0 B22R2.585681 CC(C)Oc1ccccc1C(=O)Cc2ccc(s2)[N+](=O)[O-] 1458a_100000244644_200010296502 [0,0,0,0,0,0|3,0,1]=4 1 B22R2.585681 CC(C)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000210206 [0,0,0,0,0,0|1,0,1]=2 2 B21R2.276539 CCOc1ccccc1C(=O)Cc2ccc(s2)[N+](=O)[O-] 1458a_100000211144_200010296502 [1,0,0,0,0,0|2,0,1]=4 3 B21R2.276539 CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000210202 [1,0,0,0,0,0|0,0,1]=2 4 B21R2.276539 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OCF 7a_200015203979_100015361967 [1,0,0,0,0,0|1,0,1]=3 5 B23R2.469387 CC(=O)N(C)c1ccccc1C(=O)Cc2ccc(s2)[N+](=O)[O-] 1458a_100000242783_200010296502 [0,1,0,0,0,0|3,0,0]=4 6 B23R2.745195 COC(=O)c1cnc(s1)NC(=O)c2ccccc2OC(=O)C 188690a_100000231023_100000210466 [0,1,0,0,0,0|1,0,1]=3 7 B23R2.3203156 CC(C#N)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000703298 [0,1,0,0,0,0|1,0,1]=3 8 B23R2.3203156 CC(CO)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100012180447 [0,1,0,0,0,0|0,0,2]=3 9 B23R2.3203156 CCC(=O)Nc1ccccc1C(=O)Cc2ccc(s2)[N+](=O)[O-] 1458a_100000194446_200010296502 [0,1,0,0,0,0|3,0,0]=4 10 B23R2.3203156 CCC(C)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000758301 [0,1,0,0,0,0|1,0,1]=3 11 B23R2.3203156 COC(=O)Cc1ccccc1C(=O)Cc2ccc(s2)[N+](=O)[O-] 1458a_100000726341_200010296502 [0,1,0,0,0,0|3,0,0]=4 12 B23R2.5171702 CC(=O)Nc1cc(ccc1C(=O)Cc2ccc(s2)[N+](=O)[O-])Br 1458a_100000747254_200010296502 [0,1,0,0,0,0|3,0,0]=4 13 B23R2.5171702 CC(=O)Nc1cc(ccc1C(=O)Cc2ccc(s2)[N+](=O)[O-])Cl 1458a_100000195377_200010296502 [0,1,0,0,0,0|3,0,0]=4 14 B23R2.5171702 CC(=O)Nc1cc(ccc1C(=O)Cc2ccc(s2)[N+](=O)[O-])F 1458a_100000222213_200010296502 [0,1,0,0,0,0|3,0,0]=4 15 B23R2.8249754 CC(=O)Nc1cccc(c1C(=O)Cc2ccc(s2)[N+](=O)[O-])Cl 1458a_200011219801_200010296502 [0,1,0,0,0,0|3,0,0]=4 16 B23R2.8249754 CC(=O)Nc1cccc(c1C(=O)Cc2ccc(s2)[N+](=O)[O-])F 1458a_100000756107_200010296502 [0,1,0,0,0,0|3,0,0]=4 17 B23R2.8311158 CC(=O)Nc1ccc(cc1C(=O)Cc2ccc(s2)[N+](=O)[O-])Br 1458a_100000195241_200010296502 [0,1,0,0,0,0|3,0,0]=4 18 B23R2.8311158 CC(=O)Nc1ccc(cc1C(=O)Cc2ccc(s2)[N+](=O)[O-])F 1458a_100011219192_200010296502 [0,1,0,0,0,0|3,0,0]=4 19 B23R2.8871601 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OC(F)(F)F 7a_200015203979_200000243211 [0,1,0,0,0,0|2,0,1]=4 20 B23R3.805283 Cc1nc2cccc(c2o1)C(=O)Cc3ccc(s3)[N+](=O)[O-] 1458a_100011934341_200010296502 [0,0,0,1,0,0|3,0,0]=4 21 B21R2.253608 CS(=O)c1ccccc1C(=O)Cc2ccc(s2)[N+](=O)[O-] 1458a_100000204632_200010296502 [0,0,0,0,1,0|3,0,0]=4 22 B23R2.5230175 C=C(C)COc1ccccc1C(=O)Cc2ccc(s2)[N+](=O)[O-] 1458a_100000217157_200010296502 [0,0,0,0,0,1|3,0,0]=4 23 B23R2.5230175 C=C(C)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000748629 [0,0,0,0,0,1|1,0,0]=2 24 B23R2.5230175 C=C(F)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000042424 [0,0,0,0,0,1|1,0,1]=3 25 B23R2.5230175 CC(C)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000210760 [0,0,0,0,0,1|1,0,1]=3 26 B23R2.5230175 CC(O)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100011218427 [0,0,0,0,0,1|0,0,2]=3 27 B23R2.5230175 C[C@@H](O)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100009817552 [0,0,0,0,0,1|0,0,2]=3 28 B23R2.5230175 NC(=O)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000187820 [0,0,0,0,0,1|1,0,0]=2 29 B23R2.5230175 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OCC(F)F 7a_200015203979_100011934356 [0,0,0,0,0,1|2,0,1]=4 30 B20R2.42716 COc1ccccc1C(=O)Cc2ccc(s2)[N+](=O)[O-] 1458a_100000185835_200010296502 [2,0,0,0,0,0|2,0,0]=4 31 B20R2.42716 COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_200000210301 [2,0,0,0,0,0|0,0,0]=2 32 B20R2.42716 [13CH3]Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_200025704644 [2,0,0,0,0,0|0,0,0]=2 33 B22R2.575841 C#CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000038162 [1,1,0,0,0,0|0,0,2]=4 34 B22R2.575841 C=CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100015514636 [1,1,0,0,0,0|0,0,1]=3 35 B22R2.575841 CCCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000210303 [1,1,0,0,0,0|0,0,1]=3 36 B22R2.575841 N#CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100011215382 [1,1,0,0,0,0|0,0,2]=4 37 B22R2.575841 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OCCF 7a_200015203979_100011217306 [1,1,0,0,0,0|0,0,1]=3 38 B22R2.575841 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OCCO 7a_200015203979_100000211926 [1,1,0,0,0,0|0,0,1]=3 39 B22R2.575841 O=CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_200015260668 [1,1,0,0,0,0|0,0,0]=2 40 B24R2.16839084 COC(=O)Cc1cnc(s1)NC(=O)c2ccccc2OC(=O)C 188690a_100000013123_100000210466 [0,1,0,0,0,1|1,0,1]=4 41 B24R2.11083142 CC(=O)Oc1ccc(cc1C(=O)Nc2ccc(cc2)[N+](=O)[O-])C 1626a_100015195142_100000047319 [0,1,0,0,0,1|2,0,0]=4 42 B24R2.11083533 CC(=O)Oc1ccc(cc1C(=O)Nc2cccc(c2)[N+](=O)[O-])C 1626a_100000184103_100000047319 [0,1,0,0,0,1|2,0,0]=4 43 B24R2.594350 CC(C)(O)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000764493 [0,1,0,0,0,1|0,0,2]=4 44 B24R2.594350 C[Si](C)(C)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000233785 [0,1,0,0,0,1|1,1,0]=4 45 B24R2.1102591 CCC(=O)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000747405 [0,1,0,0,0,1|0,0,0]=2 46 B24R2.1102591 CCC(C)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000748023 [0,1,0,0,0,1|1,0,1]=4 47 B24R2.1102591 CCC(O)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100011218378 [0,1,0,0,0,1|0,0,2]=4 48 B24R2.1102591 CC[C@H](C)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100009816398 [0,1,0,0,0,1|1,0,1]=4 49 B24R2.1102591 CNC(=O)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000183359 [0,1,0,0,0,1|0,0,0]=2 50 B24R2.1102591 COC(=O)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000747449 [0,1,0,0,0,1|0,0,0]=2 51 B24R2.1102591 C[C@@H](CO)COc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000059175 [0,1,0,0,0,1|0,0,2]=4 52 B24R2.1102591 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OCC(O)CO 7a_200015203979_100011219619 [0,1,0,0,0,1|0,0,2]=4 53 B24R2.1102591 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OC[C@@H](O)CF 7a_200015203979_100015614560 [0,1,0,0,0,1|0,0,2]=4 54 B24R2.1102591 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OC[C@@H](O)CO 7a_200015203979_100009815848 [0,1,0,0,0,1|0,0,2]=4 55 B24R2.12007890 CC(=O)C(C)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000179758 [0,1,0,0,0,1|0,0,0]=2 56 B24R2.12007890 CC(Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-])C(=O)N 7a_200015203979_100000702099 [0,1,0,0,0,1|1,0,0]=3 57 B24R2.12007890 NC(=O)C(F)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100009813875 [0,1,0,0,0,1|1,0,0]=3 58 B24R2.826761 CCOC(=O)c1cnc(s1)NC(=O)c2ccccc2OC(=O)C 188690a_100000743782_100000210466 [0,2,0,0,0,0|1,0,1]=4 59 B24R2.984296 COC(=O)c1cnc(s1)NC(=O)c2cc(ccc2OC(=O)C)Br 188690a_100000231023_200009996594 [0,2,0,0,0,0|1,0,1]=4 60 B24R2.984296 COC(=O)c1cnc(s1)NC(=O)c2cc(ccc2OC(=O)C)C 188690a_100000231023_100000047319 [0,2,0,0,0,0|1,0,1]=4 61 B24R2.984296 COC(=O)c1cnc(s1)NC(=O)c2cc(ccc2OC(=O)C)Cl 188690a_100000231023_100000058116 [0,2,0,0,0,0|1,0,1]=4 62 B24R2.1302744 CC(CC#N)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100009813641 [0,2,0,0,0,0|1,0,1]=4 63 B24R2.1302744 CC(CCO)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100009893172 [0,2,0,0,0,0|0,0,2]=4 64 B24R2.1302744 CCCC(C)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000766640 [0,2,0,0,0,0|1,0,1]=4 65 B24R2.1302744 COCC(C)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000765312 [0,2,0,0,0,0|0,0,2]=4 66 B24R2.6372112 CCC(CC)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000210505 [0,2,0,0,0,0|1,0,1]=4 67 B24R2.10092377 CC(C)(C#N)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100011162410 [0,2,0,0,0,0|1,0,1]=4 68 B24R2.10092377 CCC(C)(C)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000210677 [0,2,0,0,0,0|1,0,1]=4 69 B24R3.28564118 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OCC3CC3 7a_200015203979_100000742324 [0,0,0,1,0,1|1,0,1]=4 70 B24R3.28564118 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OCC3CO3 7a_200015203979_102125554688 [0,0,0,1,0,1|0,0,2]=4 71 B24R3.28564118 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OCC3CS3 7a_200015203979_100000031435 [0,0,0,1,0,1|0,1,1]=4 72 B24R3.28564118 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OC[C@@H]3CO3 7a_200015203979_100000745022 [0,0,0,1,0,1|0,0,2]=4 73 B24R3.28564199 O=C(Nc1ncc(s1)[N+](=O)[O-])c2ccccc2OC3COC3 7a_200015203979_100009818527 [0,1,0,1,0,0|0,0,2]=4 74 B20R2.262228 CC(=O)Nc1ccccc1Sc2ncc(s2)[N+](=O)[O-] 11a_200000023412_100015343762 [1,0,0,0,1,0|2,0,0]=4 75 B24R2.18201853 CC(=O)Nc1ccccc1OCC(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_100000185124_100000183304 [0,0,0,0,0,2|1,0,0]=3 76 B24R2.18201853 CC(=O)Nc1ncccc1OCC(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200000022013_100000183304 [0,0,0,0,0,2|2,0,0]=4 77 B24R2.18201853 CC(C)Oc1ccccc1NCC(=O)Nc2ncc(s2)[N+](=O)[O-] 2230a_100000739276_100000183304 [0,0,0,0,0,2|1,0,1]=4 78 B24R2.18201853 CC(C)Oc1ccccc1OCC(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_100011218612_100000183304 [0,0,0,0,0,2|1,0,1]=4 79 B24R2.1082948 CC(=O)Oc1ccccc1C(=NNc2ccc(cn2)[N+](=O)[O-])C 4a_100000737981_100000002011 [0,0,0,0,0,2|2,0,0]=4 80 B24R2.1082948 CC(=O)Oc1ccccc1C(=O)NCc2ccc(cc2)[N+](=O)[O-] 240690a_100000742766_100000210466 [0,0,0,0,0,2|2,0,0]=4 81 B24R2.12115310 CC(=O)Oc1ccccc1C(=O)NCc2cccc(c2)[N+](=O)[O-] 240690a_100000755791_100000210466 [0,0,0,0,0,2|2,0,0]=4 82 B24R2.11968422 C=C(C)CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000730704 [0,0,0,0,0,2|1,0,0]=3 83 B24R2.11968422 CC(=CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-])C 7a_200015203979_100000761012 [0,0,0,0,0,2|1,0,0]=3 84 B24R2.11968422 CC(=O)CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000053229 [0,0,0,0,0,2|0,0,0]=2 85 B24R2.11968422 CC(C)CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000210626 [0,0,0,0,0,2|1,0,1]=4 86 B24R2.11968422 CC(O)CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100012276601 [0,0,0,0,0,2|0,0,2]=4 87 B24R2.11968422 CN(C)CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000755713 [0,0,0,0,0,2|2,0,0]=4 88 B24R2.11968422 NC(=O)CCOc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] 7a_200015203979_100000744528 [0,0,0,0,0,2|1,0,0]=3