0 B26R3.156025954 O=c1c2ccccc2ncn1CCNCc3cccc(c3)[N+](=O)[O-] 2230a_100000755791_200000757059 [0,0,1,0,0,0|1,0,1]=3 1 B26R3.156025954 O=c1c2ccccc2ncn1CCNCc3cccc(c3)[N+](=O)[O-] 34a_100000755791_200000757059 [0,0,1,0,0,0|1,0,1]=3 2 B26R3.156025954 O=c1c2ccccc2ncn1CCOCc3cccc(c3)[N+](=O)[O-] 34a_100000238370_200000757059 [0,0,1,0,0,0|1,0,1]=3 3 B26R3.156025954 O=c1c2ccccc2ncn1CCOCc3cccc(c3)[N+](=O)[O-] 7a_100000238370_200000757059 [0,0,1,0,0,0|1,0,1]=3 4 B26R3.156025954 O=c1c2ccccc2ncn1CCSCc3cc(ccn3)[N+](=O)[O-] 62a_100010177786_200000757059 [0,0,1,0,0,0|2,0,1]=4 5 B26R3.156025954 O=c1c2ccccc2ncn1CCSCc3cc(ccn3)[N+](=O)[O-] 62a_200000757059_100010177786 [0,0,1,0,0,0|2,0,1]=4 6 B26R3.156025954 O=c1c2ccccc2ncn1CCSCc3cccc(c3)[N+](=O)[O-] 62a_100000187168_200000757059 [0,0,1,0,0,0|1,0,1]=3 7 B26R3.156025954 O=c1c2ccccc2ncn1CCSCc3cccc(c3)[N+](=O)[O-] 62a_200000757059_100000737091 [0,0,1,0,0,0|1,0,1]=3 8 B26R3.156221548 CN(Cc1cccc(c1)[N+](=O)[O-])c2nc3ccccc3c(=O)n2C 27a_100000738247_200000215938 [0,0,1,0,0,0|1,0,1]=3 9 B25R3.127967443 Cn1c(nc2ccccc2c1=O)NCc3cccc(c3)[N+](=O)[O-] 27a_100000755791_200000215938 [1,0,1,0,0,0|1,0,1]=4 10 B25R3.127967443 Cn1c(nc2ccccc2c1=O)SCc3cccc(c3)[N+](=O)[O-] 62a_100000187168_200000215938 [1,0,1,0,0,0|1,0,1]=4 11 B27R3.6360353 Cc1ccc(cc1[N+](=O)[O-])COCCn2cnc3ccccc3c2=O 7a_100011216690_200000757059 [0,1,1,0,0,0|1,0,1]=4 12 B27R3.6360353 O=c1c2ccccc2ncn1CCOCc3ccc(c(c3)[N+](=O)[O-])Cl 7a_100000756607_200000757059 [0,1,1,0,0,0|1,0,1]=4 13 B27R3.6360353 O=c1c2ccccc2ncn1CCOCc3ccc(c(c3)[N+](=O)[O-])F 34a_100000039452_200000757059 [0,1,1,0,0,0|1,0,1]=4 14 B27R3.6360353 O=c1c2ccccc2ncn1CCOCc3ccc(c(c3)[N+](=O)[O-])F 7a_100000039452_200000757059 [0,1,1,0,0,0|1,0,1]=4 15 B27R3.6360353 O=c1c2ccccc2ncn1CCSCc3ccc(c(c3)[N+](=O)[O-])Br 62a_100000693152_200000757059 [0,1,1,0,0,0|1,0,1]=4 16 B27R3.6360353 O=c1c2ccccc2ncn1CCSCc3ccc(c(c3)[N+](=O)[O-])F 62a_100009816672_200000757059 [0,1,1,0,0,0|1,0,1]=4 17 B27R3.6381108 Cc1ccc(cc1COCCn2cnc3ccccc3c2=O)[N+](=O)[O-] 34a_100000075575_200000757059 [0,1,1,0,0,0|1,0,1]=4 18 B27R3.6381108 Cc1ccc(cc1COCCn2cnc3ccccc3c2=O)[N+](=O)[O-] 7a_100000075575_200000757059 [0,1,1,0,0,0|1,0,1]=4 19 B27R3.6381108 O=c1c2ccccc2ncn1CCNCc3cc(ccc3F)[N+](=O)[O-] 34a_200016989751_200000757059 [0,1,1,0,0,0|1,0,1]=4 20 B27R3.6381108 O=c1c2ccccc2ncn1CCOCc3cc(ccc3Br)[N+](=O)[O-] 7a_200010255310_200000757059 [0,1,1,0,0,0|1,0,1]=4 21 B27R3.6381108 O=c1c2ccccc2ncn1CCOCc3cc(ccc3Cl)[N+](=O)[O-] 34a_100000756606_200000757059 [0,1,1,0,0,0|1,0,1]=4 22 B27R3.6381108 O=c1c2ccccc2ncn1CCOCc3cc(ccc3Cl)[N+](=O)[O-] 7a_100000756606_200000757059 [0,1,1,0,0,0|1,0,1]=4 23 B27R3.6381108 O=c1c2ccccc2ncn1CCOCc3cc(ccc3F)[N+](=O)[O-] 34a_100011214969_200000757059 [0,1,1,0,0,0|1,0,1]=4 24 B27R3.6381108 O=c1c2ccccc2ncn1CCOCc3cc(ccc3F)[N+](=O)[O-] 7a_100011214969_200000757059 [0,1,1,0,0,0|1,0,1]=4 25 B27R3.6381108 O=c1c2ccccc2ncn1CCSCc3cc(ccc3Br)[N+](=O)[O-] 62a_100010254470_200000757059 [0,1,1,0,0,0|1,0,1]=4 26 B27R3.18839286 Cc1cc(cc(c1)[N+](=O)[O-])COCCn2cnc3ccccc3c2=O 34a_100009873062_200000757059 [0,1,1,0,0,0|1,0,1]=4 27 B27R3.18839286 Cc1cc(cc(c1)[N+](=O)[O-])COCCn2cnc3ccccc3c2=O 7a_100009873062_200000757059 [0,1,1,0,0,0|1,0,1]=4 28 B27R3.18839286 Nc1cc(cc(c1)[N+](=O)[O-])COCCn2cnc3ccccc3c2=O 34a_106657271727_200000757059 [0,1,1,0,0,0|1,0,1]=4 29 B27R3.18839286 O=c1c2ccccc2ncn1CCOCc3cc(cc(c3)[N+](=O)[O-])Br 34a_100010202659_200000757059 [0,1,1,0,0,0|1,0,1]=4 30 B27R3.18839286 O=c1c2ccccc2ncn1CCOCc3cc(cc(c3)[N+](=O)[O-])Br 7a_100010202659_200000757059 [0,1,1,0,0,0|1,0,1]=4 31 B27R3.18839286 O=c1c2ccccc2ncn1CCOCc3cc(cc(c3)[N+](=O)[O-])Cl 34a_100000087606_200000757059 [0,1,1,0,0,0|1,0,1]=4 32 B27R3.18839286 O=c1c2ccccc2ncn1CCOCc3cc(cc(c3)[N+](=O)[O-])Cl 7a_100000087606_200000757059 [0,1,1,0,0,0|1,0,1]=4 33 B27R3.18839286 O=c1c2ccccc2ncn1CCOCc3cc(cc(c3)[N+](=O)[O-])F 34a_100012178896_200000757059 [0,1,1,0,0,0|1,0,1]=4 34 B27R3.18839286 O=c1c2ccccc2ncn1CCOCc3cc(cc(c3)[N+](=O)[O-])F 7a_100012178896_200000757059 [0,1,1,0,0,0|1,0,1]=4 35 B27R3.18839286 O=c1c2ccccc2ncn1CCOCc3cc(cc(c3)[N+](=O)[O-])I 7a_100000731454_200000757059 [0,1,1,0,0,0|1,0,1]=4 36 B27R3.18839286 O=c1c2ccccc2ncn1CCSCc3cc(cc(c3)[N+](=O)[O-])Br 62a_100012359582_200000757059 [0,1,1,0,0,0|1,0,1]=4 37 B27R3.18839286 O=c1c2ccccc2ncn1CCSCc3cc(cc(c3)[N+](=O)[O-])Br 62a_200000757059_100012359582 [0,1,1,0,0,0|1,0,1]=4 38 B27R3.18839286 O=c1c2ccccc2ncn1CCSCc3cc(cc(c3)[N+](=O)[O-])Cl 62a_200000757059_100010239696 [0,1,1,0,0,0|1,0,1]=4 39 B27R3.18839286 O=c1c2ccccc2ncn1CCSCc3cc(cc(c3)[N+](=O)[O-])F 62a_200000757059_100012145706 [0,1,1,0,0,0|1,0,1]=4 40 B27R3.18839286 O=c1c2ccccc2ncn1CCSCc3cc(cc(c3)[N+](=O)[O-])I 62a_100010150304_200000757059 [0,1,1,0,0,0|1,0,1]=4 41 B27R3.18839286 O=c1c2ccccc2ncn1CCSCc3cc(cc(c3)[N+](=O)[O-])I 62a_200000757059_100010150304 [0,1,1,0,0,0|1,0,1]=4 42 B27R3.170809793 Cc1c(cccc1[N+](=O)[O-])COCCn2cnc3ccccc3c2=O 34a_100011215329_200000757059 [0,1,1,0,0,0|1,0,1]=4 43 B27R3.170809793 Cc1c(cccc1[N+](=O)[O-])COCCn2cnc3ccccc3c2=O 7a_100011215329_200000757059 [0,1,1,0,0,0|1,0,1]=4 44 B27R3.170809793 Cc1c(cccc1[N+](=O)[O-])CSCCn2cnc3ccccc3c2=O 62a_200000757059_100000740638 [0,1,1,0,0,0|1,0,1]=4 45 B27R3.170809793 O=c1c2ccccc2ncn1CCOCc3cccc(c3Br)[N+](=O)[O-] 7a_100012349632_200000757059 [0,1,1,0,0,0|1,0,1]=4 46 B27R3.170809793 O=c1c2ccccc2ncn1CCOCc3cccc(c3Cl)[N+](=O)[O-] 7a_100000087621_200000757059 [0,1,1,0,0,0|1,0,1]=4 47 B27R3.170809793 O=c1c2ccccc2ncn1CCOCc3cccc(c3F)[N+](=O)[O-] 34a_100012000434_200000757059 [0,1,1,0,0,0|1,0,1]=4 48 B27R3.170809793 O=c1c2ccccc2ncn1CCOCc3cccc(c3F)[N+](=O)[O-] 7a_100012000434_200000757059 [0,1,1,0,0,0|1,0,1]=4 49 B27R3.170809793 O=c1c2ccccc2ncn1CCSCc3cccc(c3Br)[N+](=O)[O-] 62a_100012349479_200000757059 [0,1,1,0,0,0|1,0,1]=4 50 B27R3.170809793 O=c1c2ccccc2ncn1CCSCc3cccc(c3F)[N+](=O)[O-] 62a_100012360031_200000757059 [0,1,1,0,0,0|1,0,1]=4 51 B27R3.170809793 O=c1c2ccccc2ncn1CCSCc3cccc(c3I)[N+](=O)[O-] 62a_100010150299_200000757059 [0,1,1,0,0,0|1,0,1]=4 52 B27R3.170809841 CC(NCCn1cnc2ccccc2c1=O)c3cccc(c3)[N+](=O)[O-] 2230a_100000741830_200000757059 [0,1,1,0,0,0|1,0,1]=4 53 B27R3.170809841 CC(OCCn1cnc2ccccc2c1=O)c3cccc(c3)[N+](=O)[O-] 34a_100000246462_200000757059 [0,1,1,0,0,0|1,0,1]=4 54 B27R3.170809841 CC(OCCn1cnc2ccccc2c1=O)c3cccc(c3)[N+](=O)[O-] 7a_100000246462_200000757059 [0,1,1,0,0,0|1,0,1]=4 55 B27R3.170809841 CC(SCCn1cnc2ccccc2c1=O)c3cccc(c3)[N+](=O)[O-] 62a_200000757059_100000209821 [0,1,1,0,0,0|1,0,1]=4 56 B27R3.170809862 CN(CCn1cnc2ccccc2c1=O)Cc3cccc(c3)[N+](=O)[O-] 2230a_100000738247_200000757059 [0,1,1,0,0,0|1,0,1]=4 57 B27R3.170809862 CN(CCn1cnc2ccccc2c1=O)Cc3cccc(c3)[N+](=O)[O-] 269982a_100000738247_200000757059 [0,1,1,0,0,0|1,0,1]=4 58 B27R3.170809862 O=C(CCn1cnc2ccccc2c1=O)Cc3cc(ccn3)[N+](=O)[O-] 1458a_100000234353_100010177786 [0,1,1,0,0,0|1,0,1]=4 59 B27R3.170809862 O=C(CCn1cnc2ccccc2c1=O)Cc3cccc(c3)[N+](=O)[O-] 1458a_100000234353_100000737091 [0,1,1,0,0,0|0,0,1]=3 60 B27R3.170809862 O=C(CCn1cnc2ccccc2c1=O)Cc3cccc(c3)[N+](=O)[O-] 1458a_100000749288_200000757059 [0,1,1,0,0,0|0,0,1]=3 61 B27R3.170809862 O=C(CCn1cnc2ccccc2c1=O)Nc3cccc(c3)[N+](=O)[O-] 11a_100000184103_100000234353 [0,1,1,0,0,0|1,0,0]=3 62 B27R3.170809862 O=C(CCn1cnc2ccccc2c1=O)Nc3cccc(c3)[N+](=O)[O-] 22a_100000184103_100000234353 [0,1,1,0,0,0|1,0,0]=3 63 B27R3.170809862 O=C(CCn1nnc2ccccc2c1=O)Cc3cccc(c3)[N+](=O)[O-] 1458a_100000230374_100000737091 [0,1,1,0,0,0|1,0,1]=4 64 B27R3.170809862 O=C(CCn1nnc2ccccc2c1=O)Nc3cccc(c3)[N+](=O)[O-] 11a_100000184103_100000230374 [0,1,1,0,0,0|2,0,0]=4 65 B27R3.170809862 O=C(CCn1nnc2ccccc2c1=O)Nc3cccc(c3)[N+](=O)[O-] 1626a_100000184103_100000230374 [0,1,1,0,0,0|2,0,0]=4 66 B27R3.170809862 O=C(CCn1nnc2ccccc2c1=O)Nc3cccc(c3)[N+](=O)[O-] 22a_100000184103_100000230374 [0,1,1,0,0,0|2,0,0]=4 67 B27R3.529602133 CC(Cn1cnc2ccccc2c1=O)NCc3cccc(c3)[N+](=O)[O-] 270004a_100000755791_100000198175 [0,1,1,0,0,0|1,0,1]=4 68 B27R3.6331095 CN(Cc1cc(ccc1Cl)[N+](=O)[O-])c2nc3ccccc3c(=O)n2C 27a_100000707945_200000215938 [0,1,1,0,0,0|1,0,1]=4 69 B27R3.530607185 CC(c1cccc(c1)[N+](=O)[O-])N(C)c2nc3ccccc3c(=O)n2C 27a_100000704473_200000215938 [0,1,1,0,0,0|1,0,1]=4 70 B25R2.27748815 CC/C(=C\c1cccc(c1)[N+](=O)[O-])/C(=O)Cc2ccccc2C=O 1458a_200020681858_200009853537 [0,0,2,0,0,0|2,0,0]=4 71 B25R2.904393 CC/C(=C\c1cccc(c1)[N+](=O)[O-])/C(=O)CC(=O)c2ccccc2 1458a_200020681858_100000211460 [0,0,2,0,0,0|2,0,0]=4 72 B27R4.89846644 Cn1c(nc2ccccc2c1=O)N3Cc4ccc(cc4C3)[N+](=O)[O-] 27a_100000763510_200000215938 [0,0,1,1,0,0|1,0,1]=4 73 B25R3.127807889 O=c1c2ccccc2ncn1CCNc3cccc(c3)[N+](=O)[O-] 34a_100000184103_200000757059 [0,0,1,0,1,0|1,0,0]=3 74 B25R3.127807889 O=c1c2ccccc2ncn1CCOc3cccc(c3)[N+](=O)[O-] 34a_100000185994_200000757059 [0,0,1,0,1,0|1,0,0]=3 75 B25R3.127807889 O=c1c2ccccc2ncn1CCOc3cccc(c3)[N+](=O)[O-] 7a_100000185994_200000757059 [0,0,1,0,1,0|1,0,0]=3 76 B25R3.127807889 O=c1c2ccccc2ncn1CCOc3cncc(c3)[N+](=O)[O-] 34a_100009862860_200000757059 [0,0,1,0,1,0|2,0,0]=4 77 B25R3.127807889 O=c1c2ccccc2ncn1CCOc3cncc(c3)[N+](=O)[O-] 7a_100009862860_200000757059 [0,0,1,0,1,0|2,0,0]=4 78 B25R3.127967480 CN(c1cccc(c1)[N+](=O)[O-])c2nc3ccccc3c(=O)n2C 27a_102515432896_200000215938 [0,0,1,0,1,0|1,0,0]=3 79 B27R3.2657486 CCn1c(nc2ccccc2c1=O)NN=Cc3cc(ccn3)[N+](=O)[O-] 4a_100000017179_200000085670 [0,0,1,0,0,1|2,0,0]=4 80 B27R3.2657486 CCn1c(nc2ccccc2c1=O)NN=Cc3cccc(c3)[N+](=O)[O-] 4a_100000017179_100000185827 [0,0,1,0,0,1|1,0,0]=3 81 B27R3.170809854 O=c1c2ccccc2ncn1CCNCCc3cccc(c3)[N+](=O)[O-] 2230a_100000694159_200000757059 [0,0,1,0,0,1|0,0,2]=4 82 B27R3.170809854 O=c1c2ccccc2ncn1CCNCCc3cccc(c3)[N+](=O)[O-] 34a_100000694159_200000757059 [0,0,1,0,0,1|0,0,2]=4 83 B27R3.170809854 O=c1c2ccccc2ncn1CCOCCc3cccc(c3)[N+](=O)[O-] 34a_100011219613_200000757059 [0,0,1,0,0,1|0,0,2]=4 84 B27R3.170809854 O=c1c2ccccc2ncn1CCOCCc3cccc(c3)[N+](=O)[O-] 7a_100011219613_200000757059 [0,0,1,0,0,1|0,0,2]=4 85 B27R3.170809854 O=c1c2ccccc2ncn1CCSCCc3cccc(c3)[N+](=O)[O-] 62a_200000757059_100011935270 [0,0,1,0,0,1|0,0,2]=4