(cnc1C)[N+](=O)[O-] 270084a_100015368576_100000211323 [0,0,0,0,0,1|0,0,0]=1 11 B17R1.13153 CCS(=O)(=O)NCCn1c(cnc1C)[N+](=O)[O-] 274078a_100015368576_100000211323 [0,0,0,0,0,1|0,0,0]=1 12 B17R1.13153 CCS(=O)(=O)NCCn1c(cnc1C)[N+](=O)[O-] 40a_100015368576_100000053943 [0,0,0,0,0,1|0,0,0]=1 13 B17R1.13153 Cc1ncc(n1CCNS(=O)(=O)CCl)[N+](=O)[O-] 270084a_100015368576_100000031410 [0,0,0,0,0,1|1,0,0]=2 14 B17R1.13153 Cc1ncc(n1CCNS(=O)(=O)CCl)[N+](=O)[O-] 274078a_100015368576_100000031410 [0,0,0,0,0,1|1,0,0]=2 15 B14R1.4447 CC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000070787_100000718062 [2,0,0,0,0,0|1,0,0]=3 16 B14R1.4447 Cc1ncc(n1CCN(C)C)[N+](=O)[O-] 2230a_100102631434_100000718062 [2,0,0,0,0,0|2,0,0]=4 17 B14R1.4447 Cc1ncc(n1CCN(C)C)[N+](=O)[O-] 269982a_100102631434_100000718062 [2,0,0,0,0,0|2,0,0]=4 18 B14R1.3372 CCNCCn1c(cnc1C)[N+](=O)[O-] 2230a_100015525214_100000718062 [2,0,0,0,0,0|1,0,0]=3 19 B14R1.3372 CCOCCn1c(cnc1C)[N+](=O)[O-] 7a_100000182250_100000210202 [2,0,0,0,0,0|0,1,0]=3 20 B14R1.3372 CCSCCn1c(cnc1C)[N+](=O)[O-] 62a_100000210202_100000718062 [2,0,0,0,0,0|0,0,1]=3 21 B14R1.3372 Cc1ncc(n1CCOCF)[N+](=O)[O-] 7a_100000182250_100015361967 [2,0,0,0,0,0|1,1,0]=4 22 B14R1.3372 Cc1ncc(n1CCSCF)[N+](=O)[O-] 62a_100015361967_100000718062 [2,0,0,0,0,0|1,0,1]=4 23 B16R1.39665 C=C(C)C(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000185857_100000718062 [1,1,0,0,0,0|1,0,1]=4 24 B16R1.39665 Cc1ncc(n1CCC(=O)C(C)C)[N+](=O)[O-] 1458a_100000210198_100000718062 [1,1,0,0,0,0|1,0,0]=3 25 B16R1.39665 Cc1ncc(n1CCC(=O)C(C)F)[N+](=O)[O-] 1458a_100000062450_100000718062 [1,1,0,0,0,0|1,0,0]=3 26 B16R1.39665 Cc1ncc(n1CCC(=O)C(O)O)[N+](=O)[O-] 1458a_100000233687_100000718062 [1,1,0,0,0,0|2,0,0]=4 27 B16R1.39665 Cc1ncc(n1CCC(=O)[C@@H](C)O)[N+](=O)[O-] 1458a_100000717761_100000718062 [1,1,0,0,0,0|1,0,0]=3 28 B16R1.39665 Cc1ncc(n1CCC(=O)[C@H](C)O)[N+](=O)[O-] 1458a_217856618621_100000718062 [1,1,0,0,0,0|1,0,0]=3 29 B16R1.39665 Cc1ncc(n1CCN(C)C(C)C)[N+](=O)[O-] 269982a_200000211004_100000718062 [1,1,0,0,0,0|2,0,0]=4 30 B16R1.64450 C#CCC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100011220946_100000718062 [1,1,0,0,0,0|1,0,1]=4 31 B16R1.64450 C=CCC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000210193_100000718062 [1,1,0,0,0,0|1,0,1]=4 32 B16R1.64450 CC#CC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000763181_100000718062 [1,1,0,0,0,0|1,0,1]=4 33 B16R1.64450 CC=CC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000210699_100000718062 [1,1,0,0,0,0|1,0,1]=4 34 B16R1.64450 CCCC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000211992_100000718062 [1,1,0,0,0,0|1,0,0]=3 35 B16R1.64450 CCCN(C)CCn1c(cnc1C)[N+](=O)[O-] 2230a_100000747261_100000718062 [1,1,0,0,0,0|2,0,0]=4 36 B16R1.64450 CCCN(C)CCn1c(cnc1C)[N+](=O)[O-] 269982a_100000747261_100000718062 [1,1,0,0,0,0|2,0,0]=4 37 B16R1.64450 COCC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000210968_100000718062 [1,1,0,0,0,0|1,0,0]=3 38 B16R1.64450 CSCC(=O)CCn1c(cnc1C)[N+](=O)[O-] 1458a_100000184570_100000718062 [1,1,0,0,0,0|1,0,0]=3 39 B16R1.64450 Cc1ncc(n1CCC(=O)CC#N)[N+](=O)[O-] 1458a_100051588842_100000718062 [1,1,0,0,0,0|1,0,1]=4 40 B16R1.64450 Cc1ncc(n1CCC(=O)CCO)[N+](=O)[O-] 1458a_100011216618_100000718062 [1,1,0,0,0,0|1,0,0]=3 41 B16R1.64450 Cc1ncc(n1CCN(C)CCO)[N+](=O)[O-] 2230a_100000210263_100000718062 [1,1,0,0,0,0|2,0,0]=4 42 B16R1.64450 Cc1ncc(n1CCN(C)CCO)[N+](=O)[O-] 269982a_100000210263_100000718062 [1,1,0,0,0,0|2,0,0]=4 43 B16R1.66685 CCN(CC)CCn1c(cnc1C)[N+](=O)[O-] 2230a_100000724800_100000718062 [1,1,0,0,0,0|2,0,0]=4 44 B16R1.66685 CCN(CC)CCn1c(cnc1C)[N+](=O)[O-] 269956a_100000042499_100000718062 [1,1,0,0,0,0|2,0,0]=4 45 B16R1.66685 CCN(CC)CCn1c(cnc1C)[N+](=O)[O-] 269982a_100000724800_100000718062 [1,1,0,0,0,0|2,0,0]=4 46 B18R1.50679 C=CCS(=O)(=O)NCCn1c(cnc1C)[N+](=O)[O-] 270084a_100015368576_100000751117 [0,1,0,0,0,1|0,0,1]=3 47 B18R1.50679 C=CCS(=O)(=O)NCCn1c(cnc1C)[N+](=O)[O-] 274078a_100015368576_100000751117 [0,1,0,0,0,1|0,0,1]=3 48 B18R1.50679 CCCS(=O)(=O)NCCn1c(cnc1C)[N+](=O)[O-] 270084a_100015368576_100000211391 [0,1,0,0,0,1|0,0,0]=2 49 B18R1.50679 CCCS(=O)(=O)NCCn1c(cnc1C)[N+](=O)[O-] 274078a_100015368576_100000211391 [0,1,0,0,0,1|0,0,0]=2 50 B18R1.50679 CCCS(=O)(=O)NCCn1c(cnc1C)[N+](=O)[O-] 40a_100015368576_100000054278 [0,1,0,0,0,1|0,0,0]=2 51 B18R1.50679 Cc1ncc(n1CCNS(=O)(=O)CCBr)[N+](=O)[O-] 270084a_100015368576_100000731045 [0,1,0,0,0,1|0,0,0]=2 52 B18R1.50679 Cc1ncc(n1CCNS(=O)(=O)CCBr)[N+](=O)[O-] 274078a_100015368576_100000731045 [0,1,0,0,0,1|0,0,0]=2 53 B18R1.50679 Cc1ncc(n1CCNS(=O)(=O)CCCl)[N+](=O)[O-] 270084a_100015368576_100000184613 [0,1,0,0,0,1|0,0,0]=2 54 B18R1.50679 Cc1ncc(n1CCNS(=O)(=O)CCCl)[N+](=O)[O-] 274078a_100015368576_100000184613 [0,1,0,0,0,1|0,0,0]=2 55 B18R1.101522 Cc1ncc(n1CCNS(=O)(=O)C(C)C)[N+](=O)[O-] 270084a_100015368576_100000742656 [0,1,0,0,0,1|0,0,0]=2 56 B18R1.101522 Cc1ncc(n1CCNS(=O)(=O)C(C)C)[N+](=O)[O-] 274078a_100015368576_100000742656 [0,1,0,0,0,1|0,0,0]=2 57 B18R1.101522 Cc1ncc(n1CCNS(=O)(=O)C(Cl)Cl)[N+](=O)[O-] 270084a_100015368576_100000034607 [0,1,0,0,0,1|1,0,0]=3 58 B18R1.101522 Cc1ncc(n1CCNS(=O)(=O)C(F)F)[N+](=O)[O-] 270084a_100015368576_100000737280 [0,1,0,0,0,1|1,0,0]=3 59 B18R1.101522 Cc1ncc(n1CCNS(=O)(=O)C(F)F)[N+](=O)[O-] 274078a_100015368576_100000737280 [0,1,0,0,0,1|1,0,0]=3 60 B18R1.153619 CCS(=O)(=O)NC(=O)Cn1c(cnc1C)[N+](=O)[O-] 2740a_100000171174_200000019284 [0,1,0,0,0,1|0,0,1]=3 61 B16R2.83069 Cc1ncc(n1CCN2CCC2)[N+](=O)[O-] 269982a_100000754969_100000718062 [1,0,0,1,0,0|2,0,0]=4 62 B14R1.10175 CCC(=O)Cn1c(cnc1C)[N+](=O)[O-] 1458a_200000019284_100000210202 [1,0,0,0,1,0|1,0,0]=3 63 B14R1.10175 CNC(=O)Cn1c(cnc1C)[N+](=O)[O-] 11a_106832991635_200000019284 [1,0,0,0,1,0|2,0,0]=4 64 B14R1.10175 CNC(=O)Cn1c(cnc1C)[N+](=O)[O-] 1626a_100102657272_200000019284 [1,0,0,0,1,0|2,0,0]=4 65 B14R1.10175 CNC(=O)Cn1c(cnc1C)[N+](=O)[O-] 240690a_100102657272_200000019284 [1,0,0,0,1,0|2,0,0]=4 66 B14R1.10175 Cc1ncc(n1CC(=O)CF)[N+](=O)[O-] 1458a_200000019284_100015361967 [1,0,0,0,1,0|2,0,0]=4 67 B16R1.7375 Cc1ncc(n1CCNS(=O)(=O)C)[N+](=O)[O-] 40a_100015368576_100000738038 [1,0,0,0,0,1|0,0,0]=2 68 B16R1.10362 CCS(=O)(=O)NCCn1ccnc1[N+](=O)[O-] 270084a_100160468890_100000211323 [1,0,0,0,0,1|2,0,0]=4 69 B16R1.10362 CCS(=O)(=O)NCCn1ccnc1[N+](=O)[O-] 274078a_100160468890_100000211323 [1,0,0,0,0,1|2,0,0]=4 70 B16R1.10362 CCS(=O)(=O)NCCn1ccnc1[N+](=O)[O-] 40a_100160468890_100000053943 [1,0,0,0,0,1|2,0,0]=4 71 B16R1.16712 CCC(=O)NCCn1c(cnc1C)[N+](=O)[O-] 240690a_100015368576_100000210414 [1,0,0,0,0,1|1,0,0]=3 72 B16R1.16712 CCC(=O)NCCn1c(cnc1C)[N+](=O)[O-] 527a_100015368576_100000210414 [1,0,0,0,0,1|1,0,0]=3 73 B16R1.16712 CCC(C)NCCn1c(cnc1C)[N+](=O)[O-] 2230a_100000209981_100000718062 [1,0,0,0,0,1|2,0,0]=4 74 B16R1.16712 CCC(C)OCCn1c(cnc1C)[N+](=O)[O-] 7a_100000182250_100000758301 [1,0,0,0,0,1|2,0,0]=4 75 B16R1.16712 CCC(C)OCCn1c(cnc1C)[N+](=O)[O-] 7a_100000210228_100000718062 [1,0,0,0,0,1|2,0,0]=4 76 B16R1.16712 CCC(C)SCCn1c(cnc1C)[N+](=O)[O-] 62a_100000758301_100000718062 [1,0,0,0,0,1|2,0,0]=4 77 B16R1.16712 CNC(=O)NCCn1c(cnc1C)[N+](=O)[O-] 273464a_100015368576_100102657272 [1,0,0,0,0,1|2,0,0]=4 78 B16R1.16712 CNC(=O)NCCn1c(cnc1C)[N+](=O)[O-] 273464a_100102657272_100015368576 [1,0,0,0,0,1|2,0,0]=4 79 B16R1.16712 CNC(=O)NCCn1c(cnc1C)[N+](=O)[O-] 512a_100015368576_100102657272 [1,0,0,0,0,1|2,0,0]=4 80 B16R1.16712 CNC(=O)NCCn1c(cnc1C)[N+](=O)[O-] 512a_106832991638_100015368576 [1,0,0,0,0,1|2,0,0]=4 81 B16R1.16712 Cc1ncc(n1CCNC(=O)CO)[N+](=O)[O-] 240690a_100015368576_100000210174 [1,0,0,0,0,1|2,0,0]=4 82 B16R1.16712 Cc1ncc(n1CCNC(=O)CO)[N+](=O)[O-] 527a_100015368576_100000210174 [1,0,0,0,0,1|2,0,0]=4 83 B18R1.16034 CCS(=O)(=O)CCNc1cc(ccc1C)[N+](=O)[O-] 34a_100000184112_100000756660 [0,0,0,0,0,2|2,0,0]=4 84 B18R1.16034 CCS(=O)(=O)CCNc1cc(ccc1C)[N+](=O)[O-] 7a_100000184112_100000756660 [0,0,0,0,0,2|2,0,0]=4 85 B18R1.16034 CCS(=O)(=O)CCOc1cc(ccc1C)[N+](=O)[O-] 34a_100000740739_100000756660 [0,0,0,0,0,2|2,0,0]=4 86 B18R1.16034 CCS(=O)(=O)CCOc1cc(ccc1C)[N+](=O)[O-] 7a_100000740739_100000756660 [0,0,0,0,0,2|2,0,0]=4 87 B18R1.16034 CCS(=O)(=O)CCOc1cc(cnc1Cl)[N+](=O)[O-] 34a_200010746660_100000756660 [0,0,0,0,0,2|2,0,0]=4 88 B18R1.16034 CCS(=O)(=O)CCOc1cc(cnc1Cl)[N+](=O)[O-] 7a_200010746660_100000756660 [0,0,0,0,0,2|2,0,0]=4 89 B18R1.16034 CCS(=O)(=O)CCOc1cc(cnc1N)[N+](=O)[O-] 34a_100009863383_100000756660 [0,0,0,0,0,2|2,0,0]=4 90 B18R1.16034 CCS(=O)(=O)CCOc1cc(cnc1N)[N+](=O)[O-] 7a_100009863383_100000756660 [0,0,0,0,0,2|2,0,0]=4 91 B18R1.16035 CCS(=O)(=O)CCOc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_100000756660 [0,0,0,0,0,2|2,0,0]=4 92 B18R1.16035 CCS(=O)(=O)CCOc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_100000756660 [0,0,0,0,0,2|2,0,0]=4 93 B18R1.16059 CCS(=O)(=O)CCOc1c(cccc1[N+](=O)[O-])C 34a_100000763257_100000756660 [0,0,0,0,0,2|2,0,0]=4 94 B18R1.16059 CCS(=O)(=O)CCOc1c(cccc1[N+](=O)[O-])C 7a_100000763257_100000756660 [0,0,0,0,0,2|2,0,0]=4 95 B18R1.16059 CCS(=O)(=O)CCOc1c(ccnc1C)[N+](=O)[O-] 34a_200000144590_100000756660 [0,0,0,0,0,2|1,0,0]=3 96 B18R1.16059 CCS(=O)(=O)CCOc1c(ccnc1C)[N+](=O)[O-] 7a_200000144590_100000756660 [0,0,0,0,0,2|1,0,0]=3 97 B18R1.16059 CCS(=O)(=O)CCOc1c(ccnc1Cl)[N+](=O)[O-] 34a_100009852515_100000756660 [0,0,0,0,0,2|2,0,0]=4 98 B18R1.16059 CCS(=O)(=O)CCOc1c(ccnc1Cl)[N+](=O)[O-] 7a_100009852515_100000756660 [0,0,0,0,0,2|2,0,0]=4 99 B18R1.16059 CCS(=O)(=O)CCOc1c(ccnc1[N+](=O)[O-])C 7a_100009875811_100000756660 [0,0,0,0,0,2|2,0,0]=4