0 B39R4.3987717247 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3)Cc4ccccc4)C)C 11a_100000211868_100015188237 [0,0,0,0,0,0|1,0,0]=1 1 B39R4.3987717247 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3)Cc4ccccc4)C)C 1626a_100000211868_100015188237 [0,0,0,0,0,0|1,0,0]=1 2 B39R4.3987717247 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3)Cc4ccccc4)C)C 240690a_100000211868_100015188237 [0,0,0,0,0,0|1,0,0]=1 3 B38R3.1008875082 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 2230a_100000186914_100102596886 [0,0,1,0,0,0|0,0,0]=1 4 B38R3.1008875082 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 269982a_100000186914_100102596886 [0,0,1,0,0,0|0,0,0]=1 5 B38R3.1008875082 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccn3 2230a_100000201164_100102596886 [0,0,1,0,0,0|1,0,0]=2 6 B38R3.1008875082 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccn3 269982a_100000201164_100102596886 [0,0,1,0,0,0|1,0,0]=2 7 B38R3.1008875082 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccnc3 2230a_100000186920_100102596886 [0,0,1,0,0,0|1,0,0]=2 8 B38R3.1008875082 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccnc3 269982a_100000186920_100102596886 [0,0,1,0,0,0|1,0,0]=2 9 B38R3.1008875082 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccncc3 2230a_100000186919_100102596886 [0,0,1,0,0,0|1,0,0]=2 10 B38R3.1008875082 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccncc3 269982a_100000186919_100102596886 [0,0,1,0,0,0|1,0,0]=2 11 B38R3.1008875194 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCN(C)Cc3ccccc3)C)C 11a_100000205149_100015188237 [0,0,1,0,0,0|1,0,0]=2 12 B38R3.1008875194 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCN(C)Cc3ccccc3)C)C 240690a_100000205149_100015188237 [0,0,1,0,0,0|1,0,0]=2 13 B38R3.1008875194 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(C)Cc3ccccn3)C)C 2230a_100000238496_100102596886 [0,0,1,0,0,0|3,0,0]=4 14 B38R3.1008875194 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(C)Cc3cccnc3)C)C 2230a_100011207255_100102596886 [0,0,1,0,0,0|3,0,0]=4 15 B38R3.1008875194 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC(C)Cc3ccccc3)C)C 34a_100000748627_100102596886 [0,0,1,0,0,0|2,0,0]=3 16 B38R3.1008875194 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC(C)Cc3ccccc3)C)C 7a_100000748627_100102596886 [0,0,1,0,0,0|2,0,0]=3 17 B38R3.4091312780 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H](CO)COCc3ccccc3)C)C 240690a_100016995297_100015188237 [0,0,1,0,0,0|3,0,0]=4 18 B38R4.1114422430 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(C3)Oc4ccccc4)C)C 1626a_200015184049_100015188237 [0,0,0,0,1,0|3,0,0]=4 19 B38R4.1114422430 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(C3)Oc4ccccc4)C)C 240690a_200015184049_100015188237 [0,0,0,0,1,0|3,0,0]=4 20 B38R4.5138921198 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CN(C3)Cc4ccccc4)C)C 11a_100011919438_100015188237 [0,0,0,0,1,0|1,0,0]=2 21 B38R4.5138921198 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CN(C3)Cc4ccccc4)C)C 240690a_100011919438_100015188237 [0,0,0,0,1,0|1,0,0]=2 22 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCN(C)Cc3ccccc3)C)C 240690a_100000744458_100015188237 [1,0,1,0,0,0|1,0,0]=3 23 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccccc3)C)C 2230a_100000186898_100102596886 [1,0,1,0,0,0|0,0,0]=2 24 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccccc3)C)C 269982a_100000186898_100102596886 [1,0,1,0,0,0|0,0,0]=2 25 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccccn3)C)C 2230a_100000207498_100102596886 [1,0,1,0,0,0|1,0,0]=3 26 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccccn3)C)C 269982a_100000207498_100102596886 [1,0,1,0,0,0|1,0,0]=3 27 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3cccnc3)C)C 2230a_100000184577_100102596886 [1,0,1,0,0,0|1,0,0]=3 28 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3cccnc3)C)C 269982a_100000184577_100102596886 [1,0,1,0,0,0|1,0,0]=3 29 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccncc3)C)C 2230a_100000187231_100102596886 [1,0,1,0,0,0|1,0,0]=3 30 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccncc3)C)C 269982a_100000187231_100102596886 [1,0,1,0,0,0|1,0,0]=3 31 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)CCCCOCc3ccccc3)C)C 1458a_100015188237_100011219843 [1,0,1,0,0,0|2,0,0]=4 32 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCCCc3ccccc3)C)C 11a_100000750932_100015188237 [1,0,1,0,0,0|2,0,0]=4 33 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCCCc3ccccc3)C)C 1626a_100000750932_100015188237 [1,0,1,0,0,0|2,0,0]=4 34 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCCCc3ccccc3)C)C 240690a_100000750932_100015188237 [1,0,1,0,0,0|2,0,0]=4 35 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCOCc3ccccc3)C)C 11a_200000206031_100015188237 [1,0,1,0,0,0|2,0,0]=4 36 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCOCc3ccccc3)C)C 1626a_200000206031_100015188237 [1,0,1,0,0,0|2,0,0]=4 37 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCOCc3ccccc3)C)C 240690a_200000206031_100015188237 [1,0,1,0,0,0|2,0,0]=4 38 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNCCc3ccccc3)C)C 2230a_100000106460_100102596886 [1,0,1,0,0,0|2,0,0]=4 39 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNCCc3ccccc3)C)C 34a_100000106460_100102596886 [1,0,1,0,0,0|2,0,0]=4 40 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOCCc3ccccc3)C)C 34a_100000210268_100102596886 [1,0,1,0,0,0|2,0,0]=4 41 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOCCc3ccccc3)C)C 7a_100000210268_100102596886 [1,0,1,0,0,0|2,0,0]=4 42 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCSCCc3ccccc3)C)C 62a_100102596886_100011218657 [1,0,1,0,0,0|2,0,0]=4 43 B37R3.4763563314 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)CC(C)COCc3ccccc3)C)C 1458a_100015188237_100011216253 [1,0,1,0,0,0|2,0,0]=4 44 B39R4.979215809 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)C3CCN(C3=O)Cc4ccccc4)C)C 1458a_100015188237_100011875758 [0,1,0,0,1,0|0,0,1]=3 45 B39R4.3987677904 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CC(=O)N(C3)c4ccccc4)C)C 11a_100000718269_100015188237 [0,1,0,0,1,0|1,0,1]=4 46 B39R4.3987677904 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CC(=O)N(C3)c4ccccc4)C)C 1626a_100000718269_100015188237 [0,1,0,0,1,0|1,0,1]=4 47 B39R4.3987677904 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CC(=O)N(C3)c4ccccc4)C)C 240690a_100000718269_100015188237 [0,1,0,0,1,0|1,0,1]=4 48 B39R4.3987717242 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3=O)c4ccccc4)C)C 11a_200000754093_100015188237 [0,1,0,0,1,0|1,0,1]=4 49 B39R4.3987717242 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3=O)c4ccccc4)C)C 1626a_200000754093_100015188237 [0,1,0,0,1,0|1,0,1]=4 50 B39R4.3987717242 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3=O)c4ccccc4)C)C 240690a_200000754093_100015188237 [0,1,0,0,1,0|1,0,1]=4 51 B39R4.979215662 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(CC3)Cc4ccccc4)C)C 11a_100000210444_100015188237 [0,0,1,1,0,0|2,0,0]=4 52 B39R4.979215662 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(CC3)Cc4ccccc4)C)C 1626a_100000210444_100015188237 [0,0,1,1,0,0|2,0,0]=4 53 B39R4.979215662 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(CC3)Cc4ccccc4)C)C 240690a_100000210444_100015188237 [0,0,1,1,0,0|2,0,0]=4 54 B39R4.979215662 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCN(CC3)Cc4ccccn4)C)C 11a_100000229886_100015188237 [0,0,1,1,0,0|2,0,0]=4 55 B39R4.979215662 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCN(CC3)Cc4ccccn4)C)C 240690a_100000229886_100015188237 [0,0,1,1,0,0|2,0,0]=4 56 B39R4.979215662 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCN(CC3)Cc4cccnc4)C)C 11a_100000241969_100015188237 [0,0,1,1,0,0|2,0,0]=4 57 B39R4.979215662 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCN(CC3)Cc4cccnc4)C)C 240690a_100000241969_100015188237 [0,0,1,1,0,0|2,0,0]=4 58 B39R4.979215662 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCN(CC3)Cc4ccncc4)C)C 240690a_100000195410_100015188237 [0,0,1,1,0,0|2,0,0]=4 59 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCN3CCc4ccccc4C3)C)C 11a_100000246800_100015188237 [0,0,1,1,0,0|1,0,0]=3 60 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCN3CCc4ccccc4C3)C)C 1626a_100000246800_100015188237 [0,0,1,1,0,0|1,0,0]=3 61 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCN3CCc4ccccc4C3)C)C 240690a_100000246800_100015188237 [0,0,1,1,0,0|1,0,0]=3 62 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ccccc4C3)C)C 2230a_100000188457_100102596886 [0,0,1,1,0,0|0,0,0]=2 63 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ccccc4C3)C)C 269982a_100000188457_100102596886 [0,0,1,1,0,0|0,0,0]=2 64 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ccccc4C3)C)C 34a_100000188457_100102596886 [0,0,1,1,0,0|0,0,0]=2 65 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4cccnc4C3)C)C 2230a_100015206102_100102596886 [0,0,1,1,0,0|1,0,0]=3 66 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4cccnc4C3)C)C 269982a_100015206102_100102596886 [0,0,1,1,0,0|1,0,0]=3 67 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ccncc4C3)C)C 2230a_100015190008_100102596886 [0,0,1,1,0,0|1,0,0]=3 68 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ccncc4C3)C)C 269982a_100015190008_100102596886 [0,0,1,1,0,0|1,0,0]=3 69 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4cnccc4C3)C)C 2230a_100020645890_100102596886 [0,0,1,1,0,0|1,0,0]=3 70 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4cnccc4C3)C)C 269982a_100020645890_100102596886 [0,0,1,1,0,0|1,0,0]=3 71 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ncccc4C3)C)C 2230a_100000699647_100102596886 [0,0,1,1,0,0|1,0,0]=3 72 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ncccc4C3)C)C 269982a_100000699647_100102596886 [0,0,1,1,0,0|1,0,0]=3 73 B39R4.3987677270 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCC3c4ccccc4)C)C 2230a_100000739605_100102596886 [0,0,1,1,0,0|0,0,0]=2 74 B39R4.3987677270 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCC3c4ccccc4)C)C 269982a_100000739605_100102596886 [0,0,1,1,0,0|0,0,0]=2 75 B39R4.3987717192 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN3Cc4ccccc4)C)C 240690a_100000048058_100015188237 [0,0,1,1,0,0|1,0,0]=3 76 B39R4.979215695 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCCC(C3)Cc4ccccc4)C)C 11a_100000752525_100015188237 [0,0,1,1,0,0|2,0,0]=4 77 B39R4.979215695 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCCC(C3)Cc4ccccc4)C)C 1626a_100000752525_100015188237 [0,0,1,1,0,0|2,0,0]=4 78 B39R4.979215695 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCCC(C3)Cc4ccccc4)C)C 240690a_100000752525_100015188237 [0,0,1,1,0,0|2,0,0]=4 79 B39R4.3987677276 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC3Cc4ccccc4C3)C)C 2230a_100000753258_100102596886 [0,0,1,1,0,0|2,0,0]=4 80 B39R4.3987677276 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC3Cc4ccccc4C3)C)C 34a_100000753258_100102596886 [0,0,1,1,0,0|2,0,0]=4 81 B39R4.3987677276 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC3Cc4ccccc4C3)C)C 34a_100011215286_100102596886 [0,0,1,1,0,0|2,0,0]=4 82 B39R4.3987677277 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN[C@H]3C[C@@H]3c4ccccc4)C)C 2230a_100020588832_100102596886 [0,0,1,1,0,0|2,0,0]=4 83 B39R4.3987677277 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN[C@H]3C[C@@H]3c4ccccc4)C)C 34a_100020588832_100102596886 [0,0,1,1,0,0|2,0,0]=4 84 B39R4.3987677284 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3C[C@@H]3Cc4ccccc4)C)C 2230a_100016998360_100102596886 [0,0,1,1,0,0|2,0,0]=4 85 B39R4.3987677284 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3C[C@@H]3Cc4ccccc4)C)C 269982a_100016998360_100102596886 [0,0,1,1,0,0|2,0,0]=4 86 B39R4.3987677284 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3C[C@@H]3Cc4ccccc4)C)C 34a_100016998360_100102596886 [0,0,1,1,0,0|2,0,0]=4 87 B39R4.979230647 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCC(CC3)c4ccccc4)C)C 11a_100000737527_100015188237 [0,0,1,1,0,0|2,0,0]=4 88 B39R4.979230647 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCC(CC3)c4ccccc4)C)C 1626a_100000737527_100015188237 [0,0,1,1,0,0|2,0,0]=4 89 B39R4.979230647 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCC(CC3)c4ccccc4)C)C 240690a_100000737527_100015188237 [0,0,1,1,0,0|2,0,0]=4 90 B39R4.3987677474 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H]3C[C@@H](C3)OCc4ccccc4)C)C 11a_100015959148_100015188237 [0,0,1,1,0,0|2,0,0]=4 91 B39R4.3987677474 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H]3C[C@@H](C3)OCc4ccccc4)C)C 1626a_100015959148_100015188237 [0,0,1,1,0,0|2,0,0]=4 92 B39R4.3987677474 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H]3C[C@@H](C3)OCc4ccccc4)C)C 240690a_100015959148_100015188237 [0,0,1,1,0,0|2,0,0]=4 93 B37R3.1140056465 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)c3ccccc3 2230a_100000210013_100102596886 [0,0,1,0,1,0|0,0,0]=2 94 B37R3.1140056465 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)c3ccccc3 269982a_100000210013_100102596886 [0,0,1,0,1,0|0,0,0]=2 95 B37R3.1140056465 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)c3ccccc3 34a_100000210013_100102596886 [0,0,1,0,1,0|0,0,0]=2 96 B37R3.4763567927 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccco3 2230a_100000739255_100102596886 [0,0,1,0,1,0|1,0,0]=3 97 B37R3.4763567927 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccco3 269982a_100000739255_100102596886 [0,0,1,0,1,0|1,0,0]=3 98 B37R3.4763567927 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccs3 2230a_100025770963_100102596886 [0,0,1,0,1,0|1,0,0]=3 99 B37R3.4763567927 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccs3 269982a_100025770963_100102596886 [0,0,1,0,1,0|1,0,0]=3 100 B37R3.1140056572 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCN(C)c3ccccc3)C)C 11a_100000211881_100015188237 [0,0,1,0,1,0|1,0,0]=3 101 B37R3.1140056572 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCN(C)c3ccccc3)C)C 240690a_100000211881_100015188237 [0,0,1,0,1,0|1,0,0]=3 102 B37R3.1140056572 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN[C@H](C)c3ccccc3)C)C 2230a_100000751104_100102596886 [0,0,1,0,1,0|2,0,0]=4 103 B37R3.1140056572 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCO[C@H](C)c3ccccc3)C)C 34a_100000761318_100102596886 [0,0,1,0,1,0|2,0,0]=4 104 B37R3.1140056572 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCO[C@H](C)c3ccccc3)C)C 7a_100000761318_100102596886 [0,0,1,0,1,0|2,0,0]=4 105 B37R3.4763516438 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)CCCCc3ccccc3)C)C 11a_100000741445_100015188237 [0,0,1,0,1,0|2,0,0]=4 106 B37R3.4763516438 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)CCCCc3ccccc3)C)C 1626a_100000741445_100015188237 [0,0,1,0,1,0|2,0,0]=4 107 B37R3.4763516438 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)CCCCc3ccccc3)C)C 240690a_100000741445_100015188237 [0,0,1,0,1,0|2,0,0]=4 108 B37R3.4763516438 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)CCOCc3ccccc3)C)C 11a_100000687121_100015188237 [0,0,1,0,1,0|2,0,0]=4 109 B37R3.4763516438 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)CCOCc3ccccc3)C)C 1626a_100000687121_100015188237 [0,0,1,0,1,0|2,0,0]=4 110 B37R3.4763516438 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)CCOCc3ccccc3)C)C 240690a_100000687121_100015188237 [0,0,1,0,1,0|2,0,0]=4 111 B37R4.999589329 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(C3)c4ccccc4)C)C 11a_100000747531_100015188237 [0,0,0,0,2,0|2,0,0]=4 112 B37R4.999589329 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(C3)c4ccccc4)C)C 1626a_100000747531_100015188237 [0,0,0,0,2,0|2,0,0]=4 113 B37R4.999589329 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(C3)c4ccccc4)C)C 240690a_100000747531_100015188237 [0,0,0,0,2,0|2,0,0]=4 114 B37R4.1968323553 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H]3C[C@H](C3)c4ccccc4)C)C 11a_102125402554_100015188237 [0,0,0,0,2,0|2,0,0]=4 115 B37R4.1968323553 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H]3C[C@H](C3)c4ccccc4)C)C 1626a_102125402554_100015188237 [0,0,0,0,2,0|2,0,0]=4 116 B39R4.3987717169 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)C[C@H]3CCCN3Cc4ccccc4)C)C 1458a_100015188237_100015185826 [0,0,0,0,1,1|1,0,0]=3 117 B39R4.979215827 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(C3)OCc4ccccc4)C)C 11a_100011290789_100015188237 [0,0,0,0,1,1|2,0,0]=4 118 B39R4.979215827 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(C3)OCc4ccccc4)C)C 1626a_100011290789_100015188237 [0,0,0,0,1,1|2,0,0]=4 119 B39R4.979215827 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N3CCC(C3)OCc4ccccc4)C)C 240690a_100011290789_100015188237 [0,0,0,0,1,1|2,0,0]=4 120 B39R4.3987717165 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccco4)C)C 1626a_100015184725_100015188237 [0,0,0,0,1,1|2,0,0]=4 121 B39R4.3987717165 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccco4)C)C 240690a_100015184725_100015188237 [0,0,0,0,1,1|2,0,0]=4