0 B40R4.3967040421 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)C3CCN(C3)Cc4ccccc4)C)C 11a_100000231129_100015188237 [0,1,0,0,0,0|1,0,0]=2 1 B40R4.3967040421 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)C3CCN(C3)Cc4ccccc4)C)C 1626a_100000231129_100015188237 [0,1,0,0,0,0|1,0,0]=2 2 B40R4.3967040421 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)C3CCN(C3)Cc4ccccc4)C)C 240690a_100000231129_100015188237 [0,1,0,0,0,0|1,0,0]=2 3 B40R4.3967040547 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3)Cc4cccc(c4)C)C)C 11a_100025772311_100015188237 [0,1,0,0,0,0|1,0,0]=2 4 B40R4.3967040547 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3)Cc4cccc(c4)C)C)C 1626a_100025772311_100015188237 [0,1,0,0,0,0|1,0,0]=2 5 B40R4.3967040547 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(C3)Cc4cccc(c4)C)C)C 240690a_100025772311_100015188237 [0,1,0,0,0,0|1,0,0]=2 6 B40R4.5929987523 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@@H]3CN(C[C@H]3F)Cc4ccccc4)C)C 11a_106629247684_100015188237 [0,1,0,0,0,0|1,0,0]=2 7 B40R4.5929987523 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@@H]3CN(C[C@H]3F)Cc4ccccc4)C)C 240690a_106629247684_100015188237 [0,1,0,0,0,0|1,0,0]=2 8 B40R4.5930048729 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CC(=O)N(C3)Cc4ccccc4)C)C 11a_100000740609_100015188237 [0,1,0,0,0,0|1,0,1]=3 9 B40R4.5930048729 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CC(=O)N(C3)Cc4ccccc4)C)C 1626a_100000740609_100015188237 [0,1,0,0,0,0|1,0,1]=3 10 B40R4.5930048729 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CC(=O)N(C3)Cc4ccccc4)C)C 240690a_100000740609_100015188237 [0,1,0,0,0,0|1,0,1]=3 11 B38R3.1008875194 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCSC(C)Cc3ccccc3)C)C 62a_100102596886_200011218536 [0,0,1,0,0,0|2,0,0]=3 12 B40R4.3967040443 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)CC3CCN(CC3)Cc4ccccc4)C)C 1458a_100015188237_200015183350 [0,0,0,0,0,1|1,0,0]=2 13 B40R4.3967040443 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4)C)C 11a_100000180093_100015188237 [0,0,0,0,0,1|1,0,0]=2 14 B40R4.3967040443 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4)C)C 1626a_100000180093_100015188237 [0,0,0,0,0,1|1,0,0]=2 15 B40R4.3967040443 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4)C)C 240690a_100000180093_100015188237 [0,0,0,0,0,1|1,0,0]=2 16 B40R4.3967040443 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccnc4)C)C 11a_100000755617_100015188237 [0,0,0,0,0,1|2,0,0]=3 17 B40R4.3967040443 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccnc4)C)C 240690a_100000755617_100015188237 [0,0,0,0,0,1|2,0,0]=3 18 B40R4.3967040476 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)CC3CCCN(C3)Cc4ccccc4)C)C 1458a_100015188237_100015183850 [0,0,0,0,0,1|1,0,0]=2 19 B40R4.3967040476 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)CC3CN(CCO3)Cc4ccccc4)C)C 1458a_100015188237_100000185197 [0,0,0,0,0,1|1,0,0]=2 20 B40R4.3967040476 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccccc4)C)C 1626a_100000765084_100015188237 [0,0,0,0,0,1|1,0,0]=2 21 B40R4.3967040476 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccccc4)C)C 240690a_100000765084_100015188237 [0,0,0,0,0,1|1,0,0]=2 22 B40R4.3967040476 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4cccnc4)C)C 11a_100015183100_100015188237 [0,0,0,0,0,1|2,0,0]=3 23 B40R4.3967040476 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4cccnc4)C)C 240690a_100015183100_100015188237 [0,0,0,0,0,1|2,0,0]=3 24 B40R4.3967045574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN(C3)Cc4ccccc4)C)C 1626a_100000749532_100015188237 [0,0,0,0,0,1|1,0,0]=2 25 B40R4.3967045574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN(C3)Cc4ccccc4)C)C 240690a_100000749532_100015188237 [0,0,0,0,0,1|1,0,0]=2 26 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3cnccn3)C)C 2230a_100011269079_100102596886 [1,0,1,0,0,0|2,0,0]=4 27 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3cnccn3)C)C 269982a_100011269079_100102596886 [1,0,1,0,0,0|2,0,0]=4 28 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ncccn3)C)C 2230a_100025716638_100102596886 [1,0,1,0,0,0|2,0,0]=4 29 B37R3.1140056574 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ncccn3)C)C 269982a_100025716638_100102596886 [1,0,1,0,0,0|2,0,0]=4 30 B37R3.1140056594 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)CCCCCCc3ccccc3)C)C 1458a_100015188237_100011218729 [1,0,1,0,0,0|2,0,0]=4 31 B39R3.719094420 C#CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 2230a_100000730907_100102596886 [0,1,1,0,0,0|0,0,1]=3 32 B39R3.719094420 C#CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 269982a_100000730907_100102596886 [0,1,1,0,0,0|0,0,1]=3 33 B39R3.719094420 C#CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 34a_100000730907_100102596886 [0,1,1,0,0,0|0,0,1]=3 34 B39R3.719094420 C=CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 2230a_100000196212_100102596886 [0,1,1,0,0,0|0,0,1]=3 35 B39R3.719094420 C=CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 269982a_100000196212_100102596886 [0,1,1,0,0,0|0,0,1]=3 36 B39R3.719094420 C=CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccnc3 2230a_100000201331_100102596886 [0,1,1,0,0,0|1,0,1]=4 37 B39R3.719094420 C=CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccnc3 269982a_100000201331_100102596886 [0,1,1,0,0,0|1,0,1]=4 38 B39R3.719094420 C=CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccncc3 2230a_100000201359_100102596886 [0,1,1,0,0,0|1,0,1]=4 39 B39R3.719094420 C=CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccncc3 269982a_100000201359_100102596886 [0,1,1,0,0,0|1,0,1]=4 40 B39R3.719094420 CCCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 2230a_100000184400_100102596886 [0,1,1,0,0,0|0,0,0]=2 41 B39R3.719094420 CCCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 269982a_100000184400_100102596886 [0,1,1,0,0,0|0,0,0]=2 42 B39R3.719094420 CCCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccn3 2230a_100160999930_100102596886 [0,1,1,0,0,0|1,0,0]=3 43 B39R3.719094420 CCCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccn3 269982a_100160999930_100102596886 [0,1,1,0,0,0|1,0,0]=3 44 B39R3.719094420 CCCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccnc3 2230a_100160553015_100102596886 [0,1,1,0,0,0|1,0,0]=3 45 B39R3.719094420 CCCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccnc3 269982a_100160553015_100102596886 [0,1,1,0,0,0|1,0,0]=3 46 B39R3.719094420 CCCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccncc3 269982a_100160551226_100102596886 [0,1,1,0,0,0|1,0,0]=3 47 B39R3.719094420 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(CC#N)Cc3ccccc3)C)C 2230a_100000743013_100102596886 [0,1,1,0,0,0|0,0,1]=3 48 B39R3.719094420 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(CCO)Cc3ccccc3)C)C 2230a_100000180844_100102596886 [0,1,1,0,0,0|0,0,0]=2 49 B39R3.719094420 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(CCO)Cc3ccccc3)C)C 269982a_100000180844_100102596886 [0,1,1,0,0,0|0,0,0]=2 50 B39R3.719094420 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(CCO)Cc3cccnc3)C)C 2230a_200000200437_100102596886 [0,1,1,0,0,0|1,0,0]=3 51 B39R3.719094420 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(CCO)Cc3cccnc3)C)C 269982a_200000200437_100102596886 [0,1,1,0,0,0|1,0,0]=3 52 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3C 2230a_100000201206_100102596886 [0,1,1,0,0,0|0,0,0]=2 53 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3C 269982a_100000201206_100102596886 [0,1,1,0,0,0|0,0,0]=2 54 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3Cl 2230a_100000201176_100102596886 [0,1,1,0,0,0|0,0,0]=2 55 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3Cl 269982a_100000201176_100102596886 [0,1,1,0,0,0|0,0,0]=2 56 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3F 2230a_100015186831_100102596886 [0,1,1,0,0,0|0,0,0]=2 57 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3F 269982a_100015186831_100102596886 [0,1,1,0,0,0|0,0,0]=2 58 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3F 34a_100015186831_100102596886 [0,1,1,0,0,0|0,0,0]=2 59 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3O 2230a_100011223546_100102596886 [0,1,1,0,0,0|0,0,0]=2 60 B39R3.900054632 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3O 269982a_100011223546_100102596886 [0,1,1,0,0,0|0,0,0]=2 61 B39R3.1842179737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(Cc3ccccc3)C(C)C)C)C 2230a_100000068392_100102596886 [0,1,1,0,0,0|0,0,0]=2 62 B39R3.1842179737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(Cc3ccccc3)C(C)C)C)C 269982a_100000068392_100102596886 [0,1,1,0,0,0|0,0,0]=2 63 B39R3.1842179737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(Cc3ccccn3)C(C)C)C)C 2230a_100000200191_100102596886 [0,1,1,0,0,0|1,0,0]=3 64 B39R3.1842179737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(Cc3ccccn3)C(C)C)C)C 269982a_100000200191_100102596886 [0,1,1,0,0,0|1,0,0]=3 65 B39R3.1842179737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(Cc3cccnc3)C(C)C)C)C 2230a_100000200193_100102596886 [0,1,1,0,0,0|1,0,0]=3 66 B39R3.1842179737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(Cc3cccnc3)C(C)C)C)C 269982a_100000200193_100102596886 [0,1,1,0,0,0|1,0,0]=3 67 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)Br 2230a_100000187385_100102596886 [0,1,1,0,0,0|0,0,0]=2 68 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)Br 269982a_100000187385_100102596886 [0,1,1,0,0,0|0,0,0]=2 69 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)C 2230a_100000180869_100102596886 [0,1,1,0,0,0|0,0,0]=2 70 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)C 269982a_100000180869_100102596886 [0,1,1,0,0,0|0,0,0]=2 71 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)Cl 2230a_100000180830_100102596886 [0,1,1,0,0,0|0,0,0]=2 72 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)Cl 269982a_100000180830_100102596886 [0,1,1,0,0,0|0,0,0]=2 73 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)F 2230a_100015183324_100102596886 [0,1,1,0,0,0|0,0,0]=2 74 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)F 269982a_100015183324_100102596886 [0,1,1,0,0,0|0,0,0]=2 75 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)F 34a_100015183324_100102596886 [0,1,1,0,0,0|0,0,0]=2 76 B39R3.1842222907 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccc(cc3)O 269982a_100000748449_100102596886 [0,1,1,0,0,0|0,0,0]=2 77 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)Br 2230a_100000187426_100102596886 [0,1,1,0,0,0|0,0,0]=2 78 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)Br 269982a_100000187426_100102596886 [0,1,1,0,0,0|0,0,0]=2 79 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)C 2230a_102516607250_100102596886 [0,1,1,0,0,0|0,0,0]=2 80 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)C 269982a_102516607250_100102596886 [0,1,1,0,0,0|0,0,0]=2 81 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)Cl 2230a_100000201194_100102596886 [0,1,1,0,0,0|0,0,0]=2 82 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)Cl 269982a_100000201194_100102596886 [0,1,1,0,0,0|0,0,0]=2 83 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)F 2230a_100000195558_100102596886 [0,1,1,0,0,0|0,0,0]=2 84 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)F 269982a_100000195558_100102596886 [0,1,1,0,0,0|0,0,0]=2 85 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)F 34a_100000195558_100102596886 [0,1,1,0,0,0|0,0,0]=2 86 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)O 2230a_100000201218_100102596886 [0,1,1,0,0,0|0,0,0]=2 87 B39R3.1842222909 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3cccc(c3)O 269982a_100000201218_100102596886 [0,1,1,0,0,0|0,0,0]=2 88 B39R3.900054566 CCC(Cc1ccccc1)OCCOC(=O)C2=C(NC(=C(C2c3cccc(c3)[N+](=O)[O-])C(=O)OC)C)C 7a_100000760156_100102596886 [0,1,1,0,0,0|2,0,0]=4 89 B39R3.900054566 CCN(CCCNC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 1626a_200011249954_100015188237 [0,1,1,0,0,0|1,0,0]=3 90 B39R3.900054566 CCN(CCCNC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)Cc3ccccc3 240690a_200011249954_100015188237 [0,1,1,0,0,0|1,0,0]=3 91 B39R3.900054566 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(CO)Cc3ccccc3)C)C 2230a_100000739027_100102596886 [0,1,1,0,0,0|2,0,0]=4 92 B39R3.900054566 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC(CN)Cc3ccccc3)C)C 34a_100000752270_100102596886 [0,1,1,0,0,0|2,0,0]=4 93 B39R3.900054566 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCO[C@H](CCl)Cc3ccccc3)C)C 7a_100000729385_100102596886 [0,1,1,0,0,0|2,0,0]=4 94 B39R3.900054834 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(C)Cc3ccc(cc3)O)C)C 2230a_100102634573_100102596886 [0,1,1,0,0,0|2,0,0]=4 95 B39R3.900054834 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(C)Cc3ccc(cc3)O)C)C 34a_100102634573_100102596886 [0,1,1,0,0,0|2,0,0]=4 96 B39R3.900054834 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC(C)Cc3ccc(cc3)F)C)C 34a_100011351027_100102596886 [0,1,1,0,0,0|2,0,0]=4 97 B39R3.900054834 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC(C)Cc3ccc(cc3)F)C)C 7a_100011351027_100102596886 [0,1,1,0,0,0|2,0,0]=4 98 B39R3.900054849 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCC(=O)N(C)Cc3ccccc3)C)C 11a_100025749762_100015188237 [0,1,1,0,0,0|1,0,1]=4 99 B39R3.900054849 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCC(=O)N(C)Cc3ccccc3)C)C 1626a_100025749762_100015188237 [0,1,1,0,0,0|1,0,1]=4 100 B39R3.900054849 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCC(=O)N(C)Cc3ccccc3)C)C 240690a_100025749762_100015188237 [0,1,1,0,0,0|1,0,1]=4 101 B39R3.900054849 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCC(=O)C(C)Cc3ccccc3)C)C 1458a_100000754839_100102596886 [0,1,1,0,0,0|1,0,1]=4 102 B39R3.1842217676 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC(C)(C)Cc3ccccc3)C)C 7a_100011215222_100102596886 [0,1,1,0,0,0|2,0,0]=4 103 B39R3.1842217785 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCO[C@@H](C)[C@@H](N)c3ccccc3)C)C 34a_100134616770_100102596886 [0,1,1,0,0,0|2,0,0]=4 104 B41R4.3511719674 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)C3CCN(CC3)Cc4ccccc4)C)C 11a_100000207528_100015188237 [0,1,0,0,0,1|1,0,0]=3 105 B41R4.3511719674 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N(C)C3CCN(CC3)Cc4ccccc4)C)C 240690a_100000207528_100015188237 [0,1,0,0,0,1|1,0,0]=3 106 B41R4.3511719722 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)C(=O)c4ccccc4)C)C 11a_100000708042_100015188237 [0,1,0,0,0,1|1,0,1]=4 107 B41R4.3511719722 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)C(=O)c4ccccc4)C)C 1626a_100000708042_100015188237 [0,1,0,0,0,1|1,0,1]=4 108 B41R4.3511719722 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)C(=O)c4ccccc4)C)C 240690a_100000708042_100015188237 [0,1,0,0,0,1|1,0,1]=4 109 B41R4.3511719731 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4C)C)C 1626a_100020642308_100015188237 [0,1,0,0,0,1|1,0,0]=3 110 B41R4.3511719731 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4C)C)C 240690a_100020642308_100015188237 [0,1,0,0,0,1|1,0,0]=3 111 B41R4.3511719731 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4Cl)C)C 1626a_100102559272_100015188237 [0,1,0,0,0,1|1,0,0]=3 112 B41R4.3511719731 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4Cl)C)C 240690a_100102559272_100015188237 [0,1,0,0,0,1|1,0,0]=3 113 B41R4.3511719731 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4F)C)C 11a_100025751618_100015188237 [0,1,0,0,0,1|1,0,0]=3 114 B41R4.3511719731 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4F)C)C 1626a_100025751618_100015188237 [0,1,0,0,0,1|1,0,0]=3 115 B41R4.3511719731 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4F)C)C 240690a_100025751618_100015188237 [0,1,0,0,0,1|1,0,0]=3 116 B41R4.3511719732 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccc(cc4)Cl)C)C 11a_200000209842_100015188237 [0,1,0,0,0,1|1,0,0]=3 117 B41R4.3511719732 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccc(cc4)Cl)C)C 1626a_200000209842_100015188237 [0,1,0,0,0,1|1,0,0]=3 118 B41R4.3511719732 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccc(cc4)Cl)C)C 240690a_200000209842_100015188237 [0,1,0,0,0,1|1,0,0]=3 119 B41R4.3511719732 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccc(cc4)F)C)C 11a_100000741942_100015188237 [0,1,0,0,0,1|1,0,0]=3 120 B41R4.3511719732 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccc(cc4)F)C)C 1626a_100000741942_100015188237 [0,1,0,0,0,1|1,0,0]=3 121 B41R4.3511719732 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4ccc(cc4)F)C)C 240690a_100000741942_100015188237 [0,1,0,0,0,1|1,0,0]=3 122 B41R4.3511719733 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccc(c4)C)C)C 11a_103496528828_100015188237 [0,1,0,0,0,1|1,0,0]=3 123 B41R4.3511719733 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccc(c4)C)C)C 1626a_103496528828_100015188237 [0,1,0,0,0,1|1,0,0]=3 124 B41R4.3511719733 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccc(c4)C)C)C 240690a_103496528828_100015188237 [0,1,0,0,0,1|1,0,0]=3 125 B41R4.3511719733 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccc(c4)F)C)C 11a_100025744737_100015188237 [0,1,0,0,0,1|1,0,0]=3 126 B41R4.3511719733 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccc(c4)F)C)C 1626a_100025744737_100015188237 [0,1,0,0,0,1|1,0,0]=3 127 B41R4.3511719733 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccc(c4)F)C)C 240690a_100025744737_100015188237 [0,1,0,0,0,1|1,0,0]=3 128 B41R4.3511719733 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccc(c4)O)C)C 240690a_100011251830_100015188237 [0,1,0,0,0,1|1,0,0]=3 129 B41R4.3511719757 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)C(=O)c4ccccc4)C)C 11a_200000748992_100015188237 [0,1,0,0,0,1|1,0,1]=4 130 B41R4.3511719757 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)C(=O)c4ccccc4)C)C 1626a_200000748992_100015188237 [0,1,0,0,0,1|1,0,1]=4 131 B41R4.3511719757 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)C(=O)c4ccccc4)C)C 240690a_200000748992_100015188237 [0,1,0,0,0,1|1,0,1]=4 132 B41R4.3511719763 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccccc4Cl)C)C 1626a_100103156907_100015188237 [0,1,0,0,0,1|1,0,0]=3 133 B41R4.3511719763 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccccc4Cl)C)C 240690a_100103156907_100015188237 [0,1,0,0,0,1|1,0,0]=3 134 B41R4.3511719763 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccccc4F)C)C 11a_100015187710_100015188237 [0,1,0,0,0,1|1,0,0]=3 135 B41R4.3511719763 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccccc4F)C)C 1626a_100015187710_100015188237 [0,1,0,0,0,1|1,0,0]=3 136 B41R4.3511719763 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccccc4F)C)C 240690a_100015187710_100015188237 [0,1,0,0,0,1|1,0,0]=3 137 B41R4.3511719764 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccc(cc4)F)C)C 1626a_100015185226_100015188237 [0,1,0,0,0,1|1,0,0]=3 138 B41R4.3511719764 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4ccc(cc4)F)C)C 240690a_100015185226_100015188237 [0,1,0,0,0,1|1,0,0]=3 139 B41R4.3511719765 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4cccc(c4)O)C)C 240690a_100015183286_100015188237 [0,1,0,0,0,1|1,0,0]=3 140 B41R4.3511725246 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN(C3)Cc4ccccc4C)C)C 1626a_100011370371_100015188237 [0,1,0,0,0,1|1,0,0]=3 141 B41R4.3511725246 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN(C3)Cc4ccccc4C)C)C 240690a_100011370371_100015188237 [0,1,0,0,0,1|1,0,0]=3 142 B41R4.3511674110 CCN(C(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)C3CCN(C3)Cc4ccccc4 11a_100000231379_100015188237 [0,2,0,0,0,0|1,0,0]=3 143 B41R4.3511674110 CCN(C(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)C3CCN(C3)Cc4ccccc4 1626a_100000231379_100015188237 [0,2,0,0,0,0|1,0,0]=3 144 B41R4.3511674110 CCN(C(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)C3CCN(C3)Cc4ccccc4 240690a_100000231379_100015188237 [0,2,0,0,0,0|1,0,0]=3 145 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ncncc4C3)C)C 2230a_100012000121_100102596886 [0,0,1,1,0,0|2,0,0]=4 146 B39R4.3987677269 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN3CCc4ncncc4C3)C)C 269982a_100012000121_100102596886 [0,0,1,1,0,0|2,0,0]=4 147 B39R4.3987677276 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCSC3Cc4ccccc4C3)C)C 62a_100102596886_100000753484 [0,0,1,1,0,0|2,0,0]=4 148 B37R3.1140056572 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCSC(C)c3ccccc3)C)C 62a_100102596886_100000230085 [0,0,1,0,1,0|2,0,0]=4 149 B39R3.1842222908 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)CCc3ccccc3 2230a_100000741020_100102596886 [0,0,1,0,0,1|0,0,0]=2 150 B39R3.1842222908 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)CCc3ccccc3 269982a_100000741020_100102596886 [0,0,1,0,0,1|0,0,0]=2 151 B39R3.1842222908 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)CCc3ccccn3 2230a_100000227201_100102596886 [0,0,1,0,0,1|1,0,0]=3 152 B39R3.1842222908 CCN(CCOC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C)C)CCc3ccccn3 269982a_100000227201_100102596886 [0,0,1,0,0,1|1,0,0]=3 153 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCCCCN(C)Cc3ccccc3)C)C 240690a_100011208480_100015188237 [0,0,1,0,0,1|1,0,0]=3 154 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNCC(C)Oc3ccccc3)C)C 2230a_100000755676_100102596886 [0,0,1,0,0,1|2,0,0]=4 155 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNCC(C)Oc3ccccc3)C)C 34a_100000755676_100102596886 [0,0,1,0,0,1|2,0,0]=4 156 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNCC(O)Cc3ccccc3)C)C 2230a_100000752270_100102596886 [0,0,1,0,0,1|2,0,0]=4 157 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC/C(=C/c3ccccc3)/C)C)C 34a_200025717232_100102596886 [0,0,1,0,0,1|1,0,1]=4 158 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC/C(=C/c3ccccc3)/C)C)C 7a_200025717232_100102596886 [0,0,1,0,0,1|1,0,1]=4 159 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOCC(C)Cc3ccccc3)C)C 34a_100012125295_100102596886 [0,0,1,0,0,1|1,0,0]=3 160 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOCC(C)Cc3ccccc3)C)C 7a_100012125295_100102596886 [0,0,1,0,0,1|1,0,0]=3 161 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOCC(C)Oc3ccccc3)C)C 34a_200000036796_100102596886 [0,0,1,0,0,1|2,0,0]=4 162 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOCC(C)Oc3ccccc3)C)C 7a_200000036796_100102596886 [0,0,1,0,0,1|2,0,0]=4 163 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOCC(N)Cc3ccccc3)C)C 34a_100000739027_100102596886 [0,0,1,0,0,1|2,0,0]=4 164 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCSCC(=O)Cc3ccccc3)C)C 62a_100102596886_100000233483 [0,0,1,0,0,1|2,0,0]=4 165 B39R3.900054819 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCSC[C@@H](O)Cc3ccccc3)C)C 62a_100102596886_100000729385 [0,0,1,0,0,1|2,0,0]=4 166 B39R3.900054835 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(C)CCc3ccccc3)C)C 2230a_100000210798_100102596886 [0,0,1,0,0,1|2,0,0]=4 167 B39R3.900054835 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(C)CCc3ccccc3)C)C 34a_100000210798_100102596886 [0,0,1,0,0,1|2,0,0]=4 168 B39R3.900054835 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(C)COc3ccccc3)C)C 2230a_100000746794_100102596886 [0,0,1,0,0,1|2,0,0]=4 169 B39R3.900054835 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCNC(C)COc3ccccc3)C)C 34a_100000746794_100102596886 [0,0,1,0,0,1|2,0,0]=4 170 B39R3.900054835 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC(C)COc3ccccc3)C)C 34a_100000210911_100102596886 [0,0,1,0,0,1|2,0,0]=4 171 B39R3.900054835 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCOC(C)COc3ccccc3)C)C 7a_100000210911_100102596886 [0,0,1,0,0,1|2,0,0]=4 172 B39R3.900054835 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCO[C@@H](C)CCc3ccccc3)C)C 34a_100009815974_100102596886 [0,0,1,0,0,1|2,0,0]=4 173 B39R3.900054835 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCO[C@@H](C)CCc3ccccc3)C)C 7a_100009815974_100102596886 [0,0,1,0,0,1|2,0,0]=4 174 B39R4.3987717165 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccs4)C)C 11a_100000746236_100015188237 [0,0,0,0,1,1|2,0,0]=4 175 B39R4.3987717165 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccs4)C)C 1626a_100000746236_100015188237 [0,0,0,0,1,1|2,0,0]=4 176 B39R4.3987717165 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)Cc4cccs4)C)C 240690a_100000746236_100015188237 [0,0,0,0,1,1|2,0,0]=4 177 B39R4.3987717186 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCCN(C3)Cc4cccs4)C)C 240690a_200015187242_100015188237 [0,0,0,0,1,1|2,0,0]=4 178 B41R4.3511719737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)CCc4ccccc4)C)C 11a_100000738969_100015188237 [0,0,0,0,0,2|1,0,0]=3 179 B41R4.3511719737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)CCc4ccccc4)C)C 1626a_100000738969_100015188237 [0,0,0,0,0,2|1,0,0]=3 180 B41R4.3511719737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NC3CCN(CC3)CCc4ccccc4)C)C 240690a_100000738969_100015188237 [0,0,0,0,0,2|1,0,0]=3 181 B41R4.3511719737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H]3CC[C@@H](CC3)OCc4ccccc4)C)C 11a_102125556243_100015188237 [0,0,0,0,0,2|2,0,0]=4 182 B41R4.3511719737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H]3CC[C@@H](CC3)OCc4ccccc4)C)C 1626a_102125556243_100015188237 [0,0,0,0,0,2|2,0,0]=4 183 B41R4.3511719737 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)N[C@H]3CC[C@@H](CC3)OCc4ccccc4)C)C 240690a_102125556243_100015188237 [0,0,0,0,0,2|2,0,0]=4 184 B41R4.3511725137 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3=CCN(CC3)Cc4ccccc4)C)C 240690a_100010580328_100015188237 [0,0,0,0,0,2|1,0,1]=4 185 B41R4.3511725137 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN(CC3)Cc4ccccc4)C)C 240690a_100000744725_100015188237 [0,0,0,0,0,2|1,0,0]=3 186 B41R4.3511725171 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCCN(C3)Cc4ccccc4)C)C 240690a_100000743563_100015188237 [0,0,0,0,0,2|1,0,0]=3 187 B41R4.3511725171 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CN(CCO3)Cc4ccccc4)C)C 11a_100000180183_100015188237 [0,0,0,0,0,2|1,0,0]=3 188 B41R4.3511725171 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CN(CCO3)Cc4ccccc4)C)C 1626a_100000180183_100015188237 [0,0,0,0,0,2|1,0,0]=3 189 B41R4.3511725171 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CN(CCO3)Cc4ccccc4)C)C 240690a_100000180183_100015188237 [0,0,0,0,0,2|1,0,0]=3 190 B41R4.3511725252 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN(C3)CCc4ccccc4)C)C 11a_100000747384_100015188237 [0,0,0,0,0,2|1,0,0]=3 191 B41R4.3511725252 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN(C3)CCc4ccccc4)C)C 1626a_100000747384_100015188237 [0,0,0,0,0,2|1,0,0]=3 192 B41R4.3511725252 COC(=O)C1=C(NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)NCC3CCN(C3)CCc4ccccc4)C)C 240690a_100000747384_100015188237 [0,0,0,0,0,2|1,0,0]=3