0 B27R3.605750925 CC(Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000748627_100000039610 [0,0,0,0,0,0|1,0,0]=1 1 B27R3.605750925 CC(Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000748627_100000039610 [0,0,0,0,0,0|1,0,0]=1 2 B27R3.605750925 CC(Cc1ccccc1)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000039610_200011218536 [0,0,0,0,0,0|1,0,0]=1 3 B27R3.605750925 CC(Cc1ccccc1)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_200011218536_100000039610 [0,0,0,0,0,0|1,0,0]=1 4 B27R3.605750925 CC(Cc1ccccn1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000238496_100000039610 [0,0,0,0,0,0|1,0,0]=1 5 B27R3.605750925 CC(Cc1cccnc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011207255_100000039610 [0,0,0,0,0,0|1,0,0]=1 6 B27R3.605750925 CC(Cc1cnccn1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011277835_100000039610 [0,0,0,0,0,0|2,0,0]=2 7 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 2230a_100000186898_100020672187 [0,0,0,0,0,0|2,0,0]=2 8 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 269982a_100000186898_100020672187 [0,0,0,0,0,0|2,0,0]=2 9 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccn3 2230a_100000207498_100020672187 [0,0,0,0,0,0|3,0,0]=3 10 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccn3 269982a_100000207498_100020672187 [0,0,0,0,0,0|3,0,0]=3 11 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3 2230a_100000184577_100020672187 [0,0,0,0,0,0|3,0,0]=3 12 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3 269982a_100000184577_100020672187 [0,0,0,0,0,0|3,0,0]=3 13 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccncc3 2230a_100000187231_100020672187 [0,0,0,0,0,0|3,0,0]=3 14 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccncc3 269982a_100000187231_100020672187 [0,0,0,0,0,0|3,0,0]=3 15 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cnccn3 2230a_100011269079_100020672187 [0,0,0,0,0,0|4,0,0]=4 16 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cnccn3 269982a_100011269079_100020672187 [0,0,0,0,0,0|4,0,0]=4 17 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ncccn3 2230a_100025716638_100020672187 [0,0,0,0,0,0|4,0,0]=4 18 B27R3.605750925 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ncccn3 269982a_100025716638_100020672187 [0,0,0,0,0,0|4,0,0]=4 19 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)C[n+]3ccccc3)n(c1=O)C 1458a_200000086051_100020672187 [0,0,0,0,0,0|3,0,1]=4 20 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3)n(c1=O)C 1458a_100000689370_100015291786 [0,0,0,0,0,0|2,0,1]=3 21 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccn3)n(c1=O)C 1458a_100000233486_100020672187 [0,0,0,0,0,0|3,0,1]=4 22 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccn3)n(c1=O)C 1458a_100000689370_100000721315 [0,0,0,0,0,0|3,0,1]=4 23 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccnc3)n(c1=O)C 1458a_100000689370_100000733263 [0,0,0,0,0,0|3,0,1]=4 24 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccnc3)n(c1=O)C 1458a_100000737805_100020672187 [0,0,0,0,0,0|3,0,1]=4 25 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccncc3)n(c1=O)C 1458a_100000689370_100000705612 [0,0,0,0,0,0|3,0,1]=4 26 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Nc3ccccc3)n(c1=O)C 11a_100000106764_100000689370 [0,0,0,0,0,0|3,0,1]=4 27 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Nc3ccccc3)n(c1=O)C 1626a_100000106764_100000689370 [0,0,0,0,0,0|3,0,1]=4 28 B27R3.605750925 Cn1c(=O)c2c(ncn2CCCC(=O)Nc3ccccc3)n(c1=O)C 22a_100000106764_100000689370 [0,0,0,0,0,0|3,0,1]=4 29 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCNCc3ccccc3)n(c1=O)C 2230a_100015324214_100020672187 [1,0,0,0,0,0|2,0,0]=3 30 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCNCc3ccccc3)n(c1=O)C 34a_100015324214_100020672187 [1,0,0,0,0,0|2,0,0]=3 31 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3)n(c1=O)C 34a_100000210790_100020672187 [1,0,0,0,0,0|2,0,0]=3 32 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3)n(c1=O)C 7a_100000210790_100020672187 [1,0,0,0,0,0|2,0,0]=3 33 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3)n(c1=O)C 62a_100000211182_100020672187 [1,0,0,0,0,0|2,0,0]=3 34 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3)n(c1=O)C 62a_100020672187_100015291786 [1,0,0,0,0,0|2,0,0]=3 35 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCSCc3ccccn3)n(c1=O)C 62a_100000721315_100020672187 [1,0,0,0,0,0|3,0,0]=4 36 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCSCc3ccccn3)n(c1=O)C 62a_100020672187_100000721315 [1,0,0,0,0,0|3,0,0]=4 37 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCSCc3cccnc3)n(c1=O)C 62a_100000741622_100020672187 [1,0,0,0,0,0|3,0,0]=4 38 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCSCc3cccnc3)n(c1=O)C 62a_100020672187_100000741622 [1,0,0,0,0,0|3,0,0]=4 39 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCSCc3ccncc3)n(c1=O)C 62a_100015193705_100020672187 [1,0,0,0,0,0|3,0,0]=4 40 B26R3.536012726 Cn1c(=O)c2c(ncn2CCCSCc3ccncc3)n(c1=O)C 62a_100020672187_100015193705 [1,0,0,0,0,0|3,0,0]=4 41 B26R3.536012726 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3)n(c1=O)C 2230a_100000106460_100000039610 [1,0,0,0,0,0|0,0,0]=1 42 B26R3.536012726 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3)n(c1=O)C 34a_100000106460_100000039610 [1,0,0,0,0,0|0,0,0]=1 43 B26R3.536012726 Cn1c(=O)c2c(ncn2CCNCCc3cccnc3)n(c1=O)C 2230a_100000736294_100000039610 [1,0,0,0,0,0|1,0,0]=2 44 B26R3.536012726 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3)n(c1=O)C 34a_100000210268_100000039610 [1,0,0,0,0,0|1,0,0]=2 45 B26R3.536012726 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3)n(c1=O)C 7a_100000210268_100000039610 [1,0,0,0,0,0|1,0,0]=2 46 B26R3.536012726 Cn1c(=O)c2c(ncn2CCOCCc3ccccn3)n(c1=O)C 34a_100000210271_100000039610 [1,0,0,0,0,0|2,0,0]=3 47 B26R3.536012726 Cn1c(=O)c2c(ncn2CCOCCc3cccnc3)n(c1=O)C 34a_100011217484_100000039610 [1,0,0,0,0,0|2,0,0]=3 48 B26R3.536012726 Cn1c(=O)c2c(ncn2CCOCCc3ccncc3)n(c1=O)C 34a_100011216225_100000039610 [1,0,0,0,0,0|2,0,0]=3 49 B26R3.536012726 Cn1c(=O)c2c(ncn2CCOCCc3cnccn3)n(c1=O)C 34a_100011349526_100000039610 [1,0,0,0,0,0|3,0,0]=4 50 B26R3.536012726 Cn1c(=O)c2c(ncn2CCOCCc3cncnc3)n(c1=O)C 34a_100011709255_100000039610 [1,0,0,0,0,0|3,0,0]=4 51 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3)n(c1=O)C 62a_100000039610_100011218657 [1,0,0,0,0,0|1,0,0]=2 52 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3)n(c1=O)C 62a_100000765856_100000039610 [1,0,0,0,0,0|1,0,0]=2 53 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCCc3ccccn3)n(c1=O)C 62a_100000039610_100015183660 [1,0,0,0,0,0|2,0,0]=3 54 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCCc3ccccn3)n(c1=O)C 62a_100015183660_100000039610 [1,0,0,0,0,0|2,0,0]=3 55 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCCc3cccnc3)n(c1=O)C 62a_100000039610_200011713674 [1,0,0,0,0,0|2,0,0]=3 56 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCCc3cccnc3)n(c1=O)C 62a_200011713674_100000039610 [1,0,0,0,0,0|2,0,0]=3 57 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCCc3ccncc3)n(c1=O)C 62a_100000039610_100000723409 [1,0,0,0,0,0|2,0,0]=3 58 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCCc3ccncc3)n(c1=O)C 62a_100000723409_100000039610 [1,0,0,0,0,0|2,0,0]=3 59 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCSc3ccccc3)n(c1=O)C 62a_100000039610_100011218342 [1,0,0,0,0,0|2,0,0]=3 60 B26R3.536012726 Cn1c(=O)c2c(ncn2CCSCSc3ccccc3)n(c1=O)C 62a_100011218342_100000039610 [1,0,0,0,0,0|2,0,0]=3 61 B28R3.69633104 C#CC(Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000685211_100000039610 [0,1,0,0,0,0|1,0,1]=3 62 B28R3.69633104 C#CC(Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000685211_100000039610 [0,1,0,0,0,0|1,0,1]=3 63 B28R3.69633104 CCC(Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000760156_100000039610 [0,1,0,0,0,0|1,0,0]=2 64 B28R3.69633104 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 2230a_100000186914_100020672187 [0,1,0,0,0,0|2,0,0]=3 65 B28R3.69633104 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 269982a_100000186914_100020672187 [0,1,0,0,0,0|2,0,0]=3 66 B28R3.69633104 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccn3 2230a_100000201164_100020672187 [0,1,0,0,0,0|3,0,0]=4 67 B28R3.69633104 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccn3 269982a_100000201164_100020672187 [0,1,0,0,0,0|3,0,0]=4 68 B28R3.69633104 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3 2230a_100000186920_100020672187 [0,1,0,0,0,0|3,0,0]=4 69 B28R3.69633104 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3 269982a_100000186920_100020672187 [0,1,0,0,0,0|3,0,0]=4 70 B28R3.69633104 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccncc3 2230a_100000186919_100020672187 [0,1,0,0,0,0|3,0,0]=4 71 B28R3.69633104 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccncc3 269982a_100000186919_100020672187 [0,1,0,0,0,0|3,0,0]=4 72 B28R3.69633104 Cn1c(=O)c2c(ncn2CCNC(C#N)Cc3ccccc3)n(c1=O)C 2230a_100000746547_100000039610 [0,1,0,0,0,0|0,0,1]=2 73 B28R3.69633104 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3ccccc3)n(c1=O)C 2230a_100000739027_100000039610 [0,1,0,0,0,0|0,0,0]=1 74 B28R3.69633104 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3cccnc3)n(c1=O)C 2230a_100000717814_100000039610 [0,1,0,0,0,0|1,0,0]=2 75 B28R3.69633104 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3ccncc3)n(c1=O)C 2230a_100000717866_100000039610 [0,1,0,0,0,0|1,0,0]=2 76 B28R3.69633104 Cn1c(=O)c2c(ncn2CCOC(CN)Cc3ccccc3)n(c1=O)C 34a_100000752270_100000039610 [0,1,0,0,0,0|1,0,0]=2 77 B28R3.69633104 Cn1c(=O)c2c(ncn2CCO[C@H](CCl)Cc3ccccc3)n(c1=O)C 7a_100000729385_100000039610 [0,1,0,0,0,0|1,0,0]=2 78 B28R3.69633104 Cn1c(=O)c2c(ncn2CCSC(C#N)Cc3ccccc3)n(c1=O)C 62a_100000039610_100000183401 [0,1,0,0,0,0|1,0,1]=3 79 B28R3.69633104 Cn1c(=O)c2c(ncn2CCSC(C#N)Cc3ccccc3)n(c1=O)C 62a_100000183401_100000039610 [0,1,0,0,0,0|1,0,1]=3 80 B28R3.560485714 CC(Cc1ccc(cc1)F)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011351027_100000039610 [0,1,0,0,0,0|1,0,0]=2 81 B28R3.560485714 CC(Cc1ccc(cc1)F)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011351027_100000039610 [0,1,0,0,0,0|1,0,0]=2 82 B28R3.560485714 CC(Cc1ccc(cc1)O)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100102634573_100000039610 [0,1,0,0,0,0|0,0,0]=1 83 B28R3.560485714 CC(Cc1ccc(cc1)O)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100102634573_100000039610 [0,1,0,0,0,0|0,0,0]=1 84 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Br 2230a_100000180866_100020672187 [0,1,0,0,0,0|2,0,0]=3 85 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Br 269982a_100000180866_100020672187 [0,1,0,0,0,0|2,0,0]=3 86 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Cl 2230a_100000184517_100020672187 [0,1,0,0,0,0|2,0,0]=3 87 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Cl 269982a_100000184517_100020672187 [0,1,0,0,0,0|2,0,0]=3 88 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Cl 34a_100000184517_100020672187 [0,1,0,0,0,0|2,0,0]=3 89 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 2230a_100000184576_100020672187 [0,1,0,0,0,0|2,0,0]=3 90 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 269982a_100000184576_100020672187 [0,1,0,0,0,0|2,0,0]=3 91 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 34a_100000184576_100020672187 [0,1,0,0,0,0|2,0,0]=3 92 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)O 2230a_100000207500_100020672187 [0,1,0,0,0,0|2,0,0]=3 93 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)O 269982a_100000207500_100020672187 [0,1,0,0,0,0|2,0,0]=3 94 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(nc3)Cl 2230a_100000026953_100020672187 [0,1,0,0,0,0|3,0,0]=4 95 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(nc3)Cl 269982a_100000026953_100020672187 [0,1,0,0,0,0|3,0,0]=4 96 B28R3.560485714 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(nc3)Cl 34a_100000026953_100020672187 [0,1,0,0,0,0|3,0,0]=4 97 B28R3.560485714 Cc1ccc(cc1)CC(=O)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000212244_100020672187 [0,1,0,0,0,0|2,0,1]=4 98 B28R3.560485714 Cc1ccc(cc1)CC(=O)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000689370_100000210814 [0,1,0,0,0,0|2,0,1]=4 99 B28R3.560485714 Cc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000744650_100020672187 [0,1,0,0,0,0|2,0,0]=3 100 B28R3.560485714 Cc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000744650_100020672187 [0,1,0,0,0,0|2,0,0]=3 101 B28R3.560485714 Cc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000744650_100020672187 [0,1,0,0,0,0|2,0,0]=3 102 B28R3.560485714 Cc1ccc(cn1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_106623407658_100020672187 [0,1,0,0,0,0|3,0,0]=4 103 B28R3.560485714 Cc1ccc(cn1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_106623407658_100020672187 [0,1,0,0,0,0|3,0,0]=4 104 B28R3.560485714 Cc1ccc(cn1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_106623407658_100020672187 [0,1,0,0,0,0|3,0,0]=4 105 B28R3.560485714 Cc1ccc(nc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_200000717808_100020672187 [0,1,0,0,0,0|3,0,0]=4 106 B28R3.560485714 Cc1ccc(nc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_200000717808_100020672187 [0,1,0,0,0,0|3,0,0]=4 107 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)Br)n(c1=O)C 1458a_100000198978_100020672187 [0,1,0,0,0,0|2,0,1]=4 108 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)Br)n(c1=O)C 1458a_100000689370_100000189115 [0,1,0,0,0,0|2,0,1]=4 109 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)Cl)n(c1=O)C 1458a_100000211027_100020672187 [0,1,0,0,0,0|2,0,1]=4 110 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)Cl)n(c1=O)C 1458a_100000689370_100000694040 [0,1,0,0,0,0|2,0,1]=4 111 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)F)n(c1=O)C 1458a_100000210951_100020672187 [0,1,0,0,0,0|2,0,1]=4 112 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)F)n(c1=O)C 1458a_100000689370_100000198546 [0,1,0,0,0,0|2,0,1]=4 113 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)I)n(c1=O)C 1458a_100000688869_100020672187 [0,1,0,0,0,0|2,0,1]=4 114 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)I)n(c1=O)C 1458a_100000689370_100000189116 [0,1,0,0,0,0|2,0,1]=4 115 B28R3.560485714 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccc(cc3)O)n(c1=O)C 1458a_100000198540_100020672187 [0,1,0,0,0,0|2,0,1]=4 116 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Br 2230a_100000184654_100020672187 [0,1,0,0,0,0|2,0,0]=3 117 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Br 269982a_100000184654_100020672187 [0,1,0,0,0,0|2,0,0]=3 118 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Cl 2230a_100000184507_100020672187 [0,1,0,0,0,0|2,0,0]=3 119 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Cl 269982a_100000184507_100020672187 [0,1,0,0,0,0|2,0,0]=3 120 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 2230a_100000742528_100020672187 [0,1,0,0,0,0|2,0,0]=3 121 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 269982a_100000742528_100020672187 [0,1,0,0,0,0|2,0,0]=3 122 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 34a_100000742528_100020672187 [0,1,0,0,0,0|2,0,0]=3 123 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3O 2230a_100015189988_100020672187 [0,1,0,0,0,0|2,0,0]=3 124 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3O 269982a_100015189988_100020672187 [0,1,0,0,0,0|2,0,0]=3 125 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3Cl 2230a_103496529121_100020672187 [0,1,0,0,0,0|3,0,0]=4 126 B28R3.1923195578 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3Cl 269982a_103496529121_100020672187 [0,1,0,0,0,0|3,0,0]=4 127 B28R3.1923195578 Cc1ccccc1CC(=O)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000212180_100020672187 [0,1,0,0,0,0|2,0,1]=4 128 B28R3.1923195578 Cc1ccccc1CC(=O)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000689370_100000211839 [0,1,0,0,0,0|2,0,1]=4 129 B28R3.1923195578 Cc1ccccc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000184421_100020672187 [0,1,0,0,0,0|2,0,0]=3 130 B28R3.1923195578 Cc1ccccc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000184421_100020672187 [0,1,0,0,0,0|2,0,0]=3 131 B28R3.1923195578 Cc1cnccc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100015187836_100020672187 [0,1,0,0,0,0|3,0,0]=4 132 B28R3.1923195578 Cc1cnccc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100015187836_100020672187 [0,1,0,0,0,0|3,0,0]=4 133 B28R3.1923195578 Cc1ncccc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_200011875998_100020672187 [0,1,0,0,0,0|3,0,0]=4 134 B28R3.1923195578 Cc1ncccc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_200011875998_100020672187 [0,1,0,0,0,0|3,0,0]=4 135 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3Br)n(c1=O)C 1458a_100000689370_100000184730 [0,1,0,0,0,0|2,0,1]=4 136 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3Br)n(c1=O)C 1458a_100000751119_100020672187 [0,1,0,0,0,0|2,0,1]=4 137 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3Cl)n(c1=O)C 1458a_100000183793_100020672187 [0,1,0,0,0,0|2,0,1]=4 138 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3Cl)n(c1=O)C 1458a_100000689370_100000187162 [0,1,0,0,0,0|2,0,1]=4 139 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3F)n(c1=O)C 1458a_100000212012_100020672187 [0,1,0,0,0,0|2,0,1]=4 140 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3F)n(c1=O)C 1458a_100000689370_100000187165 [0,1,0,0,0,0|2,0,1]=4 141 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3I)n(c1=O)C 1458a_100000036491_100020672187 [0,1,0,0,0,0|2,0,1]=4 142 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3I)n(c1=O)C 1458a_100000689370_100011216222 [0,1,0,0,0,0|2,0,1]=4 143 B28R3.1923195578 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3ccccc3O)n(c1=O)C 1458a_100000743006_100020672187 [0,1,0,0,0,0|2,0,1]=4 144 B28R3.2044155430 CC(Cc1ccccn1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_100000238496_100000499738 [0,1,0,0,0,0|1,0,1]=3 145 B28R3.2044155430 CC(Cc1ccccn1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_100000238496_100000499738 [0,1,0,0,0,0|1,0,1]=3 146 B28R3.2044155430 CC(Cc1ccccn1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100000238496_100000499738 [0,1,0,0,0,0|1,0,1]=3 147 B28R3.2044155430 CC(Cc1ccccn1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100000238496_100000499738 [0,1,0,0,0,0|1,0,1]=3 148 B28R3.2044155430 CC(Cc1cccnc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_100011207255_100000499738 [0,1,0,0,0,0|1,0,1]=3 149 B28R3.2044155430 CC(Cc1cccnc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_100011207255_100000499738 [0,1,0,0,0,0|1,0,1]=3 150 B28R3.2044155430 CC(Cc1cccnc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100011207255_100000499738 [0,1,0,0,0,0|1,0,1]=3 151 B28R3.2044155430 CC(Cc1cccnc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100011207255_100000499738 [0,1,0,0,0,0|1,0,1]=3 152 B28R3.2044155430 CC(Cc1cnccn1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_100011277835_100000499738 [0,1,0,0,0,0|2,0,1]=4 153 B28R3.2044155430 CC(Cc1cnccn1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_100011277835_100000499738 [0,1,0,0,0,0|2,0,1]=4 154 B28R3.2044155430 CC(Cc1cnccn1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100011277835_100000499738 [0,1,0,0,0,0|2,0,1]=4 155 B28R3.2044155430 CC(Cc1cnccn1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100011277835_100000499738 [0,1,0,0,0,0|2,0,1]=4 156 B28R3.2044155431 C/C(=C\c1ccccc1)/C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100016990649_100000039610 [0,1,0,0,0,0|1,0,2]=4 157 B28R3.2044155431 CC(Cc1ccccc1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000754839_100000039610 [0,1,0,0,0,0|1,0,0]=2 158 B28R3.2044155431 CC(Cc1ccccn1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100012000792_100000039610 [0,1,0,0,0,0|2,0,0]=3 159 B28R3.2044155431 CC(Cc1ccccn1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_200011351704_100000039610 [0,1,0,0,0,0|1,0,0]=2 160 B28R3.2044155431 CC(Cc1ccccn1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_200011351704_100000039610 [0,1,0,0,0,0|1,0,0]=2 161 B28R3.2044155431 CC(Oc1ccccc1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000188414_100000039610 [0,1,0,0,0,0|2,0,0]=3 162 B28R3.2044155431 CC(Sc1ccccc1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000199063_100000039610 [0,1,0,0,0,0|2,0,0]=3 163 B28R3.2044155431 CC(Sc1ccccn1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000156770_100000039610 [0,1,0,0,0,0|3,0,0]=4 164 B28R3.2044155431 Cn1c(=O)c2c(ncn2CCC(=O)[C@H](O)Cc3ccccc3)n(c1=O)C 1458a_100009816399_100000039610 [0,1,0,0,0,0|2,0,0]=3 165 B28R3.2044155471 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3ccccc3)n(c1=O)C 7a_100011215222_100000039610 [0,1,0,0,0,0|1,0,0]=2 166 B28R3.2044155471 Cn1c(=O)c2c(ncn2CCSC(F)(F)Oc3ccccc3)n(c1=O)C 62a_100000039610_200000057402 [0,1,0,0,0,0|3,0,0]=4 167 B28R3.2044155471 Cn1c(=O)c2c(ncn2CCSC(F)(F)Oc3ccccc3)n(c1=O)C 62a_200000057402_100000039610 [0,1,0,0,0,0|3,0,0]=4 168 B28R3.2044155479 CC(C(=O)CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 1458a_100000689370_100000230085 [0,1,0,0,0,0|2,0,1]=4 169 B28R3.2044155479 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccccc3 62a_100000039610_100000239700 [0,1,0,0,0,0|1,0,1]=3 170 B28R3.2044155479 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccccc3 62a_100000239700_100000039610 [0,1,0,0,0,0|1,0,1]=3 171 B28R3.2044155479 CC(c1ccccc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000195388_100020672187 [0,1,0,0,0,0|2,0,0]=3 172 B28R3.2044155479 CC(c1ccccc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000195388_100020672187 [0,1,0,0,0,0|2,0,0]=3 173 B28R3.2044155479 CC(c1ccccn1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000231138_100020672187 [0,1,0,0,0,0|3,0,0]=4 174 B28R3.2044155479 CC(c1ccccn1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000231138_100020672187 [0,1,0,0,0,0|3,0,0]=4 175 B28R3.2044155479 CC(c1cccnc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000232774_100020672187 [0,1,0,0,0,0|3,0,0]=4 176 B28R3.2044155479 CC(c1cccnc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000232774_100020672187 [0,1,0,0,0,0|3,0,0]=4 177 B28R3.2044155479 CC(c1ccncc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000231139_100020672187 [0,1,0,0,0,0|3,0,0]=4 178 B28R3.2044155479 CC(c1ccncc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000231139_100020672187 [0,1,0,0,0,0|3,0,0]=4 179 B28R3.2044155479 C[C@H](C(=O)CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 1458a_100000751047_100020672187 [0,1,0,0,0,0|2,0,1]=4 180 B28R3.2044155479 C[C@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)[C@@H](N)c3ccccc3 34a_100134616770_100000039610 [0,1,0,0,0,0|1,0,0]=2 181 B28R3.2044155479 Cn1c(=O)c2c(ncn2CCCC(=O)C(F)c3ccccc3)n(c1=O)C 1458a_100000698975_100020672187 [0,1,0,0,0,0|2,0,1]=4 182 B28R3.2044155479 Cn1c(=O)c2c(ncn2CCCC(=O)[C@H](O)c3ccccc3)n(c1=O)C 1458a_100000684486_100020672187 [0,1,0,0,0,0|2,0,1]=4 183 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccn3)Cl 2230a_100102954512_100020672187 [0,1,0,0,0,0|3,0,0]=4 184 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccn3)Cl 269982a_100102954512_100020672187 [0,1,0,0,0,0|3,0,0]=4 185 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Br 2230a_100000187585_100020672187 [0,1,0,0,0,0|2,0,0]=3 186 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Br 269982a_100000187585_100020672187 [0,1,0,0,0,0|2,0,0]=3 187 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Cl 2230a_100020629429_100020672187 [0,1,0,0,0,0|2,0,0]=3 188 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Cl 269982a_100020629429_100020672187 [0,1,0,0,0,0|2,0,0]=3 189 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 2230a_100000184398_100020672187 [0,1,0,0,0,0|2,0,0]=3 190 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 269982a_100000184398_100020672187 [0,1,0,0,0,0|2,0,0]=3 191 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 34a_100000184398_100020672187 [0,1,0,0,0,0|2,0,0]=3 192 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)O 2230a_100000207540_100020672187 [0,1,0,0,0,0|2,0,0]=3 193 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)O 269982a_100000207540_100020672187 [0,1,0,0,0,0|2,0,0]=3 194 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(n3)Br 2230a_106354212997_100020672187 [0,1,0,0,0,0|3,0,0]=4 195 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(n3)Br 269982a_106354212997_100020672187 [0,1,0,0,0,0|3,0,0]=4 196 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cncc(c3)Br 2230a_103549770560_100020672187 [0,1,0,0,0,0|3,0,0]=4 197 B28R3.2250708580 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cncc(c3)Br 269982a_103549770560_100020672187 [0,1,0,0,0,0|3,0,0]=4 198 B28R3.2250708580 Cc1cccc(c1)CC(=O)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000689370_100000211840 [0,1,0,0,0,0|2,0,1]=4 199 B28R3.2250708580 Cc1cccc(c1)CC(=O)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100011206899_100020672187 [0,1,0,0,0,0|2,0,1]=4 200 B28R3.2250708580 Cc1cccc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_102495364743_100020672187 [0,1,0,0,0,0|2,0,0]=3 201 B28R3.2250708580 Cc1cccc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_102495364743_100020672187 [0,1,0,0,0,0|2,0,0]=3 202 B28R3.2250708580 Cc1cccc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_102495364743_100020672187 [0,1,0,0,0,0|2,0,0]=3 203 B28R3.2250708580 Cc1cccc(n1)CC(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200015421231_100000039610 [0,1,0,0,0,0|2,0,0]=3 204 B28R3.2250708580 Cc1cccc(n1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000687132_100020672187 [0,1,0,0,0,0|3,0,0]=4 205 B28R3.2250708580 Cc1cccc(n1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000687132_100020672187 [0,1,0,0,0,0|3,0,0]=4 206 B28R3.2250708580 Cc1ccnc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_106354213154_100020672187 [0,1,0,0,0,0|3,0,0]=4 207 B28R3.2250708580 Cc1ccnc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_106354213154_100020672187 [0,1,0,0,0,0|3,0,0]=4 208 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)Br)n(c1=O)C 1458a_100000689370_100000211773 [0,1,0,0,0,0|2,0,1]=4 209 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)Br)n(c1=O)C 1458a_100000747190_100020672187 [0,1,0,0,0,0|2,0,1]=4 210 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)Cl)n(c1=O)C 1458a_100000689370_100000181238 [0,1,0,0,0,0|2,0,1]=4 211 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)Cl)n(c1=O)C 1458a_100000749307_100020672187 [0,1,0,0,0,0|2,0,1]=4 212 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)F)n(c1=O)C 1458a_100000211661_100020672187 [0,1,0,0,0,0|2,0,1]=4 213 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)F)n(c1=O)C 1458a_100000689370_100000230114 [0,1,0,0,0,0|2,0,1]=4 214 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)I)n(c1=O)C 1458a_100000238430_100020672187 [0,1,0,0,0,0|2,0,1]=4 215 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)I)n(c1=O)C 1458a_100000689370_100011218688 [0,1,0,0,0,0|2,0,1]=4 216 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)O)n(c1=O)C 1458a_100000689370_100011660834 [0,1,0,0,0,0|2,0,1]=4 217 B28R3.2250708580 Cn1c(=O)c2c(ncn2CCCC(=O)Cc3cccc(c3)O)n(c1=O)C 1458a_100000745134_100020672187 [0,1,0,0,0,0|2,0,1]=4 218 B28R4.1552254667 Cn1c(=O)c2c(ncn2CCN[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 2230a_100020588832_100000039610 [0,0,0,1,0,0|0,0,0]=1 219 B28R4.1552254667 Cn1c(=O)c2c(ncn2CCN[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 34a_100020588832_100000039610 [0,0,0,1,0,0|0,0,0]=1 220 B28R4.1552254672 Cn1c(=O)c2c(ncn2CCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 2230a_100016998360_100000039610 [0,0,0,1,0,0|0,0,0]=1 221 B28R4.1552254672 Cn1c(=O)c2c(ncn2CCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 269982a_100016998360_100000039610 [0,0,0,1,0,0|0,0,0]=1 222 B28R4.1552254672 Cn1c(=O)c2c(ncn2CCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 34a_100016998360_100000039610 [0,0,0,1,0,0|0,0,0]=1 223 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCCN3Cc4ccccc4C3)n(c1=O)C 2230a_100000752595_100020672187 [0,0,0,1,0,0|2,0,0]=3 224 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCCN3Cc4ccccc4C3)n(c1=O)C 269982a_100000752595_100020672187 [0,0,0,1,0,0|2,0,0]=3 225 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCCN3Cc4ccccc4C3)n(c1=O)C 34a_100000752595_100020672187 [0,0,0,1,0,0|2,0,0]=3 226 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCCN3Cc4cccnc4C3)n(c1=O)C 269982a_100000726175_100020672187 [0,0,0,1,0,0|3,0,0]=4 227 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCCN3Cc4ccncc4C3)n(c1=O)C 2230a_100000730608_100020672187 [0,0,0,1,0,0|3,0,0]=4 228 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCCN3Cc4ccncc4C3)n(c1=O)C 269982a_100000730608_100020672187 [0,0,0,1,0,0|3,0,0]=4 229 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCNC3Cc4ccccc4C3)n(c1=O)C 2230a_100000753258_100000039610 [0,0,0,1,0,0|0,0,0]=1 230 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCNC3Cc4ccccc4C3)n(c1=O)C 34a_100000753258_100000039610 [0,0,0,1,0,0|0,0,0]=1 231 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCOC3Cc4ccccc4C3)n(c1=O)C 34a_100011215286_100000039610 [0,0,0,1,0,0|1,0,0]=2 232 B28R4.1552834511 Cn1c(=O)c2c(ncn2CCSC3Cc4ccccc4C3)n(c1=O)C 62a_100000039610_100000753484 [0,0,0,1,0,0|1,0,0]=2 233 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 2230a_100000186898_100000039610 [0,0,0,0,1,0|1,0,0]=2 234 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 269982a_100000186898_100000039610 [0,0,0,0,1,0|1,0,0]=2 235 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccn3 2230a_100000207498_100000039610 [0,0,0,0,1,0|2,0,0]=3 236 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccn3 269982a_100000207498_100000039610 [0,0,0,0,1,0|2,0,0]=3 237 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3 2230a_100000184577_100000039610 [0,0,0,0,1,0|2,0,0]=3 238 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3 269982a_100000184577_100000039610 [0,0,0,0,1,0|2,0,0]=3 239 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccncc3 2230a_100000187231_100000039610 [0,0,0,0,1,0|2,0,0]=3 240 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccncc3 269982a_100000187231_100000039610 [0,0,0,0,1,0|2,0,0]=3 241 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cnccn3 2230a_100011269079_100000039610 [0,0,0,0,1,0|3,0,0]=4 242 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cnccn3 269982a_100011269079_100000039610 [0,0,0,0,1,0|3,0,0]=4 243 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ncccn3 2230a_100025716638_100000039610 [0,0,0,0,1,0|3,0,0]=4 244 B26R3.535608627 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ncccn3 269982a_100025716638_100000039610 [0,0,0,0,1,0|3,0,0]=4 245 B26R3.535608627 Cn1c(=O)c2c(ncn2CCC(=O)C[n+]3ccccc3)n(c1=O)C 1458a_200000086051_100000039610 [0,0,0,0,1,0|2,0,1]=4 246 B26R3.535608627 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccccn3)n(c1=O)C 1458a_100000233486_100000039610 [0,0,0,0,1,0|2,0,1]=4 247 B26R3.535608627 Cn1c(=O)c2c(ncn2CCC(=O)Cc3cccnc3)n(c1=O)C 1458a_100000737805_100000039610 [0,0,0,0,1,0|2,0,1]=4 248 B26R3.536012707 CC(Cc1ccco1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011803939_100000039610 [0,0,0,0,1,0|2,0,0]=3 249 B26R3.536012707 CC(Cc1ccco1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011803939_100000039610 [0,0,0,0,1,0|2,0,0]=3 250 B26R3.536012707 CC(Cc1cccs1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000751415_100000039610 [0,0,0,0,1,0|1,0,0]=2 251 B26R3.536012707 CC(Cc1ccsc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000743546_100000039610 [0,0,0,0,1,0|1,0,0]=2 252 B26R3.536012707 CC(Cc1ccsc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000743546_100000039610 [0,0,0,0,1,0|1,0,0]=2 253 B26R3.536012707 CC(Cn1cccn1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000738251_100000039610 [0,0,0,0,1,0|2,0,0]=3 254 B26R3.536012707 CC(Cn1cncn1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011201177_100000039610 [0,0,0,0,1,0|3,0,0]=4 255 B26R3.536012707 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccco3 2230a_100000185268_100020672187 [0,0,0,0,1,0|3,0,0]=4 256 B26R3.536012707 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccco3 269982a_100000185268_100020672187 [0,0,0,0,1,0|3,0,0]=4 257 B26R3.536012707 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccs3 2230a_100000184426_100020672187 [0,0,0,0,1,0|3,0,0]=4 258 B26R3.536012707 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccs3 269982a_100000184426_100020672187 [0,0,0,0,1,0|3,0,0]=4 259 B26R3.536012707 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccsc3 2230a_100020654213_100020672187 [0,0,0,0,1,0|3,0,0]=4 260 B26R3.536012707 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccsc3 269982a_100020654213_100020672187 [0,0,0,0,1,0|3,0,0]=4 261 B26R3.536012730 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccn3 2230a_100000181244_100000039610 [0,0,0,0,1,0|1,0,0]=2 262 B26R3.536012730 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccnc3 2230a_100000195435_100000039610 [0,0,0,0,1,0|1,0,0]=2 263 B26R3.536012730 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccncc3 2230a_100000181269_100000039610 [0,0,0,0,1,0|1,0,0]=2 264 B26R3.536012730 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ncccn3 2230a_100020641698_100000039610 [0,0,0,0,1,0|2,0,0]=3 265 B26R3.536012730 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 62a_100000039610_100000230085 [0,0,0,0,1,0|1,0,0]=2 266 B26R3.536012730 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 62a_100000230085_100000039610 [0,0,0,0,1,0|1,0,0]=2 267 B26R3.536012730 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cnccn3 62a_100000039610_200000703233 [0,0,0,0,1,0|3,0,0]=4 268 B26R3.536012730 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cnccn3 62a_200000703233_100000039610 [0,0,0,0,1,0|3,0,0]=4 269 B26R3.536012730 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 2230a_100000210012_100020672187 [0,0,0,0,1,0|2,0,0]=3 270 B26R3.536012730 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 269982a_100000210012_100020672187 [0,0,0,0,1,0|2,0,0]=3 271 B26R3.536012730 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100000210012_100020672187 [0,0,0,0,1,0|2,0,0]=3 272 B26R3.536012730 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 2230a_100000751104_100000039610 [0,0,0,0,1,0|0,0,0]=1 273 B26R3.536012730 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cnccn3 2230a_100020589798_100000039610 [0,0,0,0,1,0|2,0,0]=3 274 B26R3.536012730 C[C@@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100000761318_100000039610 [0,0,0,0,1,0|1,0,0]=2 275 B26R3.536012730 C[C@@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 7a_100000761318_100000039610 [0,0,0,0,1,0|1,0,0]=2 276 B26R3.536012730 Cn1c(=O)c2c(ncn2CCCC(=O)c3ccccc3)n(c1=O)C 1458a_100000185807_100020672187 [0,0,0,0,1,0|2,0,1]=4 277 B28R3.2044155435 CC(C#Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200000065209_100000039610 [0,0,0,0,0,1|1,0,1]=3 278 B28R3.2044155435 CC(C#Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200000065209_100000039610 [0,0,0,0,0,1|1,0,1]=3 279 B28R3.2044155435 CC(CCc1ccccc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000210798_100000039610 [0,0,0,0,0,1|0,0,0]=1 280 B28R3.2044155435 CC(CCc1ccccc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000210798_100000039610 [0,0,0,0,0,1|0,0,0]=1 281 B28R3.2044155435 CC(COc1ccccc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000746794_100000039610 [0,0,0,0,0,1|0,0,0]=1 282 B28R3.2044155435 CC(COc1ccccc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000746794_100000039610 [0,0,0,0,0,1|0,0,0]=1 283 B28R3.2044155435 CC(COc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000210911_100000039610 [0,0,0,0,0,1|1,0,0]=2 284 B28R3.2044155435 CC(COc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000210911_100000039610 [0,0,0,0,0,1|1,0,0]=2 285 B28R3.2044155435 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccc3 2230a_100000207497_100020672187 [0,0,0,0,0,1|2,0,0]=3 286 B28R3.2044155435 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccc3 269982a_100000207497_100020672187 [0,0,0,0,0,1|2,0,0]=3 287 B28R3.2044155435 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccn3 2230a_100000737206_100020672187 [0,0,0,0,0,1|3,0,0]=4 288 B28R3.2044155435 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccn3 269982a_100000737206_100020672187 [0,0,0,0,0,1|3,0,0]=4 289 B28R3.2044155435 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3cccnc3 2230a_100000763209_100020672187 [0,0,0,0,0,1|3,0,0]=4 290 B28R3.2044155435 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3cccnc3 269982a_100000763209_100020672187 [0,0,0,0,0,1|3,0,0]=4 291 B28R3.2044155435 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccncc3 2230a_100000742850_100020672187 [0,0,0,0,0,1|3,0,0]=4 292 B28R3.2044155435 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccncc3 269982a_100000742850_100020672187 [0,0,0,0,0,1|3,0,0]=4 293 B28R3.2044155435 C[C@@H](CCc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100009815974_100000039610 [0,0,0,0,0,1|1,0,0]=2 294 B28R3.2044155435 C[C@@H](CCc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100009815974_100000039610 [0,0,0,0,0,1|1,0,0]=2 295 B28R3.2044155435 Cn1c(=O)c2c(ncn2CCCC(=O)CCc3ccccc3)n(c1=O)C 1458a_100000185753_100020672187 [0,0,0,0,0,1|2,0,1]=4 296 B28R3.2044155435 Cn1c(=O)c2c(ncn2CCCC(=O)CCc3ccccc3)n(c1=O)C 1458a_100000689370_100000765856 [0,0,0,0,0,1|2,0,1]=4 297 B28R3.2044155435 Cn1c(=O)c2c(ncn2CCCC(=O)COc3ccccc3)n(c1=O)C 1458a_100000186222_100020672187 [0,0,0,0,0,1|2,0,1]=4 298 B28R3.2044155435 Cn1c(=O)c2c(ncn2CCCC(=O)CSc3ccccc3)n(c1=O)C 1458a_100000211596_100020672187 [0,0,0,0,0,1|2,0,1]=4 299 B28R3.2044155435 Cn1c(=O)c2c(ncn2CCCC(=O)NCc3ccccc3)n(c1=O)C 11a_100015324214_100000689370 [0,0,0,0,0,1|2,0,1]=4 300 B28R3.2044155435 Cn1c(=O)c2c(ncn2CCCC(=O)NCc3ccccc3)n(c1=O)C 1626a_100015324214_100000689370 [0,0,0,0,0,1|2,0,1]=4 301 B28R3.2044155435 Cn1c(=O)c2c(ncn2CCCC(=O)NCc3ccccc3)n(c1=O)C 240690a_100015324214_100000689370 [0,0,0,0,0,1|2,0,1]=4 302 B28R3.2044155474 C/C(=C\c1ccccc1)/COCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200025717232_100000039610 [0,0,0,0,0,1|1,0,2]=4 303 B28R3.2044155474 C/C(=C\c1ccccc1)/COCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200025717232_100000039610 [0,0,0,0,0,1|1,0,2]=4 304 B28R3.2044155474 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 2230a_100000755676_100000039610 [0,0,0,0,0,1|1,0,0]=2 305 B28R3.2044155474 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 34a_100000755676_100000039610 [0,0,0,0,0,1|1,0,0]=2 306 B28R3.2044155474 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3cccnc3 2230a_200011219418_100000039610 [0,0,0,0,0,1|2,0,0]=3 307 B28R3.2044155474 CC(COCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 34a_100012125295_100000039610 [0,0,0,0,0,1|1,0,0]=2 308 B28R3.2044155474 CC(COCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 7a_100012125295_100000039610 [0,0,0,0,0,1|1,0,0]=2 309 B28R3.2044155474 CC(COCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 34a_200000036796_100000039610 [0,0,0,0,0,1|2,0,0]=3 310 B28R3.2044155474 CC(COCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 7a_200000036796_100000039610 [0,0,0,0,0,1|2,0,0]=3 311 B28R3.2044155474 CC(Cc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000748627_100020672187 [0,0,0,0,0,1|1,0,0]=2 312 B28R3.2044155474 CC(Cc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000748627_100020672187 [0,0,0,0,0,1|1,0,0]=2 313 B28R3.2044155474 CC(Cc1ccccc1)SCCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100020672187_200011218536 [0,0,0,0,0,1|1,0,0]=2 314 B28R3.2044155474 CC(Cc1ccccc1)SCCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_200011218536_100020672187 [0,0,0,0,0,1|1,0,0]=2 315 B28R3.2044155474 CC(Cc1ccccn1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000238496_100020672187 [0,0,0,0,0,1|1,0,0]=2 316 B28R3.2044155474 CC(Cc1cccnc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011207255_100020672187 [0,0,0,0,0,1|1,0,0]=2 317 B28R3.2044155474 CC(Cc1cnccn1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011277835_100020672187 [0,0,0,0,0,1|2,0,0]=3 318 B28R3.2044155474 Cn1c(=O)c2c(ncn2CCNCC(O)Cc3ccccc3)n(c1=O)C 2230a_100000752270_100000039610 [0,0,0,0,0,1|1,0,0]=2 319 B28R3.2044155474 Cn1c(=O)c2c(ncn2CCOCC(N)Cc3ccccc3)n(c1=O)C 34a_100000739027_100000039610 [0,0,0,0,0,1|2,0,0]=3 320 B28R3.2044155474 Cn1c(=O)c2c(ncn2CCSCC(=O)Cc3ccccc3)n(c1=O)C 62a_100000039610_100000233483 [0,0,0,0,0,1|2,0,1]=4 321 B28R3.2044155474 Cn1c(=O)c2c(ncn2CCSCC(=O)Cc3ccccc3)n(c1=O)C 62a_100000233483_100000039610 [0,0,0,0,0,1|2,0,1]=4 322 B28R3.2044155474 Cn1c(=O)c2c(ncn2CCSC[C@@H](O)Cc3ccccc3)n(c1=O)C 62a_100000039610_100000729385 [0,0,0,0,0,1|2,0,0]=3 323 B28R3.2044155474 Cn1c(=O)c2c(ncn2CCSC[C@@H](O)Cc3ccccc3)n(c1=O)C 62a_100000729385_100000039610 [0,0,0,0,0,1|2,0,0]=3 324 B27R3.165843881 Cc1cccc(c1)CCNCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000749837_100000039610 [1,1,0,0,0,0|0,0,0]=2 325 B27R3.165843881 Cc1cccc(c1)CCNCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000749837_100000039610 [1,1,0,0,0,0|0,0,0]=2 326 B27R3.165843881 Cc1cccc(c1)CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011217157_100000039610 [1,1,0,0,0,0|1,0,0]=3 327 B27R3.165843881 Cc1cccc(c1)CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011217157_100000039610 [1,1,0,0,0,0|1,0,0]=3 328 B27R3.165843881 Cc1cccc(c1)CCSCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000039610_100011713685 [1,1,0,0,0,0|1,0,0]=3 329 B27R3.165843881 Cc1cccc(c1)CCSCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100011713685_100000039610 [1,1,0,0,0,0|1,0,0]=3 330 B27R3.165843881 Cc1cccc(c1)CNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000185548_100020672187 [1,1,0,0,0,0|2,0,0]=4 331 B27R3.165843881 Cc1cccc(c1)CNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000185548_100020672187 [1,1,0,0,0,0|2,0,0]=4 332 B27R3.165843881 Cc1cccc(c1)COCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011217746_100020672187 [1,1,0,0,0,0|2,0,0]=4 333 B27R3.165843881 Cc1cccc(c1)COCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011217746_100020672187 [1,1,0,0,0,0|2,0,0]=4 334 B27R3.165843881 Cc1cccc(c1)CSCCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000211840_100020672187 [1,1,0,0,0,0|2,0,0]=4 335 B27R3.165843881 Cc1cccc(c1)CSCCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100020672187_100000211840 [1,1,0,0,0,0|2,0,0]=4 336 B27R3.165843881 Cc1cccc(n1)CCNCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011824523_100000039610 [1,1,0,0,0,0|1,0,0]=3 337 B27R3.165843881 Cc1cccc(n1)CCNCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011824523_100000039610 [1,1,0,0,0,0|1,0,0]=3 338 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)Br)n(c1=O)C 2230a_100000174977_100020672187 [1,1,0,0,0,0|2,0,0]=4 339 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)Br)n(c1=O)C 34a_100000174977_100020672187 [1,1,0,0,0,0|2,0,0]=4 340 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)Cl)n(c1=O)C 2230a_100000174878_100020672187 [1,1,0,0,0,0|2,0,0]=4 341 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)Cl)n(c1=O)C 34a_100000174878_100020672187 [1,1,0,0,0,0|2,0,0]=4 342 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)F)n(c1=O)C 2230a_100000174948_100020672187 [1,1,0,0,0,0|2,0,0]=4 343 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)F)n(c1=O)C 34a_100000174948_100020672187 [1,1,0,0,0,0|2,0,0]=4 344 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)I)n(c1=O)C 2230a_100000106179_100020672187 [1,1,0,0,0,0|2,0,0]=4 345 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)I)n(c1=O)C 34a_100000106179_100020672187 [1,1,0,0,0,0|2,0,0]=4 346 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)O)n(c1=O)C 2230a_100000743036_100020672187 [1,1,0,0,0,0|2,0,0]=4 347 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCNCc3cccc(c3)O)n(c1=O)C 34a_100000743036_100020672187 [1,1,0,0,0,0|2,0,0]=4 348 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)Br)n(c1=O)C 34a_100000687537_100020672187 [1,1,0,0,0,0|2,0,0]=4 349 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)Br)n(c1=O)C 7a_100000687537_100020672187 [1,1,0,0,0,0|2,0,0]=4 350 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)Cl)n(c1=O)C 34a_100000241301_100020672187 [1,1,0,0,0,0|2,0,0]=4 351 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)Cl)n(c1=O)C 7a_100000241301_100020672187 [1,1,0,0,0,0|2,0,0]=4 352 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)F)n(c1=O)C 34a_100000210976_100020672187 [1,1,0,0,0,0|2,0,0]=4 353 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)F)n(c1=O)C 7a_100000210976_100020672187 [1,1,0,0,0,0|2,0,0]=4 354 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)I)n(c1=O)C 34a_100011215336_100020672187 [1,1,0,0,0,0|2,0,0]=4 355 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)I)n(c1=O)C 7a_100011215336_100020672187 [1,1,0,0,0,0|2,0,0]=4 356 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCOCc3cccc(c3)N)n(c1=O)C 34a_100000211919_100020672187 [1,1,0,0,0,0|2,0,0]=4 357 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)Br)n(c1=O)C 62a_100000211773_100020672187 [1,1,0,0,0,0|2,0,0]=4 358 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)Br)n(c1=O)C 62a_100020672187_100000211773 [1,1,0,0,0,0|2,0,0]=4 359 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)Cl)n(c1=O)C 62a_100000187163_100020672187 [1,1,0,0,0,0|2,0,0]=4 360 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)Cl)n(c1=O)C 62a_100020672187_100000187163 [1,1,0,0,0,0|2,0,0]=4 361 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)F)n(c1=O)C 62a_100000230114_100020672187 [1,1,0,0,0,0|2,0,0]=4 362 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)F)n(c1=O)C 62a_100020672187_100000230114 [1,1,0,0,0,0|2,0,0]=4 363 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)I)n(c1=O)C 62a_100011218688_100020672187 [1,1,0,0,0,0|2,0,0]=4 364 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)I)n(c1=O)C 62a_100020672187_100011218688 [1,1,0,0,0,0|2,0,0]=4 365 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)O)n(c1=O)C 62a_100011660834_100020672187 [1,1,0,0,0,0|2,0,0]=4 366 B27R3.165843881 Cn1c(=O)c2c(ncn2CCCSCc3cccc(c3)O)n(c1=O)C 62a_100020672187_100011660834 [1,1,0,0,0,0|2,0,0]=4 367 B27R3.165843881 Cn1c(=O)c2c(ncn2CCNCCc3cccc(c3)Br)n(c1=O)C 2230a_100011207229_100000039610 [1,1,0,0,0,0|0,0,0]=2 368 B27R3.165843881 Cn1c(=O)c2c(ncn2CCNCCc3cccc(c3)Br)n(c1=O)C 34a_100011207229_100000039610 [1,1,0,0,0,0|0,0,0]=2 369 B27R3.165843881 Cn1c(=O)c2c(ncn2CCNCCc3cccc(c3)Cl)n(c1=O)C 2230a_100000185263_100000039610 [1,1,0,0,0,0|0,0,0]=2 370 B27R3.165843881 Cn1c(=O)c2c(ncn2CCNCCc3cccc(c3)Cl)n(c1=O)C 34a_100000185263_100000039610 [1,1,0,0,0,0|0,0,0]=2 371 B27R3.165843881 Cn1c(=O)c2c(ncn2CCNCCc3cccc(c3)F)n(c1=O)C 2230a_100000205154_100000039610 [1,1,0,0,0,0|0,0,0]=2 372 B27R3.165843881 Cn1c(=O)c2c(ncn2CCNCCc3cccc(c3)F)n(c1=O)C 34a_100000205154_100000039610 [1,1,0,0,0,0|0,0,0]=2 373 B27R3.165843881 Cn1c(=O)c2c(ncn2CCNCCc3cccc(c3)O)n(c1=O)C 2230a_100000747277_100000039610 [1,1,0,0,0,0|0,0,0]=2 374 B27R3.165843881 Cn1c(=O)c2c(ncn2CCNCCc3cccc(c3)O)n(c1=O)C 34a_100000747277_100000039610 [1,1,0,0,0,0|0,0,0]=2 375 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(c3)Br)n(c1=O)C 34a_100011217444_100000039610 [1,1,0,0,0,0|1,0,0]=3 376 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(c3)Br)n(c1=O)C 7a_100011217444_100000039610 [1,1,0,0,0,0|1,0,0]=3 377 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(c3)Cl)n(c1=O)C 34a_100000754733_100000039610 [1,1,0,0,0,0|1,0,0]=3 378 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(c3)Cl)n(c1=O)C 7a_100000754733_100000039610 [1,1,0,0,0,0|1,0,0]=3 379 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(c3)F)n(c1=O)C 34a_100000763591_100000039610 [1,1,0,0,0,0|1,0,0]=3 380 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(c3)F)n(c1=O)C 7a_100000763591_100000039610 [1,1,0,0,0,0|1,0,0]=3 381 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(c3)N)n(c1=O)C 34a_100011996697_100000039610 [1,1,0,0,0,0|1,0,0]=3 382 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(n3)Br)n(c1=O)C 34a_100010221043_100000039610 [1,1,0,0,0,0|2,0,0]=4 383 B27R3.165843881 Cn1c(=O)c2c(ncn2CCOCCc3cccc(n3)Br)n(c1=O)C 7a_100010221043_100000039610 [1,1,0,0,0,0|2,0,0]=4 384 B27R3.165843881 Cn1c(=O)c2c(ncn2CCSCCc3cccc(c3)Br)n(c1=O)C 62a_100000039610_100011740638 [1,1,0,0,0,0|1,0,0]=3 385 B27R3.165843881 Cn1c(=O)c2c(ncn2CCSCCc3cccc(c3)Br)n(c1=O)C 62a_100011740638_100000039610 [1,1,0,0,0,0|1,0,0]=3 386 B27R3.165843881 Cn1c(=O)c2c(ncn2CCSCCc3cccc(c3)Cl)n(c1=O)C 62a_100000039610_100011713710 [1,1,0,0,0,0|1,0,0]=3 387 B27R3.165843881 Cn1c(=O)c2c(ncn2CCSCCc3cccc(c3)Cl)n(c1=O)C 62a_100011713710_100000039610 [1,1,0,0,0,0|1,0,0]=3 388 B27R3.165843881 Cn1c(=O)c2c(ncn2CCSCCc3cccc(c3)F)n(c1=O)C 62a_100000039610_100011217235 [1,1,0,0,0,0|1,0,0]=3 389 B27R3.165843881 Cn1c(=O)c2c(ncn2CCSCCc3cccc(c3)F)n(c1=O)C 62a_100011217235_100000039610 [1,1,0,0,0,0|1,0,0]=3 390 B27R3.171769346 Cc1ccccc1CCNCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000685071_100000039610 [1,1,0,0,0,0|0,0,0]=2 391 B27R3.171769346 Cc1ccccc1CCNCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000685071_100000039610 [1,1,0,0,0,0|0,0,0]=2 392 B27R3.171769346 Cc1ccccc1CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011220023_100000039610 [1,1,0,0,0,0|1,0,0]=3 393 B27R3.171769346 Cc1ccccc1CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011220023_100000039610 [1,1,0,0,0,0|1,0,0]=3 394 B27R3.171769346 Cc1ccccc1CCSCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000039610_100011713688 [1,1,0,0,0,0|1,0,0]=3 395 B27R3.171769346 Cc1ccccc1CCSCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100011713688_100000039610 [1,1,0,0,0,0|1,0,0]=3 396 B27R3.171769346 Cc1ccccc1CNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000174972_100020672187 [1,1,0,0,0,0|2,0,0]=4 397 B27R3.171769346 Cc1ccccc1COCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000698903_100020672187 [1,1,0,0,0,0|2,0,0]=4 398 B27R3.171769346 Cc1ccccc1COCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000698903_100020672187 [1,1,0,0,0,0|2,0,0]=4 399 B27R3.171769346 Cc1ccccc1CSCCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000211839_100020672187 [1,1,0,0,0,0|2,0,0]=4 400 B27R3.171769346 Cc1ccccc1CSCCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100020672187_100000211839 [1,1,0,0,0,0|2,0,0]=4 401 B27R3.171769346 Cc1cccnc1CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011997706_100000039610 [1,1,0,0,0,0|2,0,0]=4 402 B27R3.171769346 Cc1cccnc1CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011997706_100000039610 [1,1,0,0,0,0|2,0,0]=4 403 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCNCc3ccccc3Br)n(c1=O)C 2230a_100000689332_100020672187 [1,1,0,0,0,0|2,0,0]=4 404 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCNCc3ccccc3Br)n(c1=O)C 34a_100000689332_100020672187 [1,1,0,0,0,0|2,0,0]=4 405 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCNCc3ccccc3Cl)n(c1=O)C 2230a_100000174879_100020672187 [1,1,0,0,0,0|2,0,0]=4 406 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCNCc3ccccc3Cl)n(c1=O)C 34a_100000174879_100020672187 [1,1,0,0,0,0|2,0,0]=4 407 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCNCc3ccccc3F)n(c1=O)C 34a_100000174869_100020672187 [1,1,0,0,0,0|2,0,0]=4 408 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCNCc3ccccc3O)n(c1=O)C 34a_100000185550_100020672187 [1,1,0,0,0,0|2,0,0]=4 409 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3Br)n(c1=O)C 34a_100000756307_100020672187 [1,1,0,0,0,0|2,0,0]=4 410 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3Br)n(c1=O)C 7a_100000756307_100020672187 [1,1,0,0,0,0|2,0,0]=4 411 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3Cl)n(c1=O)C 34a_100000210847_100020672187 [1,1,0,0,0,0|2,0,0]=4 412 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3Cl)n(c1=O)C 7a_100000210847_100020672187 [1,1,0,0,0,0|2,0,0]=4 413 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3F)n(c1=O)C 34a_100000211962_100020672187 [1,1,0,0,0,0|2,0,0]=4 414 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3F)n(c1=O)C 7a_100000211962_100020672187 [1,1,0,0,0,0|2,0,0]=4 415 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3I)n(c1=O)C 34a_100000187465_100020672187 [1,1,0,0,0,0|2,0,0]=4 416 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3I)n(c1=O)C 7a_100000187465_100020672187 [1,1,0,0,0,0|2,0,0]=4 417 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCOCc3ccccc3N)n(c1=O)C 34a_100000212039_100020672187 [1,1,0,0,0,0|2,0,0]=4 418 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3Br)n(c1=O)C 62a_100000184730_100020672187 [1,1,0,0,0,0|2,0,0]=4 419 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3Br)n(c1=O)C 62a_100020672187_100000184730 [1,1,0,0,0,0|2,0,0]=4 420 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3Cl)n(c1=O)C 62a_100000187162_100020672187 [1,1,0,0,0,0|2,0,0]=4 421 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3Cl)n(c1=O)C 62a_100020672187_100000187162 [1,1,0,0,0,0|2,0,0]=4 422 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3F)n(c1=O)C 62a_100000211605_100020672187 [1,1,0,0,0,0|2,0,0]=4 423 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3F)n(c1=O)C 62a_100020672187_100000211605 [1,1,0,0,0,0|2,0,0]=4 424 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3I)n(c1=O)C 62a_100011216222_100020672187 [1,1,0,0,0,0|2,0,0]=4 425 B27R3.171769346 Cn1c(=O)c2c(ncn2CCCSCc3ccccc3I)n(c1=O)C 62a_100020672187_100011216222 [1,1,0,0,0,0|2,0,0]=4 426 B27R3.171769346 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3Br)n(c1=O)C 2230a_100000747383_100000039610 [1,1,0,0,0,0|0,0,0]=2 427 B27R3.171769346 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3Br)n(c1=O)C 34a_100000747383_100000039610 [1,1,0,0,0,0|0,0,0]=2 428 B27R3.171769346 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3Cl)n(c1=O)C 2230a_100011207228_100000039610 [1,1,0,0,0,0|0,0,0]=2 429 B27R3.171769346 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3Cl)n(c1=O)C 34a_100011207228_100000039610 [1,1,0,0,0,0|0,0,0]=2 430 B27R3.171769346 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3F)n(c1=O)C 2230a_100000185272_100000039610 [1,1,0,0,0,0|0,0,0]=2 431 B27R3.171769346 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3F)n(c1=O)C 34a_100000185272_100000039610 [1,1,0,0,0,0|0,0,0]=2 432 B27R3.171769346 Cn1c(=O)c2c(ncn2CCNCCc3ccccc3O)n(c1=O)C 34a_100011207237_100000039610 [1,1,0,0,0,0|0,0,0]=2 433 B27R3.171769346 Cn1c(=O)c2c(ncn2CCNCCn3ccccc3=O)n(c1=O)C 2230a_100000687133_100000039610 [1,1,0,0,0,0|1,0,0]=3 434 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3Br)n(c1=O)C 34a_100000731337_100000039610 [1,1,0,0,0,0|1,0,0]=3 435 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3Br)n(c1=O)C 7a_100000731337_100000039610 [1,1,0,0,0,0|1,0,0]=3 436 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3Cl)n(c1=O)C 34a_100011215284_100000039610 [1,1,0,0,0,0|1,0,0]=3 437 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3Cl)n(c1=O)C 7a_100011215284_100000039610 [1,1,0,0,0,0|1,0,0]=3 438 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3F)n(c1=O)C 34a_100000753711_100000039610 [1,1,0,0,0,0|1,0,0]=3 439 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3F)n(c1=O)C 7a_100000753711_100000039610 [1,1,0,0,0,0|1,0,0]=3 440 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3I)n(c1=O)C 34a_100010255290_100000039610 [1,1,0,0,0,0|1,0,0]=3 441 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3I)n(c1=O)C 7a_100010255290_100000039610 [1,1,0,0,0,0|1,0,0]=3 442 B27R3.171769346 Cn1c(=O)c2c(ncn2CCOCCc3ccccc3N)n(c1=O)C 34a_100011215289_100000039610 [1,1,0,0,0,0|1,0,0]=3 443 B27R3.171769346 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3Br)n(c1=O)C 62a_100000039610_100012161201 [1,1,0,0,0,0|1,0,0]=3 444 B27R3.171769346 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3Br)n(c1=O)C 62a_100012161201_100000039610 [1,1,0,0,0,0|1,0,0]=3 445 B27R3.171769346 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3Cl)n(c1=O)C 62a_100000039610_100011713703 [1,1,0,0,0,0|1,0,0]=3 446 B27R3.171769346 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3Cl)n(c1=O)C 62a_100011713703_100000039610 [1,1,0,0,0,0|1,0,0]=3 447 B27R3.171769346 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3F)n(c1=O)C 62a_100000039610_100011713696 [1,1,0,0,0,0|1,0,0]=3 448 B27R3.171769346 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3F)n(c1=O)C 62a_100011713696_100000039610 [1,1,0,0,0,0|1,0,0]=3 449 B27R3.171769346 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3O)n(c1=O)C 62a_100000039610_100000722297 [1,1,0,0,0,0|1,0,0]=3 450 B27R3.171769346 Cn1c(=O)c2c(ncn2CCSCCc3ccccc3O)n(c1=O)C 62a_100000722297_100000039610 [1,1,0,0,0,0|1,0,0]=3 451 B27R3.370652051 Cc1ccc(cc1)CCNCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000705350_100000039610 [1,1,0,0,0,0|0,0,0]=2 452 B27R3.370652051 Cc1ccc(cc1)CCNCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000705350_100000039610 [1,1,0,0,0,0|0,0,0]=2 453 B27R3.370652051 Cc1ccc(cc1)CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000756670_100000039610 [1,1,0,0,0,0|1,0,0]=3 454 B27R3.370652051 Cc1ccc(cc1)CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000756670_100000039610 [1,1,0,0,0,0|1,0,0]=3 455 B27R3.370652051 Cc1ccc(cc1)CCSCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000039610_100011713686 [1,1,0,0,0,0|1,0,0]=3 456 B27R3.370652051 Cc1ccc(cc1)CCSCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100011713686_100000039610 [1,1,0,0,0,0|1,0,0]=3 457 B27R3.370652051 Cc1ccc(cc1)CNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000174908_100020672187 [1,1,0,0,0,0|2,0,0]=4 458 B27R3.370652051 Cc1ccc(cc1)CNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000174908_100020672187 [1,1,0,0,0,0|2,0,0]=4 459 B27R3.370652051 Cc1ccc(cc1)COCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011215236_100020672187 [1,1,0,0,0,0|2,0,0]=4 460 B27R3.370652051 Cc1ccc(cc1)COCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011215236_100020672187 [1,1,0,0,0,0|2,0,0]=4 461 B27R3.370652051 Cc1ccc(cc1)CSCCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000210814_100020672187 [1,1,0,0,0,0|2,0,0]=4 462 B27R3.370652051 Cc1ccc(cc1)CSCCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100020672187_100000210814 [1,1,0,0,0,0|2,0,0]=4 463 B27R3.370652051 Cc1ccc(cn1)CCOCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011815783_100000039610 [1,1,0,0,0,0|2,0,0]=4 464 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)Br)n(c1=O)C 2230a_100000174875_100020672187 [1,1,0,0,0,0|2,0,0]=4 465 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)Br)n(c1=O)C 34a_100000174875_100020672187 [1,1,0,0,0,0|2,0,0]=4 466 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)Cl)n(c1=O)C 2230a_100000174871_100020672187 [1,1,0,0,0,0|2,0,0]=4 467 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)Cl)n(c1=O)C 34a_100000174871_100020672187 [1,1,0,0,0,0|2,0,0]=4 468 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)F)n(c1=O)C 2230a_100000174882_100020672187 [1,1,0,0,0,0|2,0,0]=4 469 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)F)n(c1=O)C 34a_100000174882_100020672187 [1,1,0,0,0,0|2,0,0]=4 470 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)I)n(c1=O)C 2230a_100016989417_100020672187 [1,1,0,0,0,0|2,0,0]=4 471 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)I)n(c1=O)C 34a_100016989417_100020672187 [1,1,0,0,0,0|2,0,0]=4 472 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCNCc3ccc(cc3)O)n(c1=O)C 34a_100000185549_100020672187 [1,1,0,0,0,0|2,0,0]=4 473 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCOCc3ccc(cc3)Br)n(c1=O)C 34a_100000695286_100020672187 [1,1,0,0,0,0|2,0,0]=4 474 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCOCc3ccc(cc3)Cl)n(c1=O)C 34a_100000211118_100020672187 [1,1,0,0,0,0|2,0,0]=4 475 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCOCc3ccc(cc3)Cl)n(c1=O)C 7a_100000211118_100020672187 [1,1,0,0,0,0|2,0,0]=4 476 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCOCc3ccc(cc3)F)n(c1=O)C 34a_100000210977_100020672187 [1,1,0,0,0,0|2,0,0]=4 477 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCOCc3ccc(cc3)F)n(c1=O)C 7a_100000210977_100020672187 [1,1,0,0,0,0|2,0,0]=4 478 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCOCc3ccc(cc3)I)n(c1=O)C 34a_100000690907_100020672187 [1,1,0,0,0,0|2,0,0]=4 479 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCOCc3ccc(cc3)I)n(c1=O)C 7a_100000690907_100020672187 [1,1,0,0,0,0|2,0,0]=4 480 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCOCc3ccc(cc3)N)n(c1=O)C 34a_100011215238_100020672187 [1,1,0,0,0,0|2,0,0]=4 481 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCSCc3ccc(cc3)Br)n(c1=O)C 62a_100000189115_100020672187 [1,1,0,0,0,0|2,0,0]=4 482 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCSCc3ccc(cc3)Br)n(c1=O)C 62a_100020672187_100000189115 [1,1,0,0,0,0|2,0,0]=4 483 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCSCc3ccc(cc3)Cl)n(c1=O)C 62a_100000187161_100020672187 [1,1,0,0,0,0|2,0,0]=4 484 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCSCc3ccc(cc3)Cl)n(c1=O)C 62a_100020672187_100000187161 [1,1,0,0,0,0|2,0,0]=4 485 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCSCc3ccc(cc3)F)n(c1=O)C 62a_100000198546_100020672187 [1,1,0,0,0,0|2,0,0]=4 486 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCSCc3ccc(cc3)F)n(c1=O)C 62a_100020672187_100000187164 [1,1,0,0,0,0|2,0,0]=4 487 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCSCc3ccc(cc3)I)n(c1=O)C 62a_100000189116_100020672187 [1,1,0,0,0,0|2,0,0]=4 488 B27R3.370652051 Cn1c(=O)c2c(ncn2CCCSCc3ccc(cc3)I)n(c1=O)C 62a_100020672187_100000189116 [1,1,0,0,0,0|2,0,0]=4 489 B27R3.370652051 Cn1c(=O)c2c(ncn2CCNCCc3ccc(cc3)Br)n(c1=O)C 2230a_100000755846_100000039610 [1,1,0,0,0,0|0,0,0]=2 490 B27R3.370652051 Cn1c(=O)c2c(ncn2CCNCCc3ccc(cc3)Br)n(c1=O)C 34a_100000755846_100000039610 [1,1,0,0,0,0|0,0,0]=2 491 B27R3.370652051 Cn1c(=O)c2c(ncn2CCNCCc3ccc(cc3)Cl)n(c1=O)C 2230a_100000185265_100000039610 [1,1,0,0,0,0|0,0,0]=2 492 B27R3.370652051 Cn1c(=O)c2c(ncn2CCNCCc3ccc(cc3)Cl)n(c1=O)C 34a_100000185265_100000039610 [1,1,0,0,0,0|0,0,0]=2 493 B27R3.370652051 Cn1c(=O)c2c(ncn2CCNCCc3ccc(cc3)F)n(c1=O)C 2230a_100000199005_100000039610 [1,1,0,0,0,0|0,0,0]=2 494 B27R3.370652051 Cn1c(=O)c2c(ncn2CCNCCc3ccc(cc3)F)n(c1=O)C 34a_100000199005_100000039610 [1,1,0,0,0,0|0,0,0]=2 495 B27R3.370652051 Cn1c(=O)c2c(ncn2CCNCCc3ccc(cc3)O)n(c1=O)C 34a_100000743037_100000039610 [1,1,0,0,0,0|0,0,0]=2 496 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)Br)n(c1=O)C 34a_100000766406_100000039610 [1,1,0,0,0,0|1,0,0]=3 497 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)Br)n(c1=O)C 7a_100000766406_100000039610 [1,1,0,0,0,0|1,0,0]=3 498 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)Cl)n(c1=O)C 34a_100011219627_100000039610 [1,1,0,0,0,0|1,0,0]=3 499 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)Cl)n(c1=O)C 7a_100011219627_100000039610 [1,1,0,0,0,0|1,0,0]=3 500 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)F)n(c1=O)C 34a_100000754732_100000039610 [1,1,0,0,0,0|1,0,0]=3 501 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)F)n(c1=O)C 7a_100000754732_100000039610 [1,1,0,0,0,0|1,0,0]=3 502 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)I)n(c1=O)C 34a_100012291149_100000039610 [1,1,0,0,0,0|1,0,0]=3 503 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)I)n(c1=O)C 7a_100012291149_100000039610 [1,1,0,0,0,0|1,0,0]=3 504 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cc3)N)n(c1=O)C 34a_100011204434_100000039610 [1,1,0,0,0,0|1,0,0]=3 505 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(cn3)Br)n(c1=O)C 34a_100012357577_100000039610 [1,1,0,0,0,0|2,0,0]=4 506 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(nc3)Cl)n(c1=O)C 34a_100009880866_100000039610 [1,1,0,0,0,0|2,0,0]=4 507 B27R3.370652051 Cn1c(=O)c2c(ncn2CCOCCc3ccc(nc3)Cl)n(c1=O)C 7a_100009880866_100000039610 [1,1,0,0,0,0|2,0,0]=4 508 B27R3.370652051 Cn1c(=O)c2c(ncn2CCSCCc3ccc(cc3)Br)n(c1=O)C 62a_100000039610_100011740612 [1,1,0,0,0,0|1,0,0]=3 509 B27R3.370652051 Cn1c(=O)c2c(ncn2CCSCCc3ccc(cc3)Br)n(c1=O)C 62a_100011740612_100000039610 [1,1,0,0,0,0|1,0,0]=3 510 B27R3.370652051 Cn1c(=O)c2c(ncn2CCSCCc3ccc(cc3)Cl)n(c1=O)C 62a_100000039610_100011713675 [1,1,0,0,0,0|1,0,0]=3 511 B27R3.370652051 Cn1c(=O)c2c(ncn2CCSCCc3ccc(cc3)Cl)n(c1=O)C 62a_100011713675_100000039610 [1,1,0,0,0,0|1,0,0]=3 512 B27R3.370652051 Cn1c(=O)c2c(ncn2CCSCCc3ccc(cc3)F)n(c1=O)C 62a_100000039610_100011217392 [1,1,0,0,0,0|1,0,0]=3 513 B27R3.370652051 Cn1c(=O)c2c(ncn2CCSCCc3ccc(cc3)F)n(c1=O)C 62a_100011217392_100000039610 [1,1,0,0,0,0|1,0,0]=3 514 B27R3.370652051 Cn1c(=O)c2c(ncn2CCSCCc3ccc(cc3)O)n(c1=O)C 62a_100000039610_100009816426 [1,1,0,0,0,0|1,0,0]=3 515 B27R3.370652051 Cn1c(=O)c2c(ncn2CCSCCc3ccc(cc3)O)n(c1=O)C 62a_100009816426_100000039610 [1,1,0,0,0,0|1,0,0]=3 516 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)CCCc3ccccc3)n(c1=O)C 1458a_100000499738_100000211621 [1,1,0,0,0,0|1,0,1]=4 517 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccccc3)n(c1=O)C 11a_100000106460_100000499738 [1,1,0,0,0,0|0,0,1]=3 518 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccccc3)n(c1=O)C 1626a_100000106460_100000499738 [1,1,0,0,0,0|0,0,1]=3 519 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccccc3)n(c1=O)C 240690a_100000106460_100000499738 [1,1,0,0,0,0|0,0,1]=3 520 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccccc3)n(c1=O)C 527a_100000106460_100000499738 [1,1,0,0,0,0|0,0,1]=3 521 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccccn3)n(c1=O)C 11a_100000211156_100000499738 [1,1,0,0,0,0|1,0,1]=4 522 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccccn3)n(c1=O)C 1626a_100000211156_100000499738 [1,1,0,0,0,0|1,0,1]=4 523 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccccn3)n(c1=O)C 240690a_100000211156_100000499738 [1,1,0,0,0,0|1,0,1]=4 524 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccccn3)n(c1=O)C 527a_100000211156_100000499738 [1,1,0,0,0,0|1,0,1]=4 525 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3cccnc3)n(c1=O)C 11a_100000736294_100000499738 [1,1,0,0,0,0|1,0,1]=4 526 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3cccnc3)n(c1=O)C 1626a_100000736294_100000499738 [1,1,0,0,0,0|1,0,1]=4 527 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3cccnc3)n(c1=O)C 240690a_100000736294_100000499738 [1,1,0,0,0,0|1,0,1]=4 528 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3cccnc3)n(c1=O)C 527a_100000736294_100000499738 [1,1,0,0,0,0|1,0,1]=4 529 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccncc3)n(c1=O)C 11a_100000742849_100000499738 [1,1,0,0,0,0|1,0,1]=4 530 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccncc3)n(c1=O)C 1626a_100000742849_100000499738 [1,1,0,0,0,0|1,0,1]=4 531 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccncc3)n(c1=O)C 240690a_100000742849_100000499738 [1,1,0,0,0,0|1,0,1]=4 532 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NCCc3ccncc3)n(c1=O)C 527a_100000742849_100000499738 [1,1,0,0,0,0|1,0,1]=4 533 B27R3.605750903 Cn1c(=O)c2c(ncn2CC(=O)NNCc3ccccc3)n(c1=O)C 22a_100000007032_100000499738 [1,1,0,0,0,0|1,0,1]=4 534 B27R3.605750924 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 2230a_100000701038_100000039610 [1,1,0,0,0,0|0,0,0]=2 535 B27R3.605750924 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100000701038_100000039610 [1,1,0,0,0,0|0,0,0]=2 536 B27R3.605750924 CC(COCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100011215166_100000039610 [1,1,0,0,0,0|1,0,0]=3 537 B27R3.605750924 CC(COCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 7a_100011215166_100000039610 [1,1,0,0,0,0|1,0,0]=3 538 B27R3.605750924 CC(CSCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 62a_100000039610_100000756946 [1,1,0,0,0,0|1,0,0]=3 539 B27R3.605750924 CC(CSCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 62a_100000756946_100000039610 [1,1,0,0,0,0|1,0,0]=3 540 B27R3.605750924 CC(SCCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 62a_100000230085_100020672187 [1,1,0,0,0,0|2,0,0]=4 541 B27R3.605750924 CC(SCCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 62a_100020672187_100000230085 [1,1,0,0,0,0|2,0,0]=4 542 B27R3.605750924 C[C@@H](NCCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 2230a_100000751104_100020672187 [1,1,0,0,0,0|2,0,0]=4 543 B27R3.605750924 C[C@@H](OCCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100000761318_100020672187 [1,1,0,0,0,0|2,0,0]=4 544 B27R3.605750924 C[C@@H](OCCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 7a_100000761318_100020672187 [1,1,0,0,0,0|2,0,0]=4 545 B27R3.605750924 Cn1c(=O)c2c(ncn2CCNCC(O)c3ccccc3)n(c1=O)C 2230a_100000210709_100000039610 [1,1,0,0,0,0|0,0,0]=2 546 B27R3.605750924 Cn1c(=O)c2c(ncn2CCNCC(O)c3ccccn3)n(c1=O)C 2230a_100000691469_100000039610 [1,1,0,0,0,0|1,0,0]=3 547 B27R3.605750924 Cn1c(=O)c2c(ncn2CCNCC(O)c3cccnc3)n(c1=O)C 2230a_100020605170_100000039610 [1,1,0,0,0,0|1,0,0]=3 548 B27R3.605750924 Cn1c(=O)c2c(ncn2CCOC[C@@H](N)c3ccccc3)n(c1=O)C 34a_100000751927_100000039610 [1,1,0,0,0,0|1,0,0]=3 549 B27R3.605750924 Cn1c(=O)c2c(ncn2CCOC[C@@H](N)c3ccncc3)n(c1=O)C 34a_100138412524_100000039610 [1,1,0,0,0,0|2,0,0]=4 550 B27R3.605750924 Cn1c(=O)c2c(ncn2CCSCC(=O)c3ccccc3)n(c1=O)C 62a_100000039610_100000211460 [1,1,0,0,0,0|1,0,1]=4 551 B27R3.605750924 Cn1c(=O)c2c(ncn2CCSCC(=O)c3ccccc3)n(c1=O)C 62a_100000211460_100000039610 [1,1,0,0,0,0|1,0,1]=4 552 B27R3.605750924 Cn1c(=O)c2c(ncn2CCSCC(O)c3ccccc3)n(c1=O)C 62a_100000039610_100000185958 [1,1,0,0,0,0|1,0,0]=3 553 B27R3.605750924 Cn1c(=O)c2c(ncn2CCSCC(O)c3ccccc3)n(c1=O)C 62a_100000185958_100000039610 [1,1,0,0,0,0|1,0,0]=3 554 B27R3.605750924 Cn1c(=O)c2c(ncn2CCSCS(=O)c3ccccc3)n(c1=O)C 62a_100000039610_100000031784 [1,1,0,0,0,0|2,0,0]=4 555 B27R3.605750924 Cn1c(=O)c2c(ncn2CCSC[C@@H](O)c3ccccc3)n(c1=O)C 62a_100000039610_100011933945 [1,1,0,0,0,0|1,0,0]=3 556 B27R3.605750924 Cn1c(=O)c2c(ncn2CCSC[C@@H](O)c3ccccc3)n(c1=O)C 62a_100011933945_100000039610 [1,1,0,0,0,0|1,0,0]=3 557 B27R3.605750927 CN(CCc1ccccc1)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000207497_100000039610 [1,1,0,0,0,0|0,0,0]=2 558 B27R3.605750927 CN(CCc1ccccc1)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000207497_100000039610 [1,1,0,0,0,0|0,0,0]=2 559 B27R3.605750927 CN(CCc1ccccn1)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000737206_100000039610 [1,1,0,0,0,0|1,0,0]=3 560 B27R3.605750927 CN(CCc1ccccn1)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000737206_100000039610 [1,1,0,0,0,0|1,0,0]=3 561 B27R3.605750927 CN(CCc1cccnc1)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000763209_100000039610 [1,1,0,0,0,0|1,0,0]=3 562 B27R3.605750927 CN(CCc1cccnc1)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000763209_100000039610 [1,1,0,0,0,0|1,0,0]=3 563 B27R3.605750927 CN(CCc1ccncc1)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000742850_100000039610 [1,1,0,0,0,0|1,0,0]=3 564 B27R3.605750927 CN(CCc1ccncc1)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000742850_100000039610 [1,1,0,0,0,0|1,0,0]=3 565 B27R3.605750927 Cn1c(=O)c2c(ncn2CCC(=O)CCc3ccccc3)n(c1=O)C 1458a_100000185753_100000039610 [1,1,0,0,0,0|1,0,0]=3 566 B27R3.605750927 Cn1c(=O)c2c(ncn2CCC(=O)CCc3ccccn3)n(c1=O)C 1458a_100015195070_100000039610 [1,1,0,0,0,0|2,0,0]=4 567 B27R3.605750927 Cn1c(=O)c2c(ncn2CCC(=O)CCc3cccnc3)n(c1=O)C 1458a_100000198484_100000039610 [1,1,0,0,0,0|2,0,0]=4 568 B27R3.605750927 Cn1c(=O)c2c(ncn2CCC(=O)CCc3ccncc3)n(c1=O)C 1458a_100011225043_100000039610 [1,1,0,0,0,0|2,0,0]=4 569 B27R3.605750927 Cn1c(=O)c2c(ncn2CCC(=O)COc3ccccc3)n(c1=O)C 1458a_100000186222_100000039610 [1,1,0,0,0,0|2,0,0]=4 570 B27R3.605750927 Cn1c(=O)c2c(ncn2CCC(=O)CSc3ccccc3)n(c1=O)C 1458a_100000211596_100000039610 [1,1,0,0,0,0|2,0,0]=4 571 B27R3.81411607 CCN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 2230a_100000186914_100000039610 [0,1,0,0,1,0|1,0,0]=3 572 B27R3.81411607 CCN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 269982a_100000186914_100000039610 [0,1,0,0,1,0|1,0,0]=3 573 B27R3.81411607 CCN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccn3 2230a_100000201164_100000039610 [0,1,0,0,1,0|2,0,0]=4 574 B27R3.81411607 CCN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccn3 269982a_100000201164_100000039610 [0,1,0,0,1,0|2,0,0]=4 575 B27R3.81411607 CCN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3 2230a_100000186920_100000039610 [0,1,0,0,1,0|2,0,0]=4 576 B27R3.81411607 CCN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3 269982a_100000186920_100000039610 [0,1,0,0,1,0|2,0,0]=4 577 B27R3.81411607 CCN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccncc3 2230a_100000186919_100000039610 [0,1,0,0,1,0|2,0,0]=4 578 B27R3.81411607 CCN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccncc3 269982a_100000186919_100000039610 [0,1,0,0,1,0|2,0,0]=4 579 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Br 2230a_100000184654_100000039610 [0,1,0,0,1,0|1,0,0]=3 580 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Br 269982a_100000184654_100000039610 [0,1,0,0,1,0|1,0,0]=3 581 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Cl 2230a_100000184507_100000039610 [0,1,0,0,1,0|1,0,0]=3 582 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Cl 269982a_100000184507_100000039610 [0,1,0,0,1,0|1,0,0]=3 583 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 2230a_100000742528_100000039610 [0,1,0,0,1,0|1,0,0]=3 584 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 269982a_100000742528_100000039610 [0,1,0,0,1,0|1,0,0]=3 585 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 34a_100000742528_100000039610 [0,1,0,0,1,0|1,0,0]=3 586 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3O 2230a_100015189988_100000039610 [0,1,0,0,1,0|1,0,0]=3 587 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3O 269982a_100015189988_100000039610 [0,1,0,0,1,0|1,0,0]=3 588 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3Cl 2230a_103496529121_100000039610 [0,1,0,0,1,0|2,0,0]=4 589 B27R3.262730468 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccnc3Cl 269982a_103496529121_100000039610 [0,1,0,0,1,0|2,0,0]=4 590 B27R3.262730468 Cc1ccccc1CC(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000212180_100000039610 [0,1,0,0,1,0|1,0,1]=4 591 B27R3.262730468 Cc1ccccc1CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000184421_100000039610 [0,1,0,0,1,0|1,0,0]=3 592 B27R3.262730468 Cc1ccccc1CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000184421_100000039610 [0,1,0,0,1,0|1,0,0]=3 593 B27R3.262730468 Cc1cnccc1CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100015187836_100000039610 [0,1,0,0,1,0|2,0,0]=4 594 B27R3.262730468 Cc1cnccc1CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100015187836_100000039610 [0,1,0,0,1,0|2,0,0]=4 595 B27R3.262730468 Cc1ncccc1CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_200011875998_100000039610 [0,1,0,0,1,0|2,0,0]=4 596 B27R3.262730468 Cc1ncccc1CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_200011875998_100000039610 [0,1,0,0,1,0|2,0,0]=4 597 B27R3.262730468 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccccc3Br)n(c1=O)C 1458a_100000751119_100000039610 [0,1,0,0,1,0|1,0,1]=4 598 B27R3.262730468 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccccc3Cl)n(c1=O)C 1458a_100000183793_100000039610 [0,1,0,0,1,0|1,0,1]=4 599 B27R3.262730468 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccccc3F)n(c1=O)C 1458a_100000212012_100000039610 [0,1,0,0,1,0|1,0,1]=4 600 B27R3.262730468 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccccc3I)n(c1=O)C 1458a_100000036491_100000039610 [0,1,0,0,1,0|1,0,1]=4 601 B27R3.262730468 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccccc3O)n(c1=O)C 1458a_100000743006_100000039610 [0,1,0,0,1,0|1,0,1]=4 602 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Br 2230a_100000180866_100000039610 [0,1,0,0,1,0|1,0,0]=3 603 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Br 269982a_100000180866_100000039610 [0,1,0,0,1,0|1,0,0]=3 604 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Cl 2230a_100000184517_100000039610 [0,1,0,0,1,0|1,0,0]=3 605 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Cl 269982a_100000184517_100000039610 [0,1,0,0,1,0|1,0,0]=3 606 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Cl 34a_100000184517_100000039610 [0,1,0,0,1,0|1,0,0]=3 607 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 2230a_100000184576_100000039610 [0,1,0,0,1,0|1,0,0]=3 608 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 269982a_100000184576_100000039610 [0,1,0,0,1,0|1,0,0]=3 609 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 34a_100000184576_100000039610 [0,1,0,0,1,0|1,0,0]=3 610 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)O 2230a_100000207500_100000039610 [0,1,0,0,1,0|1,0,0]=3 611 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)O 269982a_100000207500_100000039610 [0,1,0,0,1,0|1,0,0]=3 612 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(nc3)Cl 2230a_100000026953_100000039610 [0,1,0,0,1,0|2,0,0]=4 613 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(nc3)Cl 269982a_100000026953_100000039610 [0,1,0,0,1,0|2,0,0]=4 614 B27R3.370147921 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(nc3)Cl 34a_100000026953_100000039610 [0,1,0,0,1,0|2,0,0]=4 615 B27R3.370147921 Cc1ccc(cc1)CC(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000212244_100000039610 [0,1,0,0,1,0|1,0,1]=4 616 B27R3.370147921 Cc1ccc(cc1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000744650_100000039610 [0,1,0,0,1,0|1,0,0]=3 617 B27R3.370147921 Cc1ccc(cc1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000744650_100000039610 [0,1,0,0,1,0|1,0,0]=3 618 B27R3.370147921 Cc1ccc(cc1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000744650_100000039610 [0,1,0,0,1,0|1,0,0]=3 619 B27R3.370147921 Cc1ccc(cn1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_106623407658_100000039610 [0,1,0,0,1,0|2,0,0]=4 620 B27R3.370147921 Cc1ccc(cn1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_106623407658_100000039610 [0,1,0,0,1,0|2,0,0]=4 621 B27R3.370147921 Cc1ccc(cn1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_106623407658_100000039610 [0,1,0,0,1,0|2,0,0]=4 622 B27R3.370147921 Cc1ccc(nc1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_200000717808_100000039610 [0,1,0,0,1,0|2,0,0]=4 623 B27R3.370147921 Cc1ccc(nc1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_200000717808_100000039610 [0,1,0,0,1,0|2,0,0]=4 624 B27R3.370147921 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccc(cc3)Br)n(c1=O)C 1458a_100000198978_100000039610 [0,1,0,0,1,0|1,0,1]=4 625 B27R3.370147921 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccc(cc3)Cl)n(c1=O)C 1458a_100000211027_100000039610 [0,1,0,0,1,0|1,0,1]=4 626 B27R3.370147921 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccc(cc3)F)n(c1=O)C 1458a_100000210951_100000039610 [0,1,0,0,1,0|1,0,1]=4 627 B27R3.370147921 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccc(cc3)I)n(c1=O)C 1458a_100000688869_100000039610 [0,1,0,0,1,0|1,0,1]=4 628 B27R3.370147921 Cn1c(=O)c2c(ncn2CCC(=O)Cc3ccc(cc3)O)n(c1=O)C 1458a_100000198540_100000039610 [0,1,0,0,1,0|1,0,1]=4 629 B27R3.605750893 CC(c1ccccc1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000195388_100000039610 [0,1,0,0,1,0|1,0,0]=3 630 B27R3.605750893 CC(c1ccccc1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000195388_100000039610 [0,1,0,0,1,0|1,0,0]=3 631 B27R3.605750893 CC(c1ccccn1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000231138_100000039610 [0,1,0,0,1,0|2,0,0]=4 632 B27R3.605750893 CC(c1ccccn1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000231138_100000039610 [0,1,0,0,1,0|2,0,0]=4 633 B27R3.605750893 CC(c1cccnc1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000232774_100000039610 [0,1,0,0,1,0|2,0,0]=4 634 B27R3.605750893 CC(c1cccnc1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000232774_100000039610 [0,1,0,0,1,0|2,0,0]=4 635 B27R3.605750893 CC(c1ccncc1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000231139_100000039610 [0,1,0,0,1,0|2,0,0]=4 636 B27R3.605750893 CC(c1ccncc1)N(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000231139_100000039610 [0,1,0,0,1,0|2,0,0]=4 637 B27R3.605750893 C[C@H](C(=O)CCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 1458a_100000751047_100000039610 [0,1,0,0,1,0|1,0,1]=4 638 B27R3.605750893 Cn1c(=O)c2c(ncn2CCC(=O)C(F)c3ccccc3)n(c1=O)C 1458a_100000698975_100000039610 [0,1,0,0,1,0|1,0,1]=4 639 B27R3.605750893 Cn1c(=O)c2c(ncn2CCC(=O)[C@H](O)c3ccccc3)n(c1=O)C 1458a_100000684486_100000039610 [0,1,0,0,1,0|1,0,1]=4 640 B27R3.605750923 CC(Cc1ccccc1)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000499738_200011218536 [0,1,0,0,1,0|0,0,1]=3 641 B27R3.605750923 CN(Cc1ccccc1)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_100000186898_100000499738 [0,1,0,0,1,0|1,0,1]=4 642 B27R3.605750923 CN(Cc1ccccc1)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_100000186898_100000499738 [0,1,0,0,1,0|1,0,1]=4 643 B27R3.605750923 CN(Cc1ccccc1)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100000186898_100000499738 [0,1,0,0,1,0|1,0,1]=4 644 B27R3.605750923 CN(Cc1ccccc1)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100000186898_100000499738 [0,1,0,0,1,0|1,0,1]=4 645 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccn3)Cl 2230a_100102954512_100000039610 [0,1,0,0,1,0|2,0,0]=4 646 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccn3)Cl 269982a_100102954512_100000039610 [0,1,0,0,1,0|2,0,0]=4 647 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Br 2230a_100000187585_100000039610 [0,1,0,0,1,0|1,0,0]=3 648 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Br 269982a_100000187585_100000039610 [0,1,0,0,1,0|1,0,0]=3 649 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Cl 2230a_100020629429_100000039610 [0,1,0,0,1,0|1,0,0]=3 650 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Cl 269982a_100020629429_100000039610 [0,1,0,0,1,0|1,0,0]=3 651 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 2230a_100000184398_100000039610 [0,1,0,0,1,0|1,0,0]=3 652 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 269982a_100000184398_100000039610 [0,1,0,0,1,0|1,0,0]=3 653 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 34a_100000184398_100000039610 [0,1,0,0,1,0|1,0,0]=3 654 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)O 2230a_100000207540_100000039610 [0,1,0,0,1,0|1,0,0]=3 655 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)O 269982a_100000207540_100000039610 [0,1,0,0,1,0|1,0,0]=3 656 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(n3)Br 2230a_106354212997_100000039610 [0,1,0,0,1,0|2,0,0]=4 657 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(n3)Br 269982a_106354212997_100000039610 [0,1,0,0,1,0|2,0,0]=4 658 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cncc(c3)Br 2230a_103549770560_100000039610 [0,1,0,0,1,0|2,0,0]=4 659 B27R3.739254322 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cncc(c3)Br 269982a_103549770560_100000039610 [0,1,0,0,1,0|2,0,0]=4 660 B27R3.739254322 Cc1cccc(c1)CC(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100011206899_100000039610 [0,1,0,0,1,0|1,0,1]=4 661 B27R3.739254322 Cc1cccc(c1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_102495364743_100000039610 [0,1,0,0,1,0|1,0,0]=3 662 B27R3.739254322 Cc1cccc(c1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_102495364743_100000039610 [0,1,0,0,1,0|1,0,0]=3 663 B27R3.739254322 Cc1cccc(c1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_102495364743_100000039610 [0,1,0,0,1,0|1,0,0]=3 664 B27R3.739254322 Cc1cccc(n1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000687132_100000039610 [0,1,0,0,1,0|2,0,0]=4 665 B27R3.739254322 Cc1cccc(n1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000687132_100000039610 [0,1,0,0,1,0|2,0,0]=4 666 B27R3.739254322 Cc1ccnc(c1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_106354213154_100000039610 [0,1,0,0,1,0|2,0,0]=4 667 B27R3.739254322 Cc1ccnc(c1)CN(C)CCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_106354213154_100000039610 [0,1,0,0,1,0|2,0,0]=4 668 B27R3.739254322 Cn1c(=O)c2c(ncn2CCC(=O)Cc3cccc(c3)Br)n(c1=O)C 1458a_100000747190_100000039610 [0,1,0,0,1,0|1,0,1]=4 669 B27R3.739254322 Cn1c(=O)c2c(ncn2CCC(=O)Cc3cccc(c3)Cl)n(c1=O)C 1458a_100000749307_100000039610 [0,1,0,0,1,0|1,0,1]=4 670 B27R3.739254322 Cn1c(=O)c2c(ncn2CCC(=O)Cc3cccc(c3)F)n(c1=O)C 1458a_100000211661_100000039610 [0,1,0,0,1,0|1,0,1]=4 671 B27R3.739254322 Cn1c(=O)c2c(ncn2CCC(=O)Cc3cccc(c3)I)n(c1=O)C 1458a_100000238430_100000039610 [0,1,0,0,1,0|1,0,1]=4 672 B27R3.739254322 Cn1c(=O)c2c(ncn2CCC(=O)Cc3cccc(c3)O)n(c1=O)C 1458a_100000745134_100000039610 [0,1,0,0,1,0|1,0,1]=4 673 B27R3.322253579 CCC(Cn1ccnc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_200015184670_100000039610 [0,1,0,0,1,0|2,0,0]=4 674 B27R3.322253579 Cn1c(=O)c2c(ncn2CCN[C@H](CO)Cc3c[nH]cn3)n(c1=O)C 2230a_100016995062_100000039610 [0,1,0,0,1,0|2,0,0]=4 675 B27R3.496164892 Cc1cc([nH]n1)CC(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000081893_100000039610 [0,1,0,0,1,0|2,0,0]=4 676 B27R3.605750915 CC(Cc1cccs1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_100000751415_100000499738 [0,1,0,0,1,0|1,0,1]=4 677 B27R3.605750915 CC(Cc1cccs1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_100000751415_100000499738 [0,1,0,0,1,0|1,0,1]=4 678 B27R3.605750915 CC(Cc1cccs1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100000751415_100000499738 [0,1,0,0,1,0|1,0,1]=4 679 B27R3.605750915 CC(Cc1cccs1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100000751415_100000499738 [0,1,0,0,1,0|1,0,1]=4 680 B27R3.605750915 CC(Cc1ccsc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_100000743546_100000499738 [0,1,0,0,1,0|1,0,1]=4 681 B27R3.605750915 CC(Cc1ccsc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_100000743546_100000499738 [0,1,0,0,1,0|1,0,1]=4 682 B27R3.605750915 CC(Cc1ccsc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100000743546_100000499738 [0,1,0,0,1,0|1,0,1]=4 683 B27R3.605750915 CC(Cc1ccsc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100000743546_100000499738 [0,1,0,0,1,0|1,0,1]=4 684 B27R3.49651356 C#CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100011219616_100000039610 [0,1,0,0,1,0|1,0,1]=4 685 B27R3.49651356 C#CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 7a_100011219616_100000039610 [0,1,0,0,1,0|1,0,1]=4 686 B27R3.49651356 C=CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100011215659_100000039610 [0,1,0,0,1,0|1,0,1]=4 687 B27R3.49651356 C=CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 7a_100011215659_100000039610 [0,1,0,0,1,0|1,0,1]=4 688 B27R3.49651356 C=CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 62a_100000039610_200000085779 [0,1,0,0,1,0|1,0,1]=4 689 B27R3.49651356 C=CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 62a_200000085779_100000039610 [0,1,0,0,1,0|1,0,1]=4 690 B27R3.49651356 CCC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 2230a_100000737752_100000039610 [0,1,0,0,1,0|0,0,0]=2 691 B27R3.49651356 CCC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccn3 2230a_100015186561_100000039610 [0,1,0,0,1,0|1,0,0]=3 692 B27R3.49651356 CCC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccnc3 2230a_100000246009_100000039610 [0,1,0,0,1,0|1,0,0]=3 693 B27R3.49651356 CCC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cnccn3 2230a_200016994365_100000039610 [0,1,0,0,1,0|2,0,0]=4 694 B27R3.49651356 CCC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100000698172_100000039610 [0,1,0,0,1,0|1,0,0]=3 695 B27R3.49651356 CCC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 7a_100000698172_100000039610 [0,1,0,0,1,0|1,0,0]=3 696 B27R3.49651356 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 2230a_100000210013_100020672187 [0,1,0,0,1,0|2,0,0]=4 697 B27R3.49651356 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 269982a_100000210013_100020672187 [0,1,0,0,1,0|2,0,0]=4 698 B27R3.49651356 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100000210013_100020672187 [0,1,0,0,1,0|2,0,0]=4 699 B27R3.49651356 Cn1c(=O)c2c(ncn2CCNC(CO)c3ccccn3)n(c1=O)C 2230a_100015196888_100000039610 [0,1,0,0,1,0|1,0,0]=3 700 B27R3.49651356 Cn1c(=O)c2c(ncn2CCN[C@H](CO)c3ccccc3)n(c1=O)C 2230a_100000751927_100000039610 [0,1,0,0,1,0|0,0,0]=2 701 B27R3.49651356 Cn1c(=O)c2c(ncn2CCN[C@H](CO)c3ccccc3)n(c1=O)C 34a_100000751927_100000039610 [0,1,0,0,1,0|0,0,0]=2 702 B27R3.49651356 Cn1c(=O)c2c(ncn2CCN[C@H](CO)c3ccncc3)n(c1=O)C 2230a_100138412524_100000039610 [0,1,0,0,1,0|1,0,0]=3 703 B27R3.49651356 Cn1c(=O)c2c(ncn2CCOC(C#N)c3ccccc3)n(c1=O)C 7a_100011217353_100000039610 [0,1,0,0,1,0|1,0,1]=4 704 B27R3.49651356 Cn1c(=O)c2c(ncn2CCOC(CBr)c3ccccc3)n(c1=O)C 7a_100000185958_100000039610 [0,1,0,0,1,0|1,0,0]=3 705 B27R3.49651356 Cn1c(=O)c2c(ncn2CCOC(CN)c3ccccc3)n(c1=O)C 34a_100000210709_100000039610 [0,1,0,0,1,0|1,0,0]=3 706 B27R3.49651356 Cn1c(=O)c2c(ncn2CCO[C@H](CCl)c3ccccc3)n(c1=O)C 34a_100011933945_100000039610 [0,1,0,0,1,0|1,0,0]=3 707 B27R3.49651356 Cn1c(=O)c2c(ncn2CCO[C@H](CCl)c3ccccc3)n(c1=O)C 7a_100011933945_100000039610 [0,1,0,0,1,0|1,0,0]=3 708 B27R3.254290602 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Br 2230a_100000181357_100000039610 [0,1,0,0,1,0|0,0,0]=2 709 B27R3.254290602 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 2230a_100000174978_100000039610 [0,1,0,0,1,0|0,0,0]=2 710 B27R3.254290602 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 34a_100000174978_100000039610 [0,1,0,0,1,0|0,0,0]=2 711 B27R3.254290602 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 2230a_100000181408_100000039610 [0,1,0,0,1,0|0,0,0]=2 712 B27R3.254290602 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 34a_100000181408_100000039610 [0,1,0,0,1,0|0,0,0]=2 713 B27R3.254290602 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccnc3O 2230a_100159269580_100000039610 [0,1,0,0,1,0|1,0,0]=3 714 B27R3.254290602 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ncccc3Br 2230a_100159271932_100000039610 [0,1,0,0,1,0|1,0,0]=3 715 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Br 34a_100000702211_100000039610 [0,1,0,0,1,0|1,0,0]=3 716 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Br 7a_100000702211_100000039610 [0,1,0,0,1,0|1,0,0]=3 717 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 34a_100000740796_100000039610 [0,1,0,0,1,0|1,0,0]=3 718 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 7a_100000740796_100000039610 [0,1,0,0,1,0|1,0,0]=3 719 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 34a_100000697922_100000039610 [0,1,0,0,1,0|1,0,0]=3 720 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 7a_100000697922_100000039610 [0,1,0,0,1,0|1,0,0]=3 721 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3N 7a_100011405641_100000039610 [0,1,0,0,1,0|1,0,0]=3 722 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccnc3Cl 34a_100009865335_100000039610 [0,1,0,0,1,0|2,0,0]=4 723 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccnc3Cl 7a_100009865335_100000039610 [0,1,0,0,1,0|2,0,0]=4 724 B27R3.254290602 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccncc3F 34a_100012180158_100000039610 [0,1,0,0,1,0|2,0,0]=4 725 B27R3.254290602 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 62a_100000039610_100000181259 [0,1,0,0,1,0|1,0,0]=3 726 B27R3.254290602 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 62a_100000181259_100000039610 [0,1,0,0,1,0|1,0,0]=3 727 B27R3.254290602 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 62a_100000039610_200000741388 [0,1,0,0,1,0|1,0,0]=3 728 B27R3.254290602 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 62a_200000741388_100000039610 [0,1,0,0,1,0|1,0,0]=3 729 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Br 2230a_100020606079_100020672187 [0,1,0,0,1,0|2,0,0]=4 730 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Br 269982a_100020606079_100020672187 [0,1,0,0,1,0|2,0,0]=4 731 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Br 34a_100020606079_100020672187 [0,1,0,0,1,0|2,0,0]=4 732 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 2230a_100000219374_100020672187 [0,1,0,0,1,0|2,0,0]=4 733 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 269982a_100000219374_100020672187 [0,1,0,0,1,0|2,0,0]=4 734 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3Cl 34a_100000219374_100020672187 [0,1,0,0,1,0|2,0,0]=4 735 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 2230a_100000220357_100020672187 [0,1,0,0,1,0|2,0,0]=4 736 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 269982a_100000220357_100020672187 [0,1,0,0,1,0|2,0,0]=4 737 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3F 34a_100000220357_100020672187 [0,1,0,0,1,0|2,0,0]=4 738 B27R3.254290602 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3O 269982a_100000033821_100020672187 [0,1,0,0,1,0|2,0,0]=4 739 B27R3.254290602 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3O 2230a_100025703389_100000039610 [0,1,0,0,1,0|0,0,0]=2 740 B27R3.254290602 C[C@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ncccc3Br 7a_100013325542_100000039610 [0,1,0,0,1,0|2,0,0]=4 741 B27R3.254290602 Cc1ccccc1C(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000181355_100000039610 [0,1,0,0,1,0|0,0,0]=2 742 B27R3.254290602 Cc1ccccc1C(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000181355_100000039610 [0,1,0,0,1,0|0,0,0]=2 743 B27R3.254290602 Cc1ccccc1C(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000742021_100000039610 [0,1,0,0,1,0|1,0,0]=3 744 B27R3.254290602 Cc1ccccc1C(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000742021_100000039610 [0,1,0,0,1,0|1,0,0]=3 745 B27R3.254290602 Cc1ccccc1N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000219699_100020672187 [0,1,0,0,1,0|2,0,0]=4 746 B27R3.254290602 Cc1ccccc1N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000219699_100020672187 [0,1,0,0,1,0|2,0,0]=4 747 B27R3.254290602 Cc1ccccc1N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000219699_100020672187 [0,1,0,0,1,0|2,0,0]=4 748 B27R3.254290602 Cc1cccnc1C(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011536111_100000039610 [0,1,0,0,1,0|1,0,0]=3 749 B27R3.368229477 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cn3)Br 2230a_100000723930_100000039610 [0,1,0,0,1,0|1,0,0]=3 750 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Br 34a_100000745893_100000039610 [0,1,0,0,1,0|1,0,0]=3 751 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Br 7a_100000745893_100000039610 [0,1,0,0,1,0|1,0,0]=3 752 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 34a_100000181323_100000039610 [0,1,0,0,1,0|1,0,0]=3 753 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 7a_100000181323_100000039610 [0,1,0,0,1,0|1,0,0]=3 754 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)N 34a_100011216399_100000039610 [0,1,0,0,1,0|1,0,0]=3 755 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cn3)Br 34a_100012353650_100000039610 [0,1,0,0,1,0|2,0,0]=4 756 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cn3)Br 7a_100012353650_100000039610 [0,1,0,0,1,0|2,0,0]=4 757 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(nc3)Br 34a_200010274204_100000039610 [0,1,0,0,1,0|2,0,0]=4 758 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(nc3)Br 7a_200010274204_100000039610 [0,1,0,0,1,0|2,0,0]=4 759 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(nc3)Cl 34a_200012017543_100000039610 [0,1,0,0,1,0|2,0,0]=4 760 B27R3.368229477 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(nc3)Cl 7a_200012017543_100000039610 [0,1,0,0,1,0|2,0,0]=4 761 B27R3.368229477 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Br 62a_100000039610_100000755118 [0,1,0,0,1,0|1,0,0]=3 762 B27R3.368229477 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Br 62a_100000755118_100000039610 [0,1,0,0,1,0|1,0,0]=3 763 B27R3.368229477 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 62a_100000039610_100000684792 [0,1,0,0,1,0|1,0,0]=3 764 B27R3.368229477 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 62a_100000684792_100000039610 [0,1,0,0,1,0|1,0,0]=3 765 B27R3.368229477 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 62a_100000039610_100000743420 [0,1,0,0,1,0|1,0,0]=3 766 B27R3.368229477 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 62a_100000743420_100000039610 [0,1,0,0,1,0|1,0,0]=3 767 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Br 2230a_100000219623_100020672187 [0,1,0,0,1,0|2,0,0]=4 768 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Br 269982a_100000219623_100020672187 [0,1,0,0,1,0|2,0,0]=4 769 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Br 34a_100000219623_100020672187 [0,1,0,0,1,0|2,0,0]=4 770 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 2230a_100020629279_100020672187 [0,1,0,0,1,0|2,0,0]=4 771 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 269982a_100020629279_100020672187 [0,1,0,0,1,0|2,0,0]=4 772 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 34a_100020629279_100020672187 [0,1,0,0,1,0|2,0,0]=4 773 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 2230a_100000219829_100020672187 [0,1,0,0,1,0|2,0,0]=4 774 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 269982a_100000219829_100020672187 [0,1,0,0,1,0|2,0,0]=4 775 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 34a_100000219829_100020672187 [0,1,0,0,1,0|2,0,0]=4 776 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)I 2230a_100000743151_100020672187 [0,1,0,0,1,0|2,0,0]=4 777 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)I 269982a_100000743151_100020672187 [0,1,0,0,1,0|2,0,0]=4 778 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)I 34a_100000743151_100020672187 [0,1,0,0,1,0|2,0,0]=4 779 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)O 269982a_100000182112_100020672187 [0,1,0,0,1,0|2,0,0]=4 780 B27R3.368229477 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)O 34a_100000182112_100020672187 [0,1,0,0,1,0|2,0,0]=4 781 B27R3.368229477 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Br 2230a_100000720352_100000039610 [0,1,0,0,1,0|0,0,0]=2 782 B27R3.368229477 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 2230a_100015205461_100000039610 [0,1,0,0,1,0|0,0,0]=2 783 B27R3.368229477 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 34a_100015205461_100000039610 [0,1,0,0,1,0|0,0,0]=2 784 B27R3.368229477 C[C@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 2230a_100025705893_100000039610 [0,1,0,0,1,0|0,0,0]=2 785 B27R3.368229477 C[C@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 34a_100025705893_100000039610 [0,1,0,0,1,0|0,0,0]=2 786 B27R3.368229477 C[C@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)I 2230a_100000753911_100000039610 [0,1,0,0,1,0|0,0,0]=2 787 B27R3.368229477 C[C@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)O 2230a_100161106496_100000039610 [0,1,0,0,1,0|0,0,0]=2 788 B27R3.368229477 C[C@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(nc3)Br 2230a_100015387476_100000039610 [0,1,0,0,1,0|1,0,0]=3 789 B27R3.368229477 C[C@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 34a_100011852131_100000039610 [0,1,0,0,1,0|1,0,0]=3 790 B27R3.368229477 C[C@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)Cl 7a_100011852131_100000039610 [0,1,0,0,1,0|1,0,0]=3 791 B27R3.368229477 Cc1ccc(cc1)C(C)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000039610_100011261388 [0,1,0,0,1,0|1,0,0]=3 792 B27R3.368229477 Cc1ccc(cc1)C(C)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100011261388_100000039610 [0,1,0,0,1,0|1,0,0]=3 793 B27R3.368229477 Cc1ccc(cc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000219977_100020672187 [0,1,0,0,1,0|2,0,0]=4 794 B27R3.368229477 Cc1ccc(cc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000219977_100020672187 [0,1,0,0,1,0|2,0,0]=4 795 B27R3.368229477 Cc1ccc(cc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000219977_100020672187 [0,1,0,0,1,0|2,0,0]=4 796 B27R3.368229477 Cc1ccc(cc1)[C@@H](C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100016988085_100000039610 [0,1,0,0,1,0|0,0,0]=2 797 B27R3.368229477 Cc1ccc(cc1)[C@@H](C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100016988085_100000039610 [0,1,0,0,1,0|0,0,0]=2 798 B27R3.368229477 Cc1ccc(cc1)[C@@H](C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000690690_100000039610 [0,1,0,0,1,0|1,0,0]=3 799 B27R3.368229477 Cc1ccc(cc1)[C@@H](C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000690690_100000039610 [0,1,0,0,1,0|1,0,0]=3 800 B27R3.368229477 Cc1ccc(cn1)C(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011815741_100000039610 [0,1,0,0,1,0|1,0,0]=3 801 B27R3.368229477 Cc1ccc(cn1)C(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011815741_100000039610 [0,1,0,0,1,0|1,0,0]=3 802 B27R3.368229477 Cc1ccc(cn1)C(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200011815720_100000039610 [0,1,0,0,1,0|2,0,0]=4 803 B27R3.368229477 Cc1ccc(cn1)C(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200011815720_100000039610 [0,1,0,0,1,0|2,0,0]=4 804 B27R3.368229477 [2H]C(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 34a_217856618577_100000039610 [0,1,0,0,1,0|2,0,0]=4 805 B27R3.368229477 [2H]C(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccc(cc3)F 7a_217856618577_100000039610 [0,1,0,0,1,0|2,0,0]=4 806 B27R3.605750891 CC(CC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 1458a_100000499738_100000756946 [0,1,0,0,1,0|1,0,1]=4 807 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccn3 11a_100000181244_100000499738 [0,1,0,0,1,0|1,0,1]=4 808 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccn3 1626a_100000181244_100000499738 [0,1,0,0,1,0|1,0,1]=4 809 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccn3 240690a_100000181244_100000499738 [0,1,0,0,1,0|1,0,1]=4 810 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccn3 527a_100000181244_100000499738 [0,1,0,0,1,0|1,0,1]=4 811 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccnc3 11a_100000195435_100000499738 [0,1,0,0,1,0|1,0,1]=4 812 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccnc3 240690a_100000195435_100000499738 [0,1,0,0,1,0|1,0,1]=4 813 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccnc3 527a_100000195435_100000499738 [0,1,0,0,1,0|1,0,1]=4 814 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccncc3 240690a_100000181269_100000499738 [0,1,0,0,1,0|1,0,1]=4 815 B27R3.605750891 CC(NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccncc3 527a_100000181269_100000499738 [0,1,0,0,1,0|1,0,1]=4 816 B27R3.605750891 C[C@@H](NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 11a_100000751104_100000499738 [0,1,0,0,1,0|0,0,1]=3 817 B27R3.605750891 C[C@@H](NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 1626a_100000751104_100000499738 [0,1,0,0,1,0|0,0,1]=3 818 B27R3.605750891 C[C@@H](NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 240690a_100000751104_100000499738 [0,1,0,0,1,0|0,0,1]=3 819 B27R3.605750891 C[C@@H](NC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 527a_100000751104_100000499738 [0,1,0,0,1,0|0,0,1]=3 820 B27R3.605750922 Cn1c(=O)c2c(ncn2CCNC(C)(C)c3ccccc3)n(c1=O)C 2230a_100011218174_100000039610 [0,1,0,0,1,0|0,0,0]=2 821 B27R3.605750922 Cn1c(=O)c2c(ncn2CCNC(C)(C)c3ccccn3)n(c1=O)C 2230a_100011999416_100000039610 [0,1,0,0,1,0|1,0,0]=3 822 B27R3.605750922 Cn1c(=O)c2c(ncn2CCNC(C)(C)c3cccnc3)n(c1=O)C 2230a_100011376175_100000039610 [0,1,0,0,1,0|1,0,0]=3 823 B27R3.605750922 Cn1c(=O)c2c(ncn2CCOC(C)(C)c3ccccc3)n(c1=O)C 7a_100000694644_100000039610 [0,1,0,0,1,0|1,0,0]=3 824 B27R3.605750922 Cn1c(=O)c2c(ncn2CCOC(C)(C)c3ccccn3)n(c1=O)C 7a_100000041474_100000039610 [0,1,0,0,1,0|2,0,0]=4 825 B27R3.605750922 Cn1c(=O)c2c(ncn2CCSC(C)(C)c3ccccc3)n(c1=O)C 62a_100000034625_100000039610 [0,1,0,0,1,0|1,0,0]=3 826 B27R3.605750922 Cn1c(=O)c2c(ncn2CCSC(C)(C)c3ccccc3)n(c1=O)C 62a_100000039610_100000034625 [0,1,0,0,1,0|1,0,0]=3 827 B27R3.605750922 Cn1c(=O)c2c(ncn2CCSC(F)(F)c3ccccc3)n(c1=O)C 62a_100000039610_100000036403 [0,1,0,0,1,0|2,0,0]=4 828 B27R3.737937354 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Br 2230a_100020642005_100000039610 [0,1,0,0,1,0|0,0,0]=2 829 B27R3.737937354 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Cl 2230a_100102723534_100000039610 [0,1,0,0,1,0|0,0,0]=2 830 B27R3.737937354 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Cl 34a_100102723534_100000039610 [0,1,0,0,1,0|0,0,0]=2 831 B27R3.737937354 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)O 2230a_100000740644_100000039610 [0,1,0,0,1,0|0,0,0]=2 832 B27R3.737937354 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(n3)Br 2230a_200010173468_100000039610 [0,1,0,0,1,0|1,0,0]=3 833 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cc(ccn3)Cl 7a_100000144657_100000039610 [0,1,0,0,1,0|2,0,0]=4 834 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Br 34a_100000246457_100000039610 [0,1,0,0,1,0|1,0,0]=3 835 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Br 7a_100000246457_100000039610 [0,1,0,0,1,0|1,0,0]=3 836 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)F 34a_100000744526_100000039610 [0,1,0,0,1,0|1,0,0]=3 837 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)F 7a_100000744526_100000039610 [0,1,0,0,1,0|1,0,0]=3 838 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)I 34a_100013085317_100000039610 [0,1,0,0,1,0|1,0,0]=3 839 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)I 7a_100013085317_100000039610 [0,1,0,0,1,0|1,0,0]=3 840 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)N 34a_100011217120_100000039610 [0,1,0,0,1,0|1,0,0]=3 841 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)N 7a_100011217120_100000039610 [0,1,0,0,1,0|1,0,0]=3 842 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(n3)Br 7a_100009820884_100000039610 [0,1,0,0,1,0|2,0,0]=4 843 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cncc(c3)Br 34a_100012351597_100000039610 [0,1,0,0,1,0|2,0,0]=4 844 B27R3.737937354 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cncc(c3)Br 7a_100012351597_100000039610 [0,1,0,0,1,0|2,0,0]=4 845 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Br 2230a_100000219648_100020672187 [0,1,0,0,1,0|2,0,0]=4 846 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Br 269982a_100000219648_100020672187 [0,1,0,0,1,0|2,0,0]=4 847 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Br 34a_100000219648_100020672187 [0,1,0,0,1,0|2,0,0]=4 848 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Cl 2230a_100000220044_100020672187 [0,1,0,0,1,0|2,0,0]=4 849 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Cl 269982a_100000220044_100020672187 [0,1,0,0,1,0|2,0,0]=4 850 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Cl 34a_100000220044_100020672187 [0,1,0,0,1,0|2,0,0]=4 851 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)F 2230a_100020633736_100020672187 [0,1,0,0,1,0|2,0,0]=4 852 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)F 269982a_100020633736_100020672187 [0,1,0,0,1,0|2,0,0]=4 853 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)F 34a_100020633736_100020672187 [0,1,0,0,1,0|2,0,0]=4 854 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)I 2230a_100000221217_100020672187 [0,1,0,0,1,0|2,0,0]=4 855 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)I 269982a_100000221217_100020672187 [0,1,0,0,1,0|2,0,0]=4 856 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)I 34a_100000221217_100020672187 [0,1,0,0,1,0|2,0,0]=4 857 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)O 2230a_100000756613_100020672187 [0,1,0,0,1,0|2,0,0]=4 858 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)O 269982a_100000756613_100020672187 [0,1,0,0,1,0|2,0,0]=4 859 B27R3.737937354 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)O 34a_100000756613_100020672187 [0,1,0,0,1,0|2,0,0]=4 860 B27R3.737937354 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)F 2230a_100015193778_100000039610 [0,1,0,0,1,0|0,0,0]=2 861 B27R3.737937354 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)F 34a_100015193778_100000039610 [0,1,0,0,1,0|0,0,0]=2 862 B27R3.737937354 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cncc(c3)Br 2230a_100012350620_100000039610 [0,1,0,0,1,0|1,0,0]=3 863 B27R3.737937354 C[C@@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Cl 34a_100000747380_100000039610 [0,1,0,0,1,0|1,0,0]=3 864 B27R3.737937354 C[C@@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(c3)Cl 7a_100000747380_100000039610 [0,1,0,0,1,0|1,0,0]=3 865 B27R3.737937354 C[C@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(n3)F 2230a_100025709760_100000039610 [0,1,0,0,1,0|1,0,0]=3 866 B27R3.737937354 C[C@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccc(n3)F 34a_100025709760_100000039610 [0,1,0,0,1,0|1,0,0]=3 867 B27R3.737937354 Cc1cccc(c1)C(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000757818_100000039610 [0,1,0,0,1,0|1,0,0]=3 868 B27R3.737937354 Cc1cccc(c1)C(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000757818_100000039610 [0,1,0,0,1,0|1,0,0]=3 869 B27R3.737937354 Cc1cccc(c1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000219674_100020672187 [0,1,0,0,1,0|2,0,0]=4 870 B27R3.737937354 Cc1cccc(c1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000219674_100020672187 [0,1,0,0,1,0|2,0,0]=4 871 B27R3.737937354 Cc1cccc(c1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000219674_100020672187 [0,1,0,0,1,0|2,0,0]=4 872 B27R3.737937354 Cc1cccc(c1)[C@@H](C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000698126_100000039610 [0,1,0,0,1,0|0,0,0]=2 873 B27R3.737937354 Cc1cccc(c1)[C@@H](C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000698126_100000039610 [0,1,0,0,1,0|0,0,0]=2 874 B27R3.737937354 Cc1cccc(n1)C(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011877385_100000039610 [0,1,0,0,1,0|1,0,0]=3 875 B27R3.737937354 Cc1cccc(n1)C(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200011877368_100000039610 [0,1,0,0,1,0|2,0,0]=4 876 B27R3.737937354 Cc1cccc(n1)C(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200011877368_100000039610 [0,1,0,0,1,0|2,0,0]=4 877 B27R3.737937354 Cc1ccnc(c1)C(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011933787_100000039610 [0,1,0,0,1,0|1,0,0]=3 878 B29R3.639615223 CCC(C#Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200000065154_100000039610 [0,1,0,0,0,1|1,0,1]=4 879 B29R3.639615223 CCC(C#Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200000065154_100000039610 [0,1,0,0,0,1|1,0,1]=4 880 B29R3.639615223 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccc3 2230a_100000741020_100020672187 [0,1,0,0,0,1|2,0,0]=4 881 B29R3.639615223 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccc3 269982a_100000741020_100020672187 [0,1,0,0,0,1|2,0,0]=4 882 B29R3.639615223 Cn1c(=O)c2c(ncn2CCOC(CN)COc3ccccc3)n(c1=O)C 34a_100000738913_100000039610 [0,1,0,0,0,1|1,0,0]=3 883 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)Br 2230a_100000752880_100020672187 [0,1,0,0,0,1|2,0,0]=4 884 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)Br 269982a_100000752880_100020672187 [0,1,0,0,0,1|2,0,0]=4 885 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)Br 34a_100000752880_100020672187 [0,1,0,0,0,1|2,0,0]=4 886 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)Cl 2230a_100000698262_100020672187 [0,1,0,0,0,1|2,0,0]=4 887 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)Cl 269982a_100000698262_100020672187 [0,1,0,0,0,1|2,0,0]=4 888 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)Cl 34a_100000698262_100020672187 [0,1,0,0,0,1|2,0,0]=4 889 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)F 2230a_100102946585_100020672187 [0,1,0,0,0,1|2,0,0]=4 890 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)F 269982a_100102946585_100020672187 [0,1,0,0,0,1|2,0,0]=4 891 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)F 34a_100102946585_100020672187 [0,1,0,0,0,1|2,0,0]=4 892 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)O 2230a_100016989440_100020672187 [0,1,0,0,0,1|2,0,0]=4 893 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)O 269982a_100016989440_100020672187 [0,1,0,0,0,1|2,0,0]=4 894 B29R3.821711880 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccc(cc3)O 34a_100016989440_100020672187 [0,1,0,0,0,1|2,0,0]=4 895 B29R3.821711880 Cc1ccc(cc1)OCC(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000743913_100000039610 [0,1,0,0,0,1|0,0,0]=2 896 B29R3.821711880 Cc1ccc(cc1)OCC(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000743913_100000039610 [0,1,0,0,0,1|0,0,0]=2 897 B29R3.821711880 Cc1ccc(cc1)OCC(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011217472_100000039610 [0,1,0,0,0,1|1,0,0]=3 898 B29R3.821711880 Cc1ccc(cc1)OCC(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011217472_100000039610 [0,1,0,0,0,1|1,0,0]=3 899 B29R3.3187887223 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccc3F 2230a_100000232559_100020672187 [0,1,0,0,0,1|2,0,0]=4 900 B29R3.3187887223 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccc3F 269982a_100000232559_100020672187 [0,1,0,0,0,1|2,0,0]=4 901 B29R3.3187887223 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3ccccc3F 34a_100000232559_100020672187 [0,1,0,0,0,1|2,0,0]=4 902 B29R3.3187887223 Cc1ccccc1OCC(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000744241_100000039610 [0,1,0,0,0,1|0,0,0]=2 903 B29R3.3187887223 Cc1ccccc1OCC(C)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000744241_100000039610 [0,1,0,0,0,1|0,0,0]=2 904 B29R3.3187887223 Cc1ccccc1OCC(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200011217337_100000039610 [0,1,0,0,0,1|1,0,0]=3 905 B29R3.3187887223 Cc1ccccc1OCC(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200011217337_100000039610 [0,1,0,0,0,1|1,0,0]=3 906 B29R3.3560465354 CC(CCc1ccccc1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100011435293_100000039610 [0,1,0,0,0,1|1,0,0]=3 907 B29R3.3560465354 CC(SCc1ccccc1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000149570_100000039610 [0,1,0,0,0,1|1,0,0]=3 908 B29R3.3560465354 C[C@H](OCc1ccccc1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000703211_100000039610 [0,1,0,0,0,1|1,0,0]=3 909 B29R3.3560465354 Cn1c(=O)c2c(ncn2CCC(=O)C(O)CCc3ccccc3)n(c1=O)C 1458a_100000242596_100000039610 [0,1,0,0,0,1|2,0,0]=4 910 B29R3.3560465393 CC(CCc1ccccc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_100000210798_100000499738 [0,1,0,0,0,1|0,0,1]=3 911 B29R3.3560465393 CC(CCc1ccccc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_100000210798_100000499738 [0,1,0,0,0,1|0,0,1]=3 912 B29R3.3560465393 CC(CCc1ccccc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100000210798_100000499738 [0,1,0,0,0,1|0,0,1]=3 913 B29R3.3560465393 CC(CCc1ccccc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100000210798_100000499738 [0,1,0,0,0,1|0,0,1]=3 914 B29R3.3560465393 CC(COc1ccccc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_100000746794_100000499738 [0,1,0,0,0,1|0,0,1]=3 915 B29R3.3560465393 CC(COc1ccccc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_100000746794_100000499738 [0,1,0,0,0,1|0,0,1]=3 916 B29R3.3560465393 CC(COc1ccccc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100000746794_100000499738 [0,1,0,0,0,1|0,0,1]=3 917 B29R3.3560465393 CC(COc1ccccc1)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100000746794_100000499738 [0,1,0,0,0,1|0,0,1]=3 918 B29R3.3560465402 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CC(O)c3ccccc3 2230a_100000227976_100020672187 [0,1,0,0,0,1|2,0,0]=4 919 B29R3.3560465402 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CC(O)c3ccccc3 269982a_100000227976_100020672187 [0,1,0,0,0,1|2,0,0]=4 920 B29R3.3560465407 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)Nc3ccccc3 2230a_100000754830_100000039610 [0,1,0,0,0,1|0,0,1]=3 921 B29R3.3560465407 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)Nc3ccccc3 34a_100000754830_100000039610 [0,1,0,0,0,1|0,0,1]=3 922 B29R3.3560465407 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)Nc3ccccc3 62a_100000039610_100000183986 [0,1,0,0,0,1|1,0,1]=4 923 B29R3.3560465407 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)Nc3ccccc3 62a_100000183986_100000039610 [0,1,0,0,0,1|1,0,1]=4 924 B29R3.4115516094 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3cccc(c3)Cl 2230a_106726388433_100020672187 [0,1,0,0,0,1|2,0,0]=4 925 B29R3.4115516094 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3cccc(c3)Cl 269982a_106726388433_100020672187 [0,1,0,0,0,1|2,0,0]=4 926 B29R3.4115516094 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3cccc(c3)Cl 34a_106726388433_100020672187 [0,1,0,0,0,1|2,0,0]=4 927 B29R3.4115516094 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3cccc(c3)F 2230a_106726388868_100020672187 [0,1,0,0,0,1|2,0,0]=4 928 B29R3.4115516094 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3cccc(c3)F 269982a_106726388868_100020672187 [0,1,0,0,0,1|2,0,0]=4 929 B29R3.4115516094 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCc3cccc(c3)F 34a_106726388868_100020672187 [0,1,0,0,0,1|2,0,0]=4 930 B29R3.4115516094 Cc1cccc(c1)CCN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_114849113767_100020672187 [0,1,0,0,0,1|2,0,0]=4 931 B29R3.4115516094 Cc1cccc(c1)CCN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_114849113767_100020672187 [0,1,0,0,0,1|2,0,0]=4 932 B29R3.4115516094 Cc1cccc(c1)CCN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_114849113767_100020672187 [0,1,0,0,0,1|2,0,0]=4 933 B29R3.4115516094 Cc1cccc(c1)OCC(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200011219432_100000039610 [0,1,0,0,0,1|1,0,0]=3 934 B29R3.4115516094 Cc1cccc(c1)OCC(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200011219432_100000039610 [0,1,0,0,0,1|1,0,0]=3 935 B29R3.8881420423 Cn1c(=O)c2c(ncn2CCOC(C)(C)C#Cc3ccccc3)n(c1=O)C 34a_100011204173_100000039610 [0,1,0,0,0,1|1,0,1]=4 936 B29R3.8881420423 Cn1c(=O)c2c(ncn2CCOC(C)(C)C#Cc3ccccc3)n(c1=O)C 7a_100011204173_100000039610 [0,1,0,0,0,1|1,0,1]=4 937 B29R3.8881420423 Cn1c(=O)c2c(ncn2CCOC(C)(C)CCc3ccccc3)n(c1=O)C 7a_100000750528_100000039610 [0,1,0,0,0,1|1,0,0]=3 938 B29R3.188109831 C#CC(Cc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000685211_100020672187 [0,1,0,0,0,1|1,0,1]=4 939 B29R3.188109831 C#CC(Cc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000685211_100020672187 [0,1,0,0,0,1|1,0,1]=4 940 B29R3.188109831 CCC(Cc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000760156_100020672187 [0,1,0,0,0,1|1,0,0]=3 941 B29R3.188109831 CN[C@H](COCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 34a_100016995599_100000039610 [0,1,0,0,0,1|1,0,0]=3 942 B29R3.188109831 Cn1c(=O)c2c(ncn2CCCNC(C#N)Cc3ccccc3)n(c1=O)C 2230a_100000746547_100020672187 [0,1,0,0,0,1|0,0,1]=3 943 B29R3.188109831 Cn1c(=O)c2c(ncn2CCCNC(CO)Cc3ccccc3)n(c1=O)C 2230a_100000739027_100020672187 [0,1,0,0,0,1|0,0,0]=2 944 B29R3.188109831 Cn1c(=O)c2c(ncn2CCCNC(CO)Cc3cccnc3)n(c1=O)C 2230a_100000717814_100020672187 [0,1,0,0,0,1|1,0,0]=3 945 B29R3.188109831 Cn1c(=O)c2c(ncn2CCCNC(CO)Cc3ccncc3)n(c1=O)C 2230a_100000717866_100020672187 [0,1,0,0,0,1|1,0,0]=3 946 B29R3.188109831 Cn1c(=O)c2c(ncn2CCCOC(CN)Cc3ccccc3)n(c1=O)C 34a_100000752270_100020672187 [0,1,0,0,0,1|1,0,0]=3 947 B29R3.188109831 Cn1c(=O)c2c(ncn2CCCO[C@H](CCl)Cc3ccccc3)n(c1=O)C 7a_100000729385_100020672187 [0,1,0,0,0,1|1,0,0]=3 948 B29R3.188109831 Cn1c(=O)c2c(ncn2CCCSC(C#N)Cc3ccccc3)n(c1=O)C 62a_100000183401_100020672187 [0,1,0,0,0,1|1,0,1]=4 949 B29R3.188109831 Cn1c(=O)c2c(ncn2CCCSC(C#N)Cc3ccccc3)n(c1=O)C 62a_100020672187_100000183401 [0,1,0,0,0,1|1,0,1]=4 950 B29R3.188109831 Cn1c(=O)c2c(ncn2CCNCC(CO)Cc3ccccc3)n(c1=O)C 34a_100160572655_100000039610 [0,1,0,0,0,1|0,0,0]=2 951 B29R3.188109831 Cn1c(=O)c2c(ncn2CCOCC(C#N)Cc3ccccc3)n(c1=O)C 34a_100000684917_100000039610 [0,1,0,0,0,1|1,0,1]=4 952 B29R3.188109831 Cn1c(=O)c2c(ncn2CCOCC(C#N)Cc3ccccc3)n(c1=O)C 7a_100000684917_100000039610 [0,1,0,0,0,1|1,0,1]=4 953 B29R3.188109831 Cn1c(=O)c2c(ncn2CCOCC(CN)Cc3ccccc3)n(c1=O)C 34a_100160572655_100000039610 [0,1,0,0,0,1|1,0,0]=3 954 B29R3.825398523 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccc(cc3)F 2230a_200020586543_100000039610 [0,1,0,0,0,1|1,0,0]=3 955 B29R3.825398523 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccc(cc3)F 34a_200020586543_100000039610 [0,1,0,0,0,1|1,0,0]=3 956 B29R3.825398523 CC(CSCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccc(cc3)F 62a_100000039610_100010228477 [0,1,0,0,0,1|2,0,0]=4 957 B29R3.825398523 CC(CSCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccc(cc3)F 62a_100010228477_100000039610 [0,1,0,0,0,1|2,0,0]=4 958 B29R3.825398523 CC(Cc1ccc(cc1)F)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011351027_100020672187 [0,1,0,0,0,1|1,0,0]=3 959 B29R3.825398523 CC(Cc1ccc(cc1)F)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011351027_100020672187 [0,1,0,0,0,1|1,0,0]=3 960 B29R3.825398523 CC(Cc1ccc(cc1)O)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100102634573_100020672187 [0,1,0,0,0,1|0,0,0]=2 961 B29R3.825398523 CC(Cc1ccc(cc1)O)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100102634573_100020672187 [0,1,0,0,0,1|0,0,0]=2 962 B29R3.825398523 Cc1ccc(cc1)OC(C)CNCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000763606_100000039610 [0,1,0,0,0,1|1,0,0]=3 963 B29R3.825398523 Cc1ccc(cc1)OC(C)CNCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000763606_100000039610 [0,1,0,0,0,1|1,0,0]=3 964 B29R3.825398523 Cn1c(=O)c2c(ncn2CCOCC(N)Cc3ccc(cc3)Cl)n(c1=O)C 34a_100025702442_100000039610 [0,1,0,0,0,1|2,0,0]=4 965 B29R3.3132297521 Cc1cccc(c1)CC(N)COCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000716799_100000039610 [0,1,0,0,0,1|2,0,0]=4 966 B29R3.3132297521 Cc1cccc(n1)CC(C)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200015421231_100020672187 [0,1,0,0,0,1|2,0,0]=4 967 B29R3.3132297521 Cn1c(=O)c2c(ncn2CCOCC(N)Cc3cccc(c3)Br)n(c1=O)C 34a_114802770106_100000039610 [0,1,0,0,0,1|2,0,0]=4 968 B29R3.3132297521 Cn1c(=O)c2c(ncn2CCOCC(N)Cc3cccc(c3)F)n(c1=O)C 34a_200012000099_100000039610 [0,1,0,0,0,1|2,0,0]=4 969 B29R3.3188261937 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3Cl 2230a_100000763343_100000039610 [0,1,0,0,0,1|1,0,0]=3 970 B29R3.3188261937 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3Cl 34a_100000763343_100000039610 [0,1,0,0,0,1|1,0,0]=3 971 B29R3.3188261937 Cn1c(=O)c2c(ncn2CCOCC(N)Cc3ccccc3Cl)n(c1=O)C 34a_100012001541_100000039610 [0,1,0,0,0,1|2,0,0]=4 972 B29R3.3560465353 Cn1c(=O)c2c(ncn2CCCOC(C)(C)Cc3ccccc3)n(c1=O)C 7a_100011215222_100020672187 [0,1,0,0,0,1|1,0,0]=3 973 B29R3.3560465362 CC(CNCCn1cnc2c1c(=O)n(c(=O)n2C)C)N(C)c3ccccc3 2230a_100000245588_100000039610 [0,1,0,0,0,1|1,0,0]=3 974 B29R3.3560465362 CC(SCCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccccc3 62a_100000239700_100020672187 [0,1,0,0,0,1|1,0,1]=4 975 B29R3.3560465362 CC(SCCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccccc3 62a_100020672187_100000239700 [0,1,0,0,0,1|1,0,1]=4 976 B29R3.3560465362 C[C@H](OCCCn1cnc2c1c(=O)n(c(=O)n2C)C)[C@@H](N)c3ccccc3 34a_100134616770_100020672187 [0,1,0,0,0,1|1,0,0]=3 977 B29R3.3560465406 CC(CNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 11a_100000755676_100000499738 [0,1,0,0,0,1|1,0,1]=4 978 B29R3.3560465406 CC(CNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 1626a_100000755676_100000499738 [0,1,0,0,0,1|1,0,1]=4 979 B29R3.3560465406 CC(CNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 240690a_100000755676_100000499738 [0,1,0,0,0,1|1,0,1]=4 980 B29R3.3560465406 CC(CNC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 527a_100000755676_100000499738 [0,1,0,0,0,1|1,0,1]=4 981 B29R3.3560465406 CN(CCC(=O)Cn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 1458a_100000499738_100015196923 [0,1,0,0,0,1|2,0,0]=4 982 B29R3.3560465406 Cn1c(=O)c2c(ncn2CC(=O)NCC(O)Cc3ccccc3)n(c1=O)C 240690a_100000752270_100000499738 [0,1,0,0,0,1|1,0,1]=4 983 B29R3.3560465406 Cn1c(=O)c2c(ncn2CC(=O)NCC(O)Cc3ccccc3)n(c1=O)C 527a_100000752270_100000499738 [0,1,0,0,0,1|1,0,1]=4 984 B29R3.8878481526 CN(CC(=O)CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 1458a_100000745601_100000039610 [0,1,0,0,0,1|2,0,0]=4 985 B29R3.181694125 C#CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 2230a_100000730907_100020672187 [0,2,0,0,0,0|2,0,0]=4 986 B29R3.181694125 C#CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 269982a_100000730907_100020672187 [0,2,0,0,0,0|2,0,0]=4 987 B29R3.181694125 C#CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 34a_100000730907_100020672187 [0,2,0,0,0,0|2,0,0]=4 988 B29R3.181694125 C=CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 2230a_100000196212_100020672187 [0,2,0,0,0,0|2,0,0]=4 989 B29R3.181694125 C=CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 269982a_100000196212_100020672187 [0,2,0,0,0,0|2,0,0]=4 990 B29R3.181694125 CCCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 2230a_100000184400_100020672187 [0,2,0,0,0,0|2,0,0]=4 991 B29R3.181694125 CCCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 269982a_100000184400_100020672187 [0,2,0,0,0,0|2,0,0]=4 992 B29R3.181694125 COCC(Cc1ccccc1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000766165_100000039610 [0,2,0,0,0,0|0,0,0]=2 993 B29R3.181694125 Cn1c(=O)c2c(ncn2CCCN(CC#N)Cc3ccccc3)n(c1=O)C 2230a_100000743013_100020672187 [0,2,0,0,0,0|2,0,0]=4 994 B29R3.181694125 Cn1c(=O)c2c(ncn2CCCN(CCO)Cc3ccccc3)n(c1=O)C 2230a_100000180844_100020672187 [0,2,0,0,0,0|2,0,0]=4 995 B29R3.181694125 Cn1c(=O)c2c(ncn2CCCN(CCO)Cc3ccccc3)n(c1=O)C 269982a_100000180844_100020672187 [0,2,0,0,0,0|2,0,0]=4 996 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Br 2230a_100000187385_100020672187 [0,2,0,0,0,0|2,0,0]=4 997 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Br 269982a_100000187385_100020672187 [0,2,0,0,0,0|2,0,0]=4 998 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)C 2230a_100000180869_100020672187 [0,2,0,0,0,0|2,0,0]=4 999 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)C 269982a_100000180869_100020672187 [0,2,0,0,0,0|2,0,0]=4 1000 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Cl 2230a_100000180830_100020672187 [0,2,0,0,0,0|2,0,0]=4 1001 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)Cl 269982a_100000180830_100020672187 [0,2,0,0,0,0|2,0,0]=4 1002 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 2230a_100015183324_100020672187 [0,2,0,0,0,0|2,0,0]=4 1003 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 269982a_100015183324_100020672187 [0,2,0,0,0,0|2,0,0]=4 1004 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)F 34a_100015183324_100020672187 [0,2,0,0,0,0|2,0,0]=4 1005 B29R3.639615224 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)O 269982a_100000748449_100020672187 [0,2,0,0,0,0|2,0,0]=4 1006 B29R3.639615224 Cc1ccc(cc1)CC(C#N)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000039610_100000697087 [0,2,0,0,0,0|1,0,1]=4 1007 B29R3.639615224 Cc1ccc(cc1)CC(C#N)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000697087_100000039610 [0,2,0,0,0,0|1,0,1]=4 1008 B29R3.639615224 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3ccc(cc3)Cl)n(c1=O)C 2230a_100025702442_100000039610 [0,2,0,0,0,0|0,0,0]=2 1009 B29R3.639615224 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3ccc(cc3)Cl)n(c1=O)C 34a_100025702442_100000039610 [0,2,0,0,0,0|0,0,0]=2 1010 B29R3.639615224 Cn1c(=O)c2c(ncn2CCN[C@@H](CO)Cc3ccc(cc3)O)n(c1=O)C 2230a_100020629837_100000039610 [0,2,0,0,0,0|0,0,0]=2 1011 B29R3.639615224 Cn1c(=O)c2c(ncn2CCN[C@@H](CO)Cc3ccc(cc3)O)n(c1=O)C 34a_100020629837_100000039610 [0,2,0,0,0,0|0,0,0]=2 1012 B29R3.639615227 Cn1c(=O)c2c(ncn2CCN[C@H](CO)[C@H](O)c3ccccc3)n(c1=O)C 2230a_100000004308_100000039610 [0,2,0,0,0,0|0,0,0]=2 1013 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3C 2230a_100000201206_100020672187 [0,2,0,0,0,0|2,0,0]=4 1014 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3C 269982a_100000201206_100020672187 [0,2,0,0,0,0|2,0,0]=4 1015 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Cl 2230a_100000201176_100020672187 [0,2,0,0,0,0|2,0,0]=4 1016 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3Cl 269982a_100000201176_100020672187 [0,2,0,0,0,0|2,0,0]=4 1017 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 2230a_100015186831_100020672187 [0,2,0,0,0,0|2,0,0]=4 1018 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 269982a_100015186831_100020672187 [0,2,0,0,0,0|2,0,0]=4 1019 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3F 34a_100015186831_100020672187 [0,2,0,0,0,0|2,0,0]=4 1020 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3O 2230a_100011223546_100020672187 [0,2,0,0,0,0|2,0,0]=4 1021 B29R3.639615265 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3O 269982a_100011223546_100020672187 [0,2,0,0,0,0|2,0,0]=4 1022 B29R3.639615265 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3ccccc3Cl)n(c1=O)C 2230a_100012001541_100000039610 [0,2,0,0,0,0|0,0,0]=2 1023 B29R3.639615265 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3ccccc3Cl)n(c1=O)C 34a_100012001541_100000039610 [0,2,0,0,0,0|0,0,0]=2 1024 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(C#N)Cc3ccccc3)n(c1=O)C 11a_100000746547_100000499738 [0,2,0,0,0,0|0,0,2]=4 1025 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(C#N)Cc3ccccc3)n(c1=O)C 1626a_100000746547_100000499738 [0,2,0,0,0,0|0,0,2]=4 1026 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(C#N)Cc3ccccc3)n(c1=O)C 240690a_100000746547_100000499738 [0,2,0,0,0,0|0,0,2]=4 1027 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(C#N)Cc3ccccc3)n(c1=O)C 527a_100000746547_100000499738 [0,2,0,0,0,0|0,0,2]=4 1028 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(CO)Cc3ccccc3)n(c1=O)C 240690a_100000739027_100000499738 [0,2,0,0,0,0|0,0,1]=3 1029 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(CO)Cc3ccccc3)n(c1=O)C 527a_100000739027_100000499738 [0,2,0,0,0,0|0,0,1]=3 1030 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(CO)Cc3cccnc3)n(c1=O)C 240690a_100000717814_100000499738 [0,2,0,0,0,0|1,0,1]=4 1031 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(CO)Cc3ccncc3)n(c1=O)C 240690a_100000717866_100000499738 [0,2,0,0,0,0|1,0,1]=4 1032 B29R3.641855973 Cn1c(=O)c2c(ncn2CC(=O)NC(CO)Cc3ccncc3)n(c1=O)C 527a_100000717866_100000499738 [0,2,0,0,0,0|1,0,1]=4 1033 B29R3.642024142 CCC(Oc1ccccc1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000211556_100000039610 [0,2,0,0,0,0|2,0,0]=4 1034 B29R3.642024142 CCC(Sc1ccccc1)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000230495_100000039610 [0,2,0,0,0,0|2,0,0]=4 1035 B29R3.642024142 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)[C@H](CO)Cc3ccccc3 2230a_100016995599_100000039610 [0,2,0,0,0,0|0,0,0]=2 1036 B29R3.642024142 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)[C@H](CO)Cc3ccccc3 269982a_100016995599_100000039610 [0,2,0,0,0,0|0,0,0]=2 1037 B29R3.642024142 Cn1c(=O)c2c(ncn2CCC(=O)C(C#N)Cc3ccccc3)n(c1=O)C 1458a_100000075392_100000039610 [0,2,0,0,0,0|1,0,1]=4 1038 B29R3.1377445447 CCC(C)(Cc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011346069_100000039610 [0,2,0,0,0,0|1,0,0]=3 1039 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Br 2230a_100000187426_100020672187 [0,2,0,0,0,0|2,0,0]=4 1040 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Br 269982a_100000187426_100020672187 [0,2,0,0,0,0|2,0,0]=4 1041 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)C 2230a_102516607250_100020672187 [0,2,0,0,0,0|2,0,0]=4 1042 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)C 269982a_102516607250_100020672187 [0,2,0,0,0,0|2,0,0]=4 1043 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Cl 2230a_100000201194_100020672187 [0,2,0,0,0,0|2,0,0]=4 1044 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)Cl 269982a_100000201194_100020672187 [0,2,0,0,0,0|2,0,0]=4 1045 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 2230a_100000195558_100020672187 [0,2,0,0,0,0|2,0,0]=4 1046 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 269982a_100000195558_100020672187 [0,2,0,0,0,0|2,0,0]=4 1047 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)F 34a_100000195558_100020672187 [0,2,0,0,0,0|2,0,0]=4 1048 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)O 2230a_100000201218_100020672187 [0,2,0,0,0,0|2,0,0]=4 1049 B29R3.4765829070 CCN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)O 269982a_100000201218_100020672187 [0,2,0,0,0,0|2,0,0]=4 1050 B29R3.4765829070 Cc1cccc(c1)CC(CO)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000716799_100000039610 [0,2,0,0,0,0|0,0,0]=2 1051 B29R3.4765829070 Cc1cccc(c1)CC(CO)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000716799_100000039610 [0,2,0,0,0,0|0,0,0]=2 1052 B29R3.4765829070 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3cccc(c3)Br)n(c1=O)C 2230a_114802770106_100000039610 [0,2,0,0,0,0|0,0,0]=2 1053 B29R3.4765829070 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3cccc(c3)Br)n(c1=O)C 34a_114802770106_100000039610 [0,2,0,0,0,0|0,0,0]=2 1054 B29R3.4765829070 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3cccc(c3)F)n(c1=O)C 2230a_200012000099_100000039610 [0,2,0,0,0,0|0,0,0]=2 1055 B29R3.4765829070 Cn1c(=O)c2c(ncn2CCNC(CO)Cc3cccc(c3)F)n(c1=O)C 34a_200012000099_100000039610 [0,2,0,0,0,0|0,0,0]=2 1056 B29R3.8881420466 CC(C)N(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 2230a_100000068392_100020672187 [0,2,0,0,0,0|2,0,0]=4 1057 B29R3.8881420466 CC(C)N(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 269982a_100000068392_100020672187 [0,2,0,0,0,0|2,0,0]=4 1058 B29R3.8881420466 Cn1c(=O)c2c(ncn2CCNC(Cc3ccccc3)C(=O)N)n(c1=O)C 2230a_100000745710_100000039610 [0,2,0,0,0,0|0,0,1]=3 1059 B29R3.8881420466 Cn1c(=O)c2c(ncn2CCNC(Cc3ccccc3)C(=O)N)n(c1=O)C 34a_100000745710_100000039610 [0,2,0,0,0,0|0,0,1]=3 1060 B29R3.231549841 CCc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000683253_100020672187 [0,2,0,0,0,0|2,0,0]=4 1061 B29R3.231549841 CCc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000683253_100020672187 [0,2,0,0,0,0|2,0,0]=4 1062 B29R3.231549841 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)C#N 2230a_100000217971_100020672187 [0,2,0,0,0,0|2,0,0]=4 1063 B29R3.231549841 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)C#N 269982a_100000217971_100020672187 [0,2,0,0,0,0|2,0,0]=4 1064 B29R3.231549841 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3)C#N 34a_100000217971_100020672187 [0,2,0,0,0,0|2,0,0]=4 1065 B29R3.231549841 COc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000184145_100020672187 [0,2,0,0,0,0|2,0,0]=4 1066 B29R3.231549841 COc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000184145_100020672187 [0,2,0,0,0,0|2,0,0]=4 1067 B29R3.231549841 CSc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_102495365258_100020672187 [0,2,0,0,0,0|2,0,0]=4 1068 B29R3.231549841 CSc1ccc(cc1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_102495365258_100020672187 [0,2,0,0,0,0|2,0,0]=4 1069 B29R3.819951856 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(c(c3)Cl)Cl 2230a_100000184578_100020672187 [0,2,0,0,0,0|2,0,0]=4 1070 B29R3.819951856 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(c(c3)Cl)Cl 269982a_100000184578_100020672187 [0,2,0,0,0,0|2,0,0]=4 1071 B29R3.819951856 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(c(c3)Cl)Cl 34a_100000184578_100020672187 [0,2,0,0,0,0|2,0,0]=4 1072 B29R3.819951856 Cc1ccc(cc1C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100015204808_100020672187 [0,2,0,0,0,0|2,0,0]=4 1073 B29R3.819951856 Cc1ccc(cc1C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100015204808_100020672187 [0,2,0,0,0,0|2,0,0]=4 1074 B29R3.819951856 Cc1ccc(cc1C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100015204808_100020672187 [0,2,0,0,0,0|2,0,0]=4 1075 B29R3.820166455 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccc(cc3)Br 62a_100000039610_100000184162 [0,2,0,0,0,0|1,0,1]=4 1076 B29R3.820166455 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccc(cc3)Br 62a_100000184162_100000039610 [0,2,0,0,0,0|1,0,1]=4 1077 B29R3.820166455 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccc(cc3)Cl 62a_100000039610_100000183210 [0,2,0,0,0,0|1,0,1]=4 1078 B29R3.820166455 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccc(cc3)Cl 62a_100000183210_100000039610 [0,2,0,0,0,0|1,0,1]=4 1079 B29R3.820166455 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccc(cc3)F 62a_100000039610_100000229918 [0,2,0,0,0,0|1,0,1]=4 1080 B29R3.820166455 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccc(cc3)F 62a_100000229918_100000039610 [0,2,0,0,0,0|1,0,1]=4 1081 B29R3.820166455 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccc(cc3)O 62a_100000039610_200010205864 [0,2,0,0,0,0|1,0,1]=4 1082 B29R3.820166455 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccc(cc3)O 62a_200010205864_100000039610 [0,2,0,0,0,0|1,0,1]=4 1083 B29R3.820166455 CC(c1ccc(cc1)Br)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000231103_100020672187 [0,2,0,0,0,0|2,0,0]=4 1084 B29R3.820166455 CC(c1ccc(cc1)Br)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000231103_100020672187 [0,2,0,0,0,0|2,0,0]=4 1085 B29R3.820166455 CC(c1ccc(cc1)Cl)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000231102_100020672187 [0,2,0,0,0,0|2,0,0]=4 1086 B29R3.820166455 CC(c1ccc(cc1)Cl)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000231102_100020672187 [0,2,0,0,0,0|2,0,0]=4 1087 B29R3.820166455 CC(c1ccc(cc1)F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000222788_100020672187 [0,2,0,0,0,0|2,0,0]=4 1088 B29R3.820166455 CC(c1ccc(cc1)F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000222788_100020672187 [0,2,0,0,0,0|2,0,0]=4 1089 B29R3.820166455 CC(c1ccc(cc1)F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000222788_100020672187 [0,2,0,0,0,0|2,0,0]=4 1090 B29R3.820166455 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)[C@@H](O)c3ccc(cc3)Cl 2230a_200009830414_100000039610 [0,2,0,0,0,0|0,0,0]=2 1091 B29R3.820166455 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)[C@@H](O)c3ccc(cc3)Cl 34a_200009830414_100000039610 [0,2,0,0,0,0|0,0,0]=2 1092 B29R3.820166455 Cc1ccc(cc1)C(=O)C(C)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000039610_100000726416 [0,2,0,0,0,0|1,0,1]=4 1093 B29R3.820166455 Cc1ccc(cc1)C(=O)C(C)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000726416_100000039610 [0,2,0,0,0,0|1,0,1]=4 1094 B29R3.825564297 CC(Cc1ccc(cc1)O)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_100102634573_100000499738 [0,2,0,0,0,0|0,0,1]=3 1095 B29R3.825564297 CC(Cc1ccc(cc1)O)NC(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_100102634573_100000499738 [0,2,0,0,0,0|0,0,1]=3 1096 B29R3.825685475 CC(Cc1ccc(cc1)Br)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000695199_100000039610 [0,2,0,0,0,0|1,0,0]=3 1097 B29R3.825685475 CC(Cc1ccc(cc1)F)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000746122_100000039610 [0,2,0,0,0,0|1,0,0]=3 1098 B29R3.825685475 CC(Oc1ccc(cc1)Br)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000181392_100000039610 [0,2,0,0,0,0|2,0,0]=4 1099 B29R3.825685475 CC(Oc1ccc(cc1)Cl)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000184027_100000039610 [0,2,0,0,0,0|2,0,0]=4 1100 B29R3.825685475 CC(Oc1ccc(cc1)F)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000203723_100000039610 [0,2,0,0,0,0|2,0,0]=4 1101 B29R3.825685475 CC(Sc1ccc(cc1)Cl)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000178403_100000039610 [0,2,0,0,0,0|2,0,0]=4 1102 B29R3.825685475 CC(Sc1ccc(cc1)F)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000181075_100000039610 [0,2,0,0,0,0|2,0,0]=4 1103 B29R3.825685475 C[C@@H](Oc1ccc(cc1)O)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000005562_100000039610 [0,2,0,0,0,0|2,0,0]=4 1104 B29R3.825685475 Cc1ccc(cc1)OC(C)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000183867_100000039610 [0,2,0,0,0,0|2,0,0]=4 1105 B29R3.825685475 Cc1ccc(cc1)SC(C)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000181072_100000039610 [0,2,0,0,0,0|2,0,0]=4 1106 B29R3.825685475 Cn1c(=O)c2c(ncn2CCC(=O)C(O)Cc3ccc(cc3)Cl)n(c1=O)C 1458a_100012362158_100000039610 [0,2,0,0,0,0|2,0,0]=4 1107 B29R3.825685475 Cn1c(=O)c2c(ncn2CCC(=O)C(O)Cc3ccc(cc3)F)n(c1=O)C 1458a_100012179405_100000039610 [0,2,0,0,0,0|2,0,0]=4 1108 B29R3.825685475 Cn1c(=O)c2c(ncn2CCC(=O)C(O)Cc3ccc(cc3)O)n(c1=O)C 1458a_100015278814_100000039610 [0,2,0,0,0,0|2,0,0]=4 1109 B29R3.825685475 Cn1c(=O)c2c(ncn2CCC(=O)[C@@H](O)Cc3ccc(cc3)Br)n(c1=O)C 1458a_200015644258_100000039610 [0,2,0,0,0,0|2,0,0]=4 1110 B29R3.3069414378 Cc1ccc(cc1)CC(C)(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200011350412_100000039610 [0,2,0,0,0,0|1,0,0]=3 1111 B29R3.3069414378 Cn1c(=O)c2c(ncn2CCNC(C)(C)Cc3ccc(cc3)F)n(c1=O)C 2230a_100015243227_100000039610 [0,2,0,0,0,0|0,0,0]=2 1112 B29R3.3069414378 Cn1c(=O)c2c(ncn2CCNC(C)(C)Cc3ccc(cc3)F)n(c1=O)C 34a_100015243227_100000039610 [0,2,0,0,0,0|0,0,0]=2 1113 B29R3.3069414378 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3ccc(cc3)Cl)n(c1=O)C 34a_200011350411_100000039610 [0,2,0,0,0,0|1,0,0]=3 1114 B29R3.3069414378 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3ccc(cc3)Cl)n(c1=O)C 7a_200011350411_100000039610 [0,2,0,0,0,0|1,0,0]=3 1115 B29R3.3069414378 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3ccc(cc3)F)n(c1=O)C 34a_200011350416_100000039610 [0,2,0,0,0,0|1,0,0]=3 1116 B29R3.3069414378 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3ccc(cc3)F)n(c1=O)C 7a_200011350416_100000039610 [0,2,0,0,0,0|1,0,0]=3 1117 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3Br)F 2230a_200011192132_100020672187 [0,2,0,0,0,0|2,0,0]=4 1118 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3Br)F 269982a_200011192132_100020672187 [0,2,0,0,0,0|2,0,0]=4 1119 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3Br)F 34a_200011192132_100020672187 [0,2,0,0,0,0|2,0,0]=4 1120 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3Cl)Cl 2230a_100015189987_100020672187 [0,2,0,0,0,0|2,0,0]=4 1121 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3Cl)Cl 269982a_100015189987_100020672187 [0,2,0,0,0,0|2,0,0]=4 1122 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3Cl)Cl 34a_100015189987_100020672187 [0,2,0,0,0,0|2,0,0]=4 1123 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3F)F 2230a_100000207661_100020672187 [0,2,0,0,0,0|2,0,0]=4 1124 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3F)F 269982a_100000207661_100020672187 [0,2,0,0,0,0|2,0,0]=4 1125 B29R3.4140833958 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccc(cc3F)F 34a_100000207661_100020672187 [0,2,0,0,0,0|2,0,0]=4 1126 B29R3.4140833958 Cc1ccc(c(c1)C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100025771030_100020672187 [0,2,0,0,0,0|2,0,0]=4 1127 B29R3.4140833958 Cc1ccc(c(c1)C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100025771030_100020672187 [0,2,0,0,0,0|2,0,0]=4 1128 B29R3.4140833958 Cc1ccc(c(c1)C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100025771030_100020672187 [0,2,0,0,0,0|2,0,0]=4 1129 B29R3.2769231996 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3C#N 2230a_100000225633_100020672187 [0,2,0,0,0,0|2,0,0]=4 1130 B29R3.2769231996 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3C#N 269982a_100000225633_100020672187 [0,2,0,0,0,0|2,0,0]=4 1131 B29R3.2769231996 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3CO 2230a_100000044721_100020672187 [0,2,0,0,0,0|2,0,0]=4 1132 B29R3.2769231996 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3CO 269982a_100000044721_100020672187 [0,2,0,0,0,0|2,0,0]=4 1133 B29R3.2769231996 COc1ccccc1CC(C)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000691916_100000039610 [0,2,0,0,0,0|1,0,0]=3 1134 B29R3.2769231996 COc1ccccc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000184376_100020672187 [0,2,0,0,0,0|2,0,0]=4 1135 B29R3.2769231996 COc1ccccc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000184376_100020672187 [0,2,0,0,0,0|2,0,0]=4 1136 B29R3.3187258282 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccccc3Cl 62a_100000039610_100010255250 [0,2,0,0,0,0|1,0,1]=4 1137 B29R3.3187258282 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3ccccc3Cl 62a_100010255250_100000039610 [0,2,0,0,0,0|1,0,1]=4 1138 B29R3.3187258282 CC(c1ccccc1Br)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000692418_100020672187 [0,2,0,0,0,0|2,0,0]=4 1139 B29R3.3187258282 CC(c1ccccc1Br)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000692418_100020672187 [0,2,0,0,0,0|2,0,0]=4 1140 B29R3.3187258282 CC(c1ccccc1F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000231110_100020672187 [0,2,0,0,0,0|2,0,0]=4 1141 B29R3.3187258282 CC(c1ccccc1F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000231110_100020672187 [0,2,0,0,0,0|2,0,0]=4 1142 B29R3.3187258282 CC(c1ccccc1F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000231110_100020672187 [0,2,0,0,0,0|2,0,0]=4 1143 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3Br)Cl 2230a_100000711432_100020672187 [0,2,0,0,0,0|2,0,0]=4 1144 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3Br)Cl 269982a_100000711432_100020672187 [0,2,0,0,0,0|2,0,0]=4 1145 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3Cl)Cl 2230a_106354212996_100020672187 [0,2,0,0,0,0|2,0,0]=4 1146 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3Cl)Cl 269982a_106354212996_100020672187 [0,2,0,0,0,0|2,0,0]=4 1147 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3Cl)Cl 34a_106354212996_100020672187 [0,2,0,0,0,0|2,0,0]=4 1148 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3F)Br 2230a_100000748472_100020672187 [0,2,0,0,0,0|2,0,0]=4 1149 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3F)Br 269982a_100000748472_100020672187 [0,2,0,0,0,0|2,0,0]=4 1150 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3F)Br 34a_100000748472_100020672187 [0,2,0,0,0,0|2,0,0]=4 1151 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3F)F 2230a_100000724026_100020672187 [0,2,0,0,0,0|2,0,0]=4 1152 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3F)F 269982a_100000724026_100020672187 [0,2,0,0,0,0|2,0,0]=4 1153 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3F)F 34a_100000724026_100020672187 [0,2,0,0,0,0|2,0,0]=4 1154 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3O)Br 2230a_100011602694_100020672187 [0,2,0,0,0,0|2,0,0]=4 1155 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3O)Br 269982a_100011602694_100020672187 [0,2,0,0,0,0|2,0,0]=4 1156 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3O)Cl 2230a_100000712467_100020672187 [0,2,0,0,0,0|2,0,0]=4 1157 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3O)Cl 269982a_100000712467_100020672187 [0,2,0,0,0,0|2,0,0]=4 1158 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3O)F 2230a_114855342409_100020672187 [0,2,0,0,0,0|2,0,0]=4 1159 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3O)F 269982a_114855342409_100020672187 [0,2,0,0,0,0|2,0,0]=4 1160 B29R3.3203558922 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(ccc3O)F 34a_114855342409_100020672187 [0,2,0,0,0,0|2,0,0]=4 1161 B29R3.3203558922 Cc1ccc(c(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C)F 2230a_102515433075_100020672187 [0,2,0,0,0,0|2,0,0]=4 1162 B29R3.3203558922 Cc1ccc(c(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C)F 269982a_102515433075_100020672187 [0,2,0,0,0,0|2,0,0]=4 1163 B29R3.3203558922 Cc1ccc(c(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C)F 34a_102515433075_100020672187 [0,2,0,0,0,0|2,0,0]=4 1164 B29R3.3203558922 Cc1ccc(cc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C)Br 2230a_106744473289_100020672187 [0,2,0,0,0,0|2,0,0]=4 1165 B29R3.3203558922 Cc1ccc(cc1CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C)Br 269982a_106744473289_100020672187 [0,2,0,0,0,0|2,0,0]=4 1166 B29R3.3545642413 CC(Oc1ccccc1Br)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000246065_100000039610 [0,2,0,0,0,0|2,0,0]=4 1167 B29R3.3545642413 CC(Oc1ccccc1Cl)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000191201_100000039610 [0,2,0,0,0,0|2,0,0]=4 1168 B29R3.3545642413 CC(Oc1ccccc1F)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000191191_100000039610 [0,2,0,0,0,0|2,0,0]=4 1169 B29R3.3545642413 CC(Sc1ccccc1Cl)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000181065_100000039610 [0,2,0,0,0,0|2,0,0]=4 1170 B29R3.3545642413 Cc1ccccc1OC(C)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000189243_100000039610 [0,2,0,0,0,0|2,0,0]=4 1171 B29R3.3545642413 Cn1c(=O)c2c(ncn2CCC(=O)C(O)Cc3ccccc3Br)n(c1=O)C 1458a_100012382637_100000039610 [0,2,0,0,0,0|2,0,0]=4 1172 B29R3.3545642413 Cn1c(=O)c2c(ncn2CCC(=O)C(O)Cc3ccccc3Cl)n(c1=O)C 1458a_100000703902_100000039610 [0,2,0,0,0,0|2,0,0]=4 1173 B29R3.3546548864 Cn1c(=O)c2c(ncn2CCNC(C)(C)Cc3ccccc3Br)n(c1=O)C 2230a_100161000475_100000039610 [0,2,0,0,0,0|0,0,0]=2 1174 B29R3.3546548864 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3ccccc3Cl)n(c1=O)C 7a_100000751322_100000039610 [0,2,0,0,0,0|1,0,0]=3 1175 B29R3.3546548864 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3ccccc3F)n(c1=O)C 34a_100011350413_100000039610 [0,2,0,0,0,0|1,0,0]=3 1176 B29R3.3546548864 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3ccccc3F)n(c1=O)C 7a_100011350413_100000039610 [0,2,0,0,0,0|1,0,0]=3 1177 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3Cl)Cl 2230a_100000690605_100020672187 [0,2,0,0,0,0|2,0,0]=4 1178 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3Cl)Cl 269982a_100000690605_100020672187 [0,2,0,0,0,0|2,0,0]=4 1179 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3Cl)Cl 34a_100000690605_100020672187 [0,2,0,0,0,0|2,0,0]=4 1180 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3F)Br 2230a_114873767014_100020672187 [0,2,0,0,0,0|2,0,0]=4 1181 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3F)Br 269982a_114873767014_100020672187 [0,2,0,0,0,0|2,0,0]=4 1182 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3F)Br 34a_114873767014_100020672187 [0,2,0,0,0,0|2,0,0]=4 1183 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3F)F 2230a_102515433064_100020672187 [0,2,0,0,0,0|2,0,0]=4 1184 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3F)F 269982a_102515433064_100020672187 [0,2,0,0,0,0|2,0,0]=4 1185 B29R3.4114737505 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3F)F 34a_102515433064_100020672187 [0,2,0,0,0,0|2,0,0]=4 1186 B29R3.4114737505 Cc1cccc(c1C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000207598_100020672187 [0,2,0,0,0,0|2,0,0]=4 1187 B29R3.4114737505 Cc1cccc(c1C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000207598_100020672187 [0,2,0,0,0,0|2,0,0]=4 1188 B29R3.4114737505 Cc1cccc(c1C)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000207598_100020672187 [0,2,0,0,0,0|2,0,0]=4 1189 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Br)F 2230a_106744473292_100020672187 [0,2,0,0,0,0|2,0,0]=4 1190 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Br)F 269982a_106744473292_100020672187 [0,2,0,0,0,0|2,0,0]=4 1191 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Br)F 34a_106744473292_100020672187 [0,2,0,0,0,0|2,0,0]=4 1192 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Cl)Cl 2230a_100000186903_100020672187 [0,2,0,0,0,0|2,0,0]=4 1193 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Cl)Cl 269982a_100000186903_100020672187 [0,2,0,0,0,0|2,0,0]=4 1194 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Cl)Cl 34a_100000186903_100020672187 [0,2,0,0,0,0|2,0,0]=4 1195 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Cl)F 2230a_100000184537_100020672187 [0,2,0,0,0,0|2,0,0]=4 1196 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Cl)F 269982a_100000184537_100020672187 [0,2,0,0,0,0|2,0,0]=4 1197 B29R3.4115917663 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3c(cccc3Cl)F 34a_100000184537_100020672187 [0,2,0,0,0,0|2,0,0]=4 1198 B29R3.3560465358 CC(Cc1ccccn1)N(C)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 11a_200011351704_100000499738 [0,2,0,0,0,0|1,0,1]=4 1199 B29R3.3560465358 CC(Cc1ccccn1)N(C)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 1626a_200011351704_100000499738 [0,2,0,0,0,0|1,0,1]=4 1200 B29R3.3560465358 CC(Cc1ccccn1)N(C)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 240690a_200011351704_100000499738 [0,2,0,0,0,0|1,0,1]=4 1201 B29R3.3560465358 CC(Cc1ccccn1)N(C)C(=O)Cn2cnc3c2c(=O)n(c(=O)n3C)C 527a_200011351704_100000499738 [0,2,0,0,0,0|1,0,1]=4 1202 B29R3.3130131367 CC(Oc1cccc(c1)Br)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000246016_100000039610 [0,2,0,0,0,0|2,0,0]=4 1203 B29R3.3130131367 CC(Oc1cccc(c1)Cl)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000185161_100000039610 [0,2,0,0,0,0|2,0,0]=4 1204 B29R3.3130131367 Cc1cccc(c1)OC(C)C(=O)CCn2cnc3c2c(=O)n(c(=O)n3C)C 1458a_100000183885_100000039610 [0,2,0,0,0,0|2,0,0]=4 1205 B29R3.3130131367 Cn1c(=O)c2c(ncn2CCC(=O)C(O)Cc3cccc(c3)Br)n(c1=O)C 1458a_100012362086_100000039610 [0,2,0,0,0,0|2,0,0]=4 1206 B29R3.3130131367 Cn1c(=O)c2c(ncn2CCC(=O)[C@@H](O)Cc3cccc(c3)F)n(c1=O)C 1458a_200016142683_100000039610 [0,2,0,0,0,0|2,0,0]=4 1207 B29R3.8881420217 Cn1c(=O)c2c(ncn2CCC(=O)C(C)(C)Cc3ccccc3)n(c1=O)C 1458a_100000757416_100000039610 [0,2,0,0,0,0|1,0,0]=3 1208 B29R3.8881420217 Cn1c(=O)c2c(ncn2CCC(=O)C(C)(C)Oc3ccccc3)n(c1=O)C 1458a_100000743201_100000039610 [0,2,0,0,0,0|2,0,0]=4 1209 B29R3.3132067457 Cn1c(=O)c2c(ncn2CCOC(C)(C)Cc3cccc(n3)Br)n(c1=O)C 7a_100010253926_100000039610 [0,2,0,0,0,0|2,0,0]=4 1210 B29R3.8881420431 Cn1c(=O)c2c(ncn2CCOC(C)(C)C(=O)c3ccccc3)n(c1=O)C 34a_100011217161_100000039610 [0,2,0,0,0,0|1,0,1]=4 1211 B29R3.8881420431 Cn1c(=O)c2c(ncn2CCOC(C)(C)C(=O)c3ccccc3)n(c1=O)C 7a_100011217161_100000039610 [0,2,0,0,0,0|1,0,1]=4 1212 B29R3.8881420431 Cn1c(=O)c2c(ncn2CCSC(C)(C)C(=O)c3ccccc3)n(c1=O)C 62a_100000039610_200009813919 [0,2,0,0,0,0|1,0,1]=4 1213 B29R3.8881420431 Cn1c(=O)c2c(ncn2CCSC(C)(C)C(=O)c3ccccc3)n(c1=O)C 62a_200009813919_100000039610 [0,2,0,0,0,0|1,0,1]=4 1214 B29R3.2198683709 CCC(c1ccccc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000737544_100020672187 [0,2,0,0,0,0|2,0,0]=4 1215 B29R3.2198683709 CCC(c1ccccc1)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000737544_100020672187 [0,2,0,0,0,0|2,0,0]=4 1216 B29R3.4114891666 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3cccc(c3)Br 62a_100000039610_100012349134 [0,2,0,0,0,0|1,0,1]=4 1217 B29R3.4114891666 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3cccc(c3)Br 62a_100012349134_100000039610 [0,2,0,0,0,0|1,0,1]=4 1218 B29R3.4114891666 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3cccc(c3)Cl 62a_100000039610_100000184413 [0,2,0,0,0,0|1,0,1]=4 1219 B29R3.4114891666 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3cccc(c3)Cl 62a_100000184413_100000039610 [0,2,0,0,0,0|1,0,1]=4 1220 B29R3.4114891666 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3cccc(c3)F 62a_100000039610_100012356231 [0,2,0,0,0,0|1,0,1]=4 1221 B29R3.4114891666 CC(SCCn1cnc2c1c(=O)n(c(=O)n2C)C)C(=O)c3cccc(c3)F 62a_100012356231_100000039610 [0,2,0,0,0,0|1,0,1]=4 1222 B29R3.4114891666 CC(c1cccc(c1)Br)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100025717457_100020672187 [0,2,0,0,0,0|2,0,0]=4 1223 B29R3.4114891666 CC(c1cccc(c1)Br)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100025717457_100020672187 [0,2,0,0,0,0|2,0,0]=4 1224 B29R3.4114891666 CC(c1cccc(c1)F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000231114_100020672187 [0,2,0,0,0,0|2,0,0]=4 1225 B29R3.4114891666 CC(c1cccc(c1)F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000231114_100020672187 [0,2,0,0,0,0|2,0,0]=4 1226 B29R3.4114891666 CC(c1cccc(c1)F)N(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000231114_100020672187 [0,2,0,0,0,0|2,0,0]=4 1227 B29R3.1550705045 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)C#N 2230a_100000168042_100020672187 [0,2,0,0,0,0|2,0,0]=4 1228 B29R3.1550705045 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)C#N 269982a_100000168042_100020672187 [0,2,0,0,0,0|2,0,0]=4 1229 B29R3.1550705045 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccc(c3)C#N 34a_100000168042_100020672187 [0,2,0,0,0,0|2,0,0]=4 1230 B29R3.1550705045 COc1cccc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000184262_100020672187 [0,2,0,0,0,0|2,0,0]=4 1231 B29R3.1550705045 COc1cccc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000184262_100020672187 [0,2,0,0,0,0|2,0,0]=4 1232 B29R3.1550705045 CSc1cccc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011934695_100020672187 [0,2,0,0,0,0|2,0,0]=4 1233 B29R3.1550705045 CSc1cccc(c1)CN(C)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100011934695_100020672187 [0,2,0,0,0,0|2,0,0]=4 1234 B29R3.3049664293 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(cc(c3)Cl)Cl 2230a_100016988021_100020672187 [0,2,0,0,0,0|2,0,0]=4 1235 B29R3.3049664293 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(cc(c3)Cl)Cl 269982a_100016988021_100020672187 [0,2,0,0,0,0|2,0,0]=4 1236 B29R3.3049664293 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(cc(c3)Cl)Cl 34a_100016988021_100020672187 [0,2,0,0,0,0|2,0,0]=4 1237 B29R3.3049664293 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(cc(c3)F)F 2230a_100000720221_100020672187 [0,2,0,0,0,0|2,0,0]=4 1238 B29R3.3049664293 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(cc(c3)F)F 269982a_100000720221_100020672187 [0,2,0,0,0,0|2,0,0]=4 1239 B29R3.3049664293 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cc(cc(c3)F)F 34a_100000720221_100020672187 [0,2,0,0,0,0|2,0,0]=4 1240 B27R3.605750928 CC(CCc1ccco1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000199034_100000039610 [0,0,1,1,0,0|1,0,1]=4 1241 B27R3.605750928 CC(CCc1ccco1)NCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000199034_100000039610 [0,0,1,1,0,0|1,0,1]=4 1242 B27R4.360837450 Cn1c(=O)c2c(ncn2CCSC3Cc4c3cccc4)n(c1=O)C 62a_100000039610_100009813401 [1,0,0,1,0,0|1,0,0]=3 1243 B27R4.360837450 Cn1c(=O)c2c(ncn2CCSC3Cc4c3cccc4)n(c1=O)C 62a_100009813401_100000039610 [1,0,0,1,0,0|1,0,0]=3 1244 B27R4.361040192 Cn1c(=O)c2c(ncn2CCN3Cc4ccccc4C3)n(c1=O)C 2230a_100000752595_100000039610 [0,0,0,1,1,0|1,0,0]=3 1245 B27R4.361040192 Cn1c(=O)c2c(ncn2CCN3Cc4ccccc4C3)n(c1=O)C 269982a_100000752595_100000039610 [0,0,0,1,1,0|1,0,0]=3 1246 B27R4.361040192 Cn1c(=O)c2c(ncn2CCN3Cc4ccccc4C3)n(c1=O)C 34a_100000752595_100000039610 [0,0,0,1,1,0|1,0,0]=3 1247 B27R4.361040192 Cn1c(=O)c2c(ncn2CCN3Cc4cccnc4C3)n(c1=O)C 269982a_100000726175_100000039610 [0,0,0,1,1,0|2,0,0]=4 1248 B27R4.361040192 Cn1c(=O)c2c(ncn2CCN3Cc4ccncc4C3)n(c1=O)C 2230a_100000730608_100000039610 [0,0,0,1,1,0|2,0,0]=4 1249 B27R4.361040192 Cn1c(=O)c2c(ncn2CCN3Cc4ccncc4C3)n(c1=O)C 269982a_100000730608_100000039610 [0,0,0,1,1,0|2,0,0]=4 1250 B29R4.1691378529 Cn1c(=O)c2c(ncn2CCOC3(CCc4c3cccc4)C)n(c1=O)C 34a_100000685031_100000039610 [0,0,0,1,0,1|1,0,0]=3 1251 B29R4.1691378529 Cn1c(=O)c2c(ncn2CCOC3(CCc4c3cccc4)C)n(c1=O)C 7a_100000685031_100000039610 [0,0,0,1,0,1|1,0,0]=3 1252 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCCN3CCc4ccccc4C3)n(c1=O)C 2230a_100000188457_100020672187 [0,0,0,1,0,1|2,0,0]=4 1253 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCCN3CCc4ccccc4C3)n(c1=O)C 269982a_100000188457_100020672187 [0,0,0,1,0,1|2,0,0]=4 1254 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCCN3CCc4ccccc4C3)n(c1=O)C 34a_100000188457_100020672187 [0,0,0,1,0,1|2,0,0]=4 1255 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCNC3CCc4ccccc4C3)n(c1=O)C 2230a_100000748446_100000039610 [0,0,0,1,0,1|0,0,0]=2 1256 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCNC3CCc4ccccc4C3)n(c1=O)C 34a_100000748446_100000039610 [0,0,0,1,0,1|0,0,0]=2 1257 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCNC3COc4ccccc4C3)n(c1=O)C 2230a_100000739546_100000039610 [0,0,0,1,0,1|0,0,0]=2 1258 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCOC3CCc4ccccc4C3)n(c1=O)C 34a_100011216300_100000039610 [0,0,0,1,0,1|1,0,0]=3 1259 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCOC3CCc4ccccc4C3)n(c1=O)C 7a_100011216300_100000039610 [0,0,0,1,0,1|1,0,0]=3 1260 B29R4.3706485158 Cn1c(=O)c2c(ncn2CCOC3Cc4ccccc4CO3)n(c1=O)C 34a_200000095866_100000039610 [0,0,0,1,0,1|1,0,0]=3 1261 B29R4.3706485172 Cn1c(=O)c2c(ncn2CCCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 2230a_100016998360_100020672187 [0,0,0,1,0,1|2,0,0]=4 1262 B29R4.3706485172 Cn1c(=O)c2c(ncn2CCCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 269982a_100016998360_100020672187 [0,0,0,1,0,1|2,0,0]=4 1263 B29R4.3706485172 Cn1c(=O)c2c(ncn2CCCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 34a_100016998360_100020672187 [0,0,0,1,0,1|2,0,0]=4 1264 B29R4.3706485173 Cn1c(=O)c2c(ncn2CCN[C@H]3C[C@H](C3)c4ccccc4)n(c1=O)C 2230a_102125402554_100000039610 [0,0,0,1,0,1|0,0,0]=2 1265 B29R4.365550978 Cn1c(=O)c2c(ncn2CCN[C@H]3c4ccccc4C[C@H]3O)n(c1=O)C 2230a_100000744645_100000039610 [0,0,0,1,0,1|1,0,0]=3 1266 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCCNC3Cc4ccccc4C3)n(c1=O)C 2230a_100000753258_100020672187 [0,0,0,1,0,1|0,0,0]=2 1267 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCCNC3Cc4ccccc4C3)n(c1=O)C 34a_100000753258_100020672187 [0,0,0,1,0,1|0,0,0]=2 1268 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCCOC3Cc4ccccc4C3)n(c1=O)C 34a_100011215286_100020672187 [0,0,0,1,0,1|1,0,0]=3 1269 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCCSC3Cc4ccccc4C3)n(c1=O)C 62a_100020672187_100000753484 [0,0,0,1,0,1|1,0,0]=3 1270 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCNCC3Cc4ccccc4C3)n(c1=O)C 2230a_100000757167_100000039610 [0,0,0,1,0,1|0,0,0]=2 1271 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCNCC3Cc4ccccc4C3)n(c1=O)C 34a_100000757167_100000039610 [0,0,0,1,0,1|0,0,0]=2 1272 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCNCC3Cc4ccccc4O3)n(c1=O)C 2230a_100015207006_100000039610 [0,0,0,1,0,1|1,0,0]=3 1273 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCNCC3Cc4ccccc4O3)n(c1=O)C 34a_100015207006_100000039610 [0,0,0,1,0,1|1,0,0]=3 1274 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCOCC3Cc4ccccc4C3)n(c1=O)C 34a_100000720471_100000039610 [0,0,0,1,0,1|1,0,0]=3 1275 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCOCC3Cc4ccccc4O3)n(c1=O)C 34a_100011273944_100000039610 [0,0,0,1,0,1|2,0,0]=4 1276 B29R4.3706485166 Cn1c(=O)c2c(ncn2CCOC[C@@H]3Cc4ccccc4N3)n(c1=O)C 34a_100011830367_100000039610 [0,0,0,1,0,1|2,0,0]=4 1277 B29R4.3706485167 Cn1c(=O)c2c(ncn2CCCN[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 2230a_100020588832_100020672187 [0,0,0,1,0,1|0,0,0]=2 1278 B29R4.3706485167 Cn1c(=O)c2c(ncn2CCCN[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 34a_100020588832_100020672187 [0,0,0,1,0,1|0,0,0]=2 1279 B29R4.3706485167 Cn1c(=O)c2c(ncn2CCOCC3CC3c4ccccc4)n(c1=O)C 34a_100011997005_100000039610 [0,0,0,1,0,1|1,0,0]=3 1280 B29R4.3706485167 Cn1c(=O)c2c(ncn2CCOCC3CC3c4ccccc4)n(c1=O)C 7a_100011997005_100000039610 [0,0,0,1,0,1|1,0,0]=3 1281 B29R4.3706485167 Cn1c(=O)c2c(ncn2CCOCC3OC3c4ccccc4)n(c1=O)C 34a_100000032844_100000039610 [0,0,0,1,0,1|2,0,0]=4 1282 B29R4.3706485167 Cn1c(=O)c2c(ncn2CCOCC3OC3c4ccccc4)n(c1=O)C 7a_100000032844_100000039610 [0,0,0,1,0,1|2,0,0]=4 1283 B29R4.3707277546 Cn1c(=O)c2c(ncn2CCN3CC(C3)Oc4ccccc4)n(c1=O)C 269982a_100000751016_100000039610 [0,0,0,1,0,1|1,0,0]=3 1284 B29R4.3707277546 Cn1c(=O)c2c(ncn2CCN3CC(C3)Oc4ccccn4)n(c1=O)C 269982a_100132309326_100000039610 [0,0,0,1,0,1|2,0,0]=4 1285 B29R4.3706485159 Cn1c(=O)c2c(ncn2CCCN3CCC3c4ccccc4)n(c1=O)C 2230a_100000739605_100020672187 [0,1,0,1,0,0|2,0,0]=4 1286 B29R4.3706485159 Cn1c(=O)c2c(ncn2CCCN3CCC3c4ccccc4)n(c1=O)C 269982a_100000739605_100020672187 [0,1,0,1,0,0|2,0,0]=4 1287 B29R4.3707277664 Cn1c(=O)c2c(ncn2CCSC3Cc4ccccc4C3=O)n(c1=O)C 62a_100000039610_100011218503 [0,1,0,1,0,0|1,0,1]=4 1288 B29R4.3707277664 Cn1c(=O)c2c(ncn2CCSC3Cc4ccccc4C3=O)n(c1=O)C 62a_100011218503_100000039610 [0,1,0,1,0,0|1,0,1]=4 1289 B29R4.3707277664 Cn1c(=O)c2c(ncn2CCSC3Cc4ccccc4C3O)n(c1=O)C 62a_100000039610_100000211646 [0,1,0,1,0,0|1,0,0]=3 1290 B29R4.3707277664 Cn1c(=O)c2c(ncn2CCSC3Cc4ccccc4C3O)n(c1=O)C 62a_100000211646_100000039610 [0,1,0,1,0,0|1,0,0]=3 1291 B29R4.501476517 Cn1c(=O)c2c(ncn2CCNC3CC3c4ccc(cc4)Br)n(c1=O)C 2230a_100000755575_100000039610 [0,1,0,1,0,0|0,0,0]=2 1292 B29R4.501476517 Cn1c(=O)c2c(ncn2CCNC3CC3c4ccc(cc4)Br)n(c1=O)C 34a_100000755575_100000039610 [0,1,0,1,0,0|0,0,0]=2 1293 B29R4.501476517 Cn1c(=O)c2c(ncn2CCN[C@@H]3C[C@H]3c4ccc(cc4)F)n(c1=O)C 2230a_100025713227_100000039610 [0,1,0,1,0,0|0,0,0]=2 1294 B29R4.501476517 Cn1c(=O)c2c(ncn2CCN[C@@H]3C[C@H]3c4ccc(cc4)F)n(c1=O)C 34a_100025713227_100000039610 [0,1,0,1,0,0|0,0,0]=2 1295 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)Br)n(c1=O)C 2230a_100000702344_100020672187 [0,1,0,1,0,0|2,0,0]=4 1296 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)Br)n(c1=O)C 269982a_100000702344_100020672187 [0,1,0,1,0,0|2,0,0]=4 1297 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)Br)n(c1=O)C 34a_100000702344_100020672187 [0,1,0,1,0,0|2,0,0]=4 1298 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)Cl)n(c1=O)C 2230a_100015205306_100020672187 [0,1,0,1,0,0|2,0,0]=4 1299 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)Cl)n(c1=O)C 269982a_100015205306_100020672187 [0,1,0,1,0,0|2,0,0]=4 1300 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)Cl)n(c1=O)C 34a_100015205306_100020672187 [0,1,0,1,0,0|2,0,0]=4 1301 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)F)n(c1=O)C 2230a_100000766377_100020672187 [0,1,0,1,0,0|2,0,0]=4 1302 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)F)n(c1=O)C 269982a_100000766377_100020672187 [0,1,0,1,0,0|2,0,0]=4 1303 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)F)n(c1=O)C 34a_100000766377_100020672187 [0,1,0,1,0,0|2,0,0]=4 1304 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)O)n(c1=O)C 2230a_100015195982_100020672187 [0,1,0,1,0,0|2,0,0]=4 1305 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)O)n(c1=O)C 269982a_100015195982_100020672187 [0,1,0,1,0,0|2,0,0]=4 1306 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCCN3Cc4ccc(cc4C3)O)n(c1=O)C 34a_100015195982_100020672187 [0,1,0,1,0,0|2,0,0]=4 1307 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCNC3Cc4ccc(cc4C3)Br)n(c1=O)C 2230a_100015193702_100000039610 [0,1,0,1,0,0|0,0,0]=2 1308 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCNC3Cc4ccc(cc4C3)Br)n(c1=O)C 34a_100015193702_100000039610 [0,1,0,1,0,0|0,0,0]=2 1309 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCNC3Cc4ccc(cc4C3)I)n(c1=O)C 2230a_100015191792_100000039610 [0,1,0,1,0,0|0,0,0]=2 1310 B29R4.1568431815 Cn1c(=O)c2c(ncn2CCOC3Cc4ccc(cc4C3)Br)n(c1=O)C 34a_100010161096_100000039610 [0,1,0,1,0,0|1,0,0]=3 1311 B29R4.220236218 Cn1c(=O)c2c(ncn2CCNC3CC3c4ccccc4F)n(c1=O)C 2230a_100000753450_100000039610 [0,1,0,1,0,0|0,0,0]=2 1312 B29R4.220236218 Cn1c(=O)c2c(ncn2CCNC3CC3c4ccccc4F)n(c1=O)C 34a_100000753450_100000039610 [0,1,0,1,0,0|0,0,0]=2 1313 B29R4.2006010558 Cc1cccc2c1CN(C2)CCCn3cnc4c3c(=O)n(c(=O)n4C)C 2230a_100020635169_100020672187 [0,1,0,1,0,0|2,0,0]=4 1314 B29R4.2006010558 Cc1cccc2c1CN(C2)CCCn3cnc4c3c(=O)n(c(=O)n4C)C 269982a_100020635169_100020672187 [0,1,0,1,0,0|2,0,0]=4 1315 B29R4.2006010558 Cc1cccc2c1CN(C2)CCCn3cnc4c3c(=O)n(c(=O)n4C)C 34a_100020635169_100020672187 [0,1,0,1,0,0|2,0,0]=4 1316 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)Br)n(c1=O)C 2230a_100000703859_100020672187 [0,1,0,1,0,0|2,0,0]=4 1317 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)Br)n(c1=O)C 269982a_100000703859_100020672187 [0,1,0,1,0,0|2,0,0]=4 1318 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)Br)n(c1=O)C 34a_100000703859_100020672187 [0,1,0,1,0,0|2,0,0]=4 1319 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)Cl)n(c1=O)C 2230a_100000731892_100020672187 [0,1,0,1,0,0|2,0,0]=4 1320 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)Cl)n(c1=O)C 269982a_100000731892_100020672187 [0,1,0,1,0,0|2,0,0]=4 1321 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)Cl)n(c1=O)C 34a_100000731892_100020672187 [0,1,0,1,0,0|2,0,0]=4 1322 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)F)n(c1=O)C 269982a_100000051403_100020672187 [0,1,0,1,0,0|2,0,0]=4 1323 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)F)n(c1=O)C 34a_100000051403_100020672187 [0,1,0,1,0,0|2,0,0]=4 1324 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)O)n(c1=O)C 269982a_100015191671_100020672187 [0,1,0,1,0,0|2,0,0]=4 1325 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCCN3Cc4cccc(c4C3)O)n(c1=O)C 34a_100015191671_100020672187 [0,1,0,1,0,0|2,0,0]=4 1326 B29R4.2006010558 Cn1c(=O)c2c(ncn2CCOC3Cc4cccc(c4C3)Br)n(c1=O)C 34a_100010752598_100000039610 [0,1,0,1,0,0|1,0,0]=3 1327 B29R4.3707277687 Cn1c(=O)c2c(ncn2CCNC3(Cc4ccccc4C3)C)n(c1=O)C 2230a_100000706725_100000039610 [0,1,0,1,0,0|0,0,0]=2 1328 B29R4.3707277687 Cn1c(=O)c2c(ncn2CCNC3(Cc4ccccc4C3)C)n(c1=O)C 34a_100000706725_100000039610 [0,1,0,1,0,0|0,0,0]=2 1329 B29R4.1691378553 Cn1c(=O)c2c(ncn2CC(=O)NC3Cc4ccccc4C3)n(c1=O)C 11a_100000753258_100000499738 [0,1,0,1,0,0|0,0,1]=3 1330 B29R4.1691378553 Cn1c(=O)c2c(ncn2CC(=O)NC3Cc4ccccc4C3)n(c1=O)C 1626a_100000753258_100000499738 [0,1,0,1,0,0|0,0,1]=3 1331 B29R4.1691378553 Cn1c(=O)c2c(ncn2CC(=O)NC3Cc4ccccc4C3)n(c1=O)C 240690a_100000753258_100000499738 [0,1,0,1,0,0|0,0,1]=3 1332 B29R4.1691378553 Cn1c(=O)c2c(ncn2CC(=O)NC3Cc4ccccc4C3)n(c1=O)C 527a_100000753258_100000499738 [0,1,0,1,0,0|0,0,1]=3 1333 B29R4.1691378554 Cn1c(=O)c2c(ncn2CC(=O)N[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 11a_100020588832_100000499738 [0,1,0,1,0,0|0,0,1]=3 1334 B29R4.1691378554 Cn1c(=O)c2c(ncn2CC(=O)N[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 1626a_100020588832_100000499738 [0,1,0,1,0,0|0,0,1]=3 1335 B29R4.1691378554 Cn1c(=O)c2c(ncn2CC(=O)N[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 240690a_100020588832_100000499738 [0,1,0,1,0,0|0,0,1]=3 1336 B29R4.1691378554 Cn1c(=O)c2c(ncn2CC(=O)N[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 527a_100020588832_100000499738 [0,1,0,1,0,0|0,0,1]=3 1337 B29R4.1691378561 Cn1c(=O)c2c(ncn2CC(=O)N3C[C@@H]3Cc4ccccc4)n(c1=O)C 11a_100016998360_100000499738 [0,1,0,1,0,0|0,0,1]=3 1338 B29R4.1691378561 Cn1c(=O)c2c(ncn2CC(=O)N3C[C@@H]3Cc4ccccc4)n(c1=O)C 1626a_100016998360_100000499738 [0,1,0,1,0,0|0,0,1]=3 1339 B29R4.1691378561 Cn1c(=O)c2c(ncn2CC(=O)N3C[C@@H]3Cc4ccccc4)n(c1=O)C 240690a_100016998360_100000499738 [0,1,0,1,0,0|0,0,1]=3 1340 B29R4.1691378561 Cn1c(=O)c2c(ncn2CC(=O)N3C[C@@H]3Cc4ccccc4)n(c1=O)C 527a_100016998360_100000499738 [0,1,0,1,0,0|0,0,1]=3 1341 B29R4.6904062932 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)C3Cc4ccccc4C3 2230a_100016990990_100000039610 [0,1,0,1,0,0|0,0,0]=2 1342 B29R4.6904062932 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)C3Cc4ccccc4C3 269982a_100016990990_100000039610 [0,1,0,1,0,0|0,0,0]=2 1343 B29R4.6904062932 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)C3Cc4ccccc4C3 34a_100016990990_100000039610 [0,1,0,1,0,0|0,0,0]=2 1344 B29R4.6904062932 Cn1c(=O)c2c(ncn2CCC(=O)C3Cc4ccccc4C3)n(c1=O)C 1458a_100000685393_100000039610 [0,1,0,1,0,0|1,0,0]=3 1345 B29R4.6904062932 Cn1c(=O)c2c(ncn2CCC(=O)C3Cc4ccccc4O3)n(c1=O)C 1458a_100000209886_100000039610 [0,1,0,1,0,0|2,0,0]=4 1346 B29R4.6904062932 Cn1c(=O)c2c(ncn2CCC(=O)C3Cc4ccccc4S3)n(c1=O)C 1458a_100000024912_100000039610 [0,1,0,1,0,0|2,0,0]=4 1347 B29R4.6905100777 Cn1c(=O)c2c(ncn2CCC(=O)C3CC3c4cccnc4)n(c1=O)C 1458a_100000746292_100000039610 [0,1,0,1,0,0|2,0,0]=4 1348 B29R4.6905100777 Cn1c(=O)c2c(ncn2CCC(=O)[C@@H]3C[C@H]3c4ccccc4)n(c1=O)C 1458a_100009815801_100000039610 [0,1,0,1,0,0|1,0,0]=3 1349 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCNc3ccccc3)n(c1=O)C 34a_100000106764_100020672187 [1,0,0,0,1,0|1,0,0]=3 1350 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCOc3ccccc3)n(c1=O)C 34a_100000210340_100020672187 [1,0,0,0,1,0|1,0,0]=3 1351 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCOc3ccccc3)n(c1=O)C 7a_100000210340_100020672187 [1,0,0,0,1,0|1,0,0]=3 1352 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCOc3cccnc3)n(c1=O)C 34a_100000210849_100020672187 [1,0,0,0,1,0|2,0,0]=4 1353 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCOc3cccnc3)n(c1=O)C 7a_100000210849_100020672187 [1,0,0,0,1,0|2,0,0]=4 1354 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCOc3ccncc3)n(c1=O)C 34a_100000212176_100020672187 [1,0,0,0,1,0|2,0,0]=4 1355 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCSc3ccccc3)n(c1=O)C 62a_100000719477_100020672187 [1,0,0,0,1,0|1,0,0]=3 1356 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCSc3ccccc3)n(c1=O)C 62a_100020672187_100000041952 [1,0,0,0,1,0|1,0,0]=3 1357 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCSc3ccccn3)n(c1=O)C 62a_100011216584_100020672187 [1,0,0,0,1,0|2,0,0]=4 1358 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCSc3ccccn3)n(c1=O)C 62a_100020672187_100011216584 [1,0,0,0,1,0|2,0,0]=4 1359 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCSc3cccnc3)n(c1=O)C 62a_100000210063_100020672187 [1,0,0,0,1,0|2,0,0]=4 1360 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCSc3cccnc3)n(c1=O)C 62a_100020672187_100000210063 [1,0,0,0,1,0|2,0,0]=4 1361 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCSc3ccncc3)n(c1=O)C 62a_100000728582_100020672187 [1,0,0,0,1,0|2,0,0]=4 1362 B25R3.535473130 Cn1c(=O)c2c(ncn2CCCSc3ccncc3)n(c1=O)C 62a_100020672187_100000728582 [1,0,0,0,1,0|2,0,0]=4 1363 B25R3.535473130 Cn1c(=O)c2c(ncn2CCNCc3ccccc3)n(c1=O)C 2230a_100015324214_100000039610 [1,0,0,0,1,0|0,0,0]=2 1364 B25R3.535473130 Cn1c(=O)c2c(ncn2CCNCc3ccccc3)n(c1=O)C 34a_100015324214_100000039610 [1,0,0,0,1,0|0,0,0]=2 1365 B25R3.535473130 Cn1c(=O)c2c(ncn2CCNCc3cccnn3)n(c1=O)C 2230a_100159270163_100000039610 [1,0,0,0,1,0|2,0,0]=4 1366 B25R3.535473130 Cn1c(=O)c2c(ncn2CCNCc3cncnc3)n(c1=O)C 2230a_100011243677_100000039610 [1,0,0,0,1,0|2,0,0]=4 1367 B25R3.535473130 Cn1c(=O)c2c(ncn2CCOCc3ccccc3)n(c1=O)C 34a_100000210790_100000039610 [1,0,0,0,1,0|1,0,0]=3 1368 B25R3.535473130 Cn1c(=O)c2c(ncn2CCOCc3ccccc3)n(c1=O)C 7a_100000210790_100000039610 [1,0,0,0,1,0|1,0,0]=3 1369 B25R3.535473130 Cn1c(=O)c2c(ncn2CCSCc3ccccc3)n(c1=O)C 62a_100000039610_100015291786 [1,0,0,0,1,0|1,0,0]=3 1370 B25R3.535473130 Cn1c(=O)c2c(ncn2CCSCc3ccccc3)n(c1=O)C 62a_100000211182_100000039610 [1,0,0,0,1,0|1,0,0]=3 1371 B25R3.535473130 Cn1c(=O)c2c(ncn2CCSCc3ccccn3)n(c1=O)C 62a_100000039610_100000721315 [1,0,0,0,1,0|2,0,0]=4 1372 B25R3.535473130 Cn1c(=O)c2c(ncn2CCSCc3ccccn3)n(c1=O)C 62a_100000721315_100000039610 [1,0,0,0,1,0|2,0,0]=4 1373 B25R3.535473130 Cn1c(=O)c2c(ncn2CCSCc3cccnc3)n(c1=O)C 62a_100000039610_100000741622 [1,0,0,0,1,0|2,0,0]=4 1374 B25R3.535473130 Cn1c(=O)c2c(ncn2CCSCc3cccnc3)n(c1=O)C 62a_100000741622_100000039610 [1,0,0,0,1,0|2,0,0]=4 1375 B25R3.535473130 Cn1c(=O)c2c(ncn2CCSCc3ccncc3)n(c1=O)C 62a_100000039610_100015193705 [1,0,0,0,1,0|2,0,0]=4 1376 B25R3.535473130 Cn1c(=O)c2c(ncn2CCSCc3ccncc3)n(c1=O)C 62a_100015193705_100000039610 [1,0,0,0,1,0|2,0,0]=4 1377 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3ccco3)n(c1=O)C 2230a_100000694680_100000039610 [1,0,0,0,1,0|1,0,0]=3 1378 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3ccco3)n(c1=O)C 34a_100000694680_100000039610 [1,0,0,0,1,0|1,0,0]=3 1379 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3cccs3)n(c1=O)C 2230a_100000203755_100000039610 [1,0,0,0,1,0|1,0,0]=3 1380 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3cccs3)n(c1=O)C 34a_100000203755_100000039610 [1,0,0,0,1,0|1,0,0]=3 1381 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3ccsc3)n(c1=O)C 2230a_100000692642_100000039610 [1,0,0,0,1,0|1,0,0]=3 1382 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3ccsc3)n(c1=O)C 34a_100000692642_100000039610 [1,0,0,0,1,0|1,0,0]=3 1383 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3cn[nH]c3)n(c1=O)C 2230a_100000732747_100000039610 [1,0,0,0,1,0|2,0,0]=4 1384 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3cncs3)n(c1=O)C 2230a_100016991637_100000039610 [1,0,0,0,1,0|2,0,0]=4 1385 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCc3nccs3)n(c1=O)C 2230a_100015186391_100000039610 [1,0,0,0,1,0|2,0,0]=4 1386 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCn3cccc3)n(c1=O)C 34a_100011368172_100000039610 [1,0,0,0,1,0|1,0,0]=3 1387 B25R3.535816991 Cn1c(=O)c2c(ncn2CCNCCn3cccn3)n(c1=O)C 2230a_100011200920_100000039610 [1,0,0,0,1,0|2,0,0]=4 1388 B25R3.535816991 Cn1c(=O)c2c(ncn2CCOCCc3cccs3)n(c1=O)C 34a_100011216825_100000039610 [1,0,0,0,1,0|2,0,0]=4 1389 B25R3.535816991 Cn1c(=O)c2c(ncn2CCOCCc3cccs3)n(c1=O)C 7a_100011216825_100000039610 [1,0,0,0,1,0|2,0,0]=4 1390 B25R3.535816991 Cn1c(=O)c2c(ncn2CCOCCc3ccsc3)n(c1=O)C 34a_100000748821_100000039610 [1,0,0,0,1,0|2,0,0]=4 1391 B25R3.535816991 Cn1c(=O)c2c(ncn2CCOCCn3cccc3)n(c1=O)C 34a_100000179382_100000039610 [1,0,0,0,1,0|2,0,0]=4 1392 B25R3.535816991 Cn1c(=O)c2c(ncn2CCSCCc3cccs3)n(c1=O)C 62a_100000039610_100000748579 [1,0,0,0,1,0|2,0,0]=4 1393 B25R3.535816991 Cn1c(=O)c2c(ncn2CCSCCc3cccs3)n(c1=O)C 62a_100000748579_100000039610 [1,0,0,0,1,0|2,0,0]=4 1394 B25R3.535816991 Cn1c(=O)c2c(ncn2CCSCCn3cccc3)n(c1=O)C 62a_100000039610_200000035178 [1,0,0,0,1,0|2,0,0]=4 1395 B25R3.535816991 Cn1c(=O)c2c(ncn2CCSCCn3cccc3)n(c1=O)C 62a_200009811947_100000039610 [1,0,0,0,1,0|2,0,0]=4 1396 B25R3.152013197 Cn1c(=O)c2c(ncn2CC(=O)Cc3ccccc3)n(c1=O)C 1458a_100000499738_100015291786 [0,0,0,0,2,0|1,0,1]=4 1397 B25R3.535473127 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 2230a_100000210012_100000039610 [0,0,0,0,2,0|1,0,0]=3 1398 B25R3.535473127 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 269982a_100000210012_100000039610 [0,0,0,0,2,0|1,0,0]=3 1399 B25R3.535473127 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccccc3 34a_100000210012_100000039610 [0,0,0,0,2,0|1,0,0]=3 1400 B25R3.535473127 Cn1c(=O)c2c(ncn2CCC(=O)c3ccccc3)n(c1=O)C 1458a_100000185807_100000039610 [0,0,0,0,2,0|1,0,1]=4 1401 B25R3.535816992 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccco3 2230a_100000185268_100000039610 [0,0,0,0,2,0|2,0,0]=4 1402 B25R3.535816992 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccco3 269982a_100000185268_100000039610 [0,0,0,0,2,0|2,0,0]=4 1403 B25R3.535816992 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccs3 2230a_100000184426_100000039610 [0,0,0,0,2,0|2,0,0]=4 1404 B25R3.535816992 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3cccs3 269982a_100000184426_100000039610 [0,0,0,0,2,0|2,0,0]=4 1405 B25R3.535816992 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccsc3 2230a_100020654213_100000039610 [0,0,0,0,2,0|2,0,0]=4 1406 B25R3.535816992 CN(CCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccsc3 269982a_100020654213_100000039610 [0,0,0,0,2,0|2,0,0]=4 1407 B25R3.535816990 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccs3 2230a_100000703493_100000039610 [0,0,0,0,2,0|1,0,0]=3 1408 B25R3.535816990 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccoc3 2230a_100000690049_100000039610 [0,0,0,0,2,0|1,0,0]=3 1409 B25R3.535816990 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccsc3 2230a_100000748604_100000039610 [0,0,0,0,2,0|1,0,0]=3 1410 B25R3.535816990 CC(NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3nccs3 2230a_100000725601_100000039610 [0,0,0,0,2,0|2,0,0]=4 1411 B25R3.535816990 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccsc3 34a_100011350980_100000039610 [0,0,0,0,2,0|2,0,0]=4 1412 B25R3.535816990 CC(OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccsc3 7a_100011350980_100000039610 [0,0,0,0,2,0|2,0,0]=4 1413 B25R3.535816990 C[C@@H](NCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccco3 2230a_100160469435_100000039610 [0,0,0,0,2,0|1,0,0]=3 1414 B25R3.535816990 C[C@@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3cccs3 7a_100000750433_100000039610 [0,0,0,0,2,0|2,0,0]=4 1415 B25R3.535816990 C[C@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccco3 34a_100000755270_100000039610 [0,0,0,0,2,0|2,0,0]=4 1416 B25R3.535816990 C[C@H](OCCn1cnc2c1c(=O)n(c(=O)n2C)C)c3ccco3 7a_100000755270_100000039610 [0,0,0,0,2,0|2,0,0]=4 1417 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCNCCc3ccccc3)n(c1=O)C 2230a_100000106460_100020672187 [1,0,0,0,0,1|0,0,0]=2 1418 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCNCCc3ccccc3)n(c1=O)C 34a_100000106460_100020672187 [1,0,0,0,0,1|0,0,0]=2 1419 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCNCCc3cccnc3)n(c1=O)C 2230a_100000736294_100020672187 [1,0,0,0,0,1|1,0,0]=3 1420 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCOCCc3ccccc3)n(c1=O)C 34a_100000210268_100020672187 [1,0,0,0,0,1|1,0,0]=3 1421 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCOCCc3ccccc3)n(c1=O)C 7a_100000210268_100020672187 [1,0,0,0,0,1|1,0,0]=3 1422 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCOCCc3ccccn3)n(c1=O)C 34a_100000210271_100020672187 [1,0,0,0,0,1|2,0,0]=4 1423 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCOCCc3cccnc3)n(c1=O)C 34a_100011217484_100020672187 [1,0,0,0,0,1|2,0,0]=4 1424 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCOCCc3ccncc3)n(c1=O)C 34a_100011216225_100020672187 [1,0,0,0,0,1|2,0,0]=4 1425 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3ccccc3)n(c1=O)C 62a_100000765856_100020672187 [1,0,0,0,0,1|1,0,0]=3 1426 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3ccccc3)n(c1=O)C 62a_100020672187_100011218657 [1,0,0,0,0,1|1,0,0]=3 1427 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3ccccn3)n(c1=O)C 62a_100015183660_100020672187 [1,0,0,0,0,1|2,0,0]=4 1428 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3ccccn3)n(c1=O)C 62a_100020672187_100015183660 [1,0,0,0,0,1|2,0,0]=4 1429 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3cccnc3)n(c1=O)C 62a_100020672187_200011713674 [1,0,0,0,0,1|2,0,0]=4 1430 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3cccnc3)n(c1=O)C 62a_200011713674_100020672187 [1,0,0,0,0,1|2,0,0]=4 1431 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3ccncc3)n(c1=O)C 62a_100000723409_100020672187 [1,0,0,0,0,1|2,0,0]=4 1432 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3ccncc3)n(c1=O)C 62a_100020672187_100000723409 [1,0,0,0,0,1|2,0,0]=4 1433 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCSc3ccccc3)n(c1=O)C 62a_100011218342_100020672187 [1,0,0,0,0,1|2,0,0]=4 1434 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCSc3ccccc3)n(c1=O)C 62a_100020672187_100011218342 [1,0,0,0,0,1|2,0,0]=4 1435 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNC/C=C/c3ccccc3)n(c1=O)C 2230a_100020603302_100000039610 [1,0,0,0,0,1|0,0,1]=3 1436 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNC/C=C/c3ccccc3)n(c1=O)C 34a_100020603302_100000039610 [1,0,0,0,0,1|0,0,1]=3 1437 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCC#Cc3ccccc3)n(c1=O)C 34a_100000735379_100000039610 [1,0,0,0,0,1|0,0,1]=3 1438 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCCc3ccccc3)n(c1=O)C 2230a_100000211184_100000039610 [1,0,0,0,0,1|0,0,0]=2 1439 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCCc3ccccc3)n(c1=O)C 34a_100000211184_100000039610 [1,0,0,0,0,1|0,0,0]=2 1440 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCCc3cccnc3)n(c1=O)C 2230a_100011532358_100000039610 [1,0,0,0,0,1|1,0,0]=3 1441 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCCc3cccnc3)n(c1=O)C 34a_100011532358_100000039610 [1,0,0,0,0,1|1,0,0]=3 1442 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCCc3ccncc3)n(c1=O)C 2230a_100011275580_100000039610 [1,0,0,0,0,1|1,0,0]=3 1443 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCOc3ccccc3)n(c1=O)C 2230a_100000174943_100000039610 [1,0,0,0,0,1|0,0,0]=2 1444 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCOc3ccccc3)n(c1=O)C 34a_100000174943_100000039610 [1,0,0,0,0,1|0,0,0]=2 1445 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCOc3ccccn3)n(c1=O)C 2230a_106741647558_100000039610 [1,0,0,0,0,1|1,0,0]=3 1446 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCOc3cccnc3)n(c1=O)C 2230a_100000754688_100000039610 [1,0,0,0,0,1|1,0,0]=3 1447 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCSc3ccccc3)n(c1=O)C 2230a_100000189519_100000039610 [1,0,0,0,0,1|0,0,0]=2 1448 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOC/C=C/c3ccccc3)n(c1=O)C 34a_100000210256_100000039610 [1,0,0,0,0,1|1,0,1]=4 1449 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCC#Cc3ccccc3)n(c1=O)C 34a_100011217464_100000039610 [1,0,0,0,0,1|1,0,1]=4 1450 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCC#Cc3ccccc3)n(c1=O)C 7a_100011217464_100000039610 [1,0,0,0,0,1|1,0,1]=4 1451 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCCc3ccccc3)n(c1=O)C 34a_100000210828_100000039610 [1,0,0,0,0,1|1,0,0]=3 1452 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCCc3ccccc3)n(c1=O)C 7a_100000210828_100000039610 [1,0,0,0,0,1|1,0,0]=3 1453 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCCc3ccccn3)n(c1=O)C 34a_100011215068_100000039610 [1,0,0,0,0,1|2,0,0]=4 1454 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCCc3cccnc3)n(c1=O)C 34a_100000211284_100000039610 [1,0,0,0,0,1|2,0,0]=4 1455 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCCc3ccncc3)n(c1=O)C 34a_100000210659_100000039610 [1,0,0,0,0,1|2,0,0]=4 1456 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCNc3ccccc3)n(c1=O)C 34a_100000211345_100000039610 [1,0,0,0,0,1|1,0,0]=3 1457 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCNc3ccncc3)n(c1=O)C 34a_200011243140_100000039610 [1,0,0,0,0,1|2,0,0]=4 1458 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCOc3ccccc3)n(c1=O)C 34a_100000210260_100000039610 [1,0,0,0,0,1|1,0,0]=3 1459 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCOc3ccccc3)n(c1=O)C 7a_100000210260_100000039610 [1,0,0,0,0,1|1,0,0]=3 1460 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCSc3ccccc3)n(c1=O)C 7a_100000230494_100000039610 [1,0,0,0,0,1|1,0,0]=3 1461 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOCCSc3ccccn3)n(c1=O)C 7a_100000156319_100000039610 [1,0,0,0,0,1|2,0,0]=4 1462 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSC/C=C/c3ccccc3)n(c1=O)C 62a_100000039610_100016265936 [1,0,0,0,0,1|1,0,1]=4 1463 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSC/C=C/c3ccccc3)n(c1=O)C 62a_100016265936_100000039610 [1,0,0,0,0,1|1,0,1]=4 1464 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCC#Cc3ccccc3)n(c1=O)C 62a_100000039610_100011352542 [1,0,0,0,0,1|1,0,1]=4 1465 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCCCc3ccccc3)n(c1=O)C 62a_100000039610_100000211621 [1,0,0,0,0,1|1,0,0]=3 1466 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCCCc3ccccc3)n(c1=O)C 62a_100000211621_100000039610 [1,0,0,0,0,1|1,0,0]=3 1467 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCCOc3ccccc3)n(c1=O)C 62a_100000039610_100000184471 [1,0,0,0,0,1|1,0,0]=3 1468 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCCOc3ccccc3)n(c1=O)C 62a_100000184471_100000039610 [1,0,0,0,0,1|1,0,0]=3 1469 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCCSc3ccccc3)n(c1=O)C 62a_100000039610_100000246102 [1,0,0,0,0,1|1,0,0]=3 1470 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCCSc3ccccc3)n(c1=O)C 62a_100000246102_100000039610 [1,0,0,0,0,1|1,0,0]=3 1471 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCOCc3ccccc3)n(c1=O)C 62a_100000039610_100000763385 [1,0,0,0,0,1|1,0,0]=3 1472 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCOCc3ccccc3)n(c1=O)C 62a_100000763385_100000039610 [1,0,0,0,0,1|1,0,0]=3 1473 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCSCc3ccccc3)n(c1=O)C 62a_100000039610_200011217039 [1,0,0,0,0,1|1,0,0]=3 1474 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSCSCc3ccccc3)n(c1=O)C 62a_200011217039_100000039610 [1,0,0,0,0,1|1,0,0]=3 1475 B27R3.605750930 CC(Cc1ccco1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011803939_100020672187 [0,0,0,0,1,1|2,0,0]=4 1476 B27R3.605750930 CC(Cc1ccco1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100011803939_100020672187 [0,0,0,0,1,1|2,0,0]=4 1477 B27R3.605750930 CC(Cc1cccs1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000751415_100020672187 [0,0,0,0,1,1|1,0,0]=3 1478 B27R3.605750930 CC(Cc1ccsc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000743546_100020672187 [0,0,0,0,1,1|1,0,0]=3 1479 B27R3.605750930 CC(Cc1ccsc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000743546_100020672187 [0,0,0,0,1,1|1,0,0]=3 1480 B27R3.605750930 CC(Cn1cccn1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000738251_100020672187 [0,0,0,0,1,1|2,0,0]=4 1481 B29R3.3560465403 CC(CCCc1ccccc1)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_100000039610_200010759516 [0,0,0,0,0,2|1,0,0]=3 1482 B29R3.3560465403 CC(CCCc1ccccc1)SCCn2cnc3c2c(=O)n(c(=O)n3C)C 62a_200010759516_100000039610 [0,0,0,0,0,2|1,0,0]=3 1483 B29R3.3560465403 CC(COCc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000764311_100000039610 [0,0,0,0,0,2|1,0,0]=3 1484 B29R3.3560465403 CC(COCc1ccccc1)OCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000764311_100000039610 [0,0,0,0,0,2|1,0,0]=3 1485 B29R3.3560465403 CN(CCCc1ccccc1)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000693637_100020672187 [0,0,0,0,0,2|2,0,0]=4 1486 B29R3.3560465403 CN(CCCc1ccccc1)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000693637_100020672187 [0,0,0,0,0,2|2,0,0]=4 1487 B29R3.3560465403 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCOc3ccccc3 2230a_100000184383_100020672187 [0,0,0,0,0,2|2,0,0]=4 1488 B29R3.3560465403 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCOc3ccccc3 269982a_100000184383_100020672187 [0,0,0,0,0,2|2,0,0]=4 1489 B29R3.3560465405 CC(C#Cc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200000065209_100020672187 [0,0,0,0,0,2|1,0,1]=4 1490 B29R3.3560465405 CC(C#Cc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200000065209_100020672187 [0,0,0,0,0,2|1,0,1]=4 1491 B29R3.3560465405 CC(CCc1ccccc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000210798_100020672187 [0,0,0,0,0,2|0,0,0]=2 1492 B29R3.3560465405 CC(CCc1ccccc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000210798_100020672187 [0,0,0,0,0,2|0,0,0]=2 1493 B29R3.3560465405 CC(COc1ccccc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000746794_100020672187 [0,0,0,0,0,2|0,0,0]=2 1494 B29R3.3560465405 CC(COc1ccccc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000746794_100020672187 [0,0,0,0,0,2|0,0,0]=2 1495 B29R3.3560465405 CC(COc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000210911_100020672187 [0,0,0,0,0,2|1,0,0]=3 1496 B29R3.3560465405 CC(COc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100000210911_100020672187 [0,0,0,0,0,2|1,0,0]=3 1497 B29R3.3560465405 C[C@@H](CCc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100009815974_100020672187 [0,0,0,0,0,2|1,0,0]=3 1498 B29R3.3560465405 C[C@@H](CCc1ccccc1)OCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_100009815974_100020672187 [0,0,0,0,0,2|1,0,0]=3 1499 B29R3.3560465405 C[C@H](COCCn1cnc2c1c(=O)n(c(=O)n2C)C)NCc3ccccc3 34a_100000762708_100000039610 [0,0,0,0,0,2|1,0,0]=3 1500 B29R3.3560465405 Cn1c(=O)c2c(ncn2CCNCC(=O)NCc3ccccc3)n(c1=O)C 2230a_100000739245_100000039610 [0,0,0,0,0,2|1,0,1]=4 1501 B29R3.3560465405 Cn1c(=O)c2c(ncn2CCNCC(O)COc3ccccc3)n(c1=O)C 2230a_100000738913_100000039610 [0,0,0,0,0,2|1,0,0]=3 1502 B29R3.3560465405 Cn1c(=O)c2c(ncn2CCNCC(O)COc3ccccc3)n(c1=O)C 34a_100000738913_100000039610 [0,0,0,0,0,2|1,0,0]=3 1503 B29R3.3560465404 CC(CNCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 2230a_100000755676_100020672187 [0,0,0,0,0,2|1,0,0]=3 1504 B29R3.3560465404 CC(CNCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 34a_100000755676_100020672187 [0,0,0,0,0,2|1,0,0]=3 1505 B29R3.3560465404 CC(CNCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3cccnc3 2230a_200011219418_100020672187 [0,0,0,0,0,2|2,0,0]=4 1506 B29R3.3560465404 CC(COCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 34a_100012125295_100020672187 [0,0,0,0,0,2|1,0,0]=3 1507 B29R3.3560465404 CC(COCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 7a_100012125295_100020672187 [0,0,0,0,0,2|1,0,0]=3 1508 B29R3.3560465404 CC(COCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 34a_200000036796_100020672187 [0,0,0,0,0,2|2,0,0]=4 1509 B29R3.3560465404 CC(COCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 7a_200000036796_100020672187 [0,0,0,0,0,2|2,0,0]=4 1510 B29R3.3560465404 CN(CCSCCn1cnc2c1c(=O)n(c(=O)n2C)C)Cc3ccccc3 62a_100000039610_100015196923 [0,0,0,0,0,2|2,0,0]=4 1511 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCNCC(O)Cc3ccccc3)n(c1=O)C 2230a_100000752270_100020672187 [0,0,0,0,0,2|1,0,0]=3 1512 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCOCC(N)Cc3ccccc3)n(c1=O)C 34a_100000739027_100020672187 [0,0,0,0,0,2|2,0,0]=4 1513 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCSC[C@@H](O)Cc3ccccc3)n(c1=O)C 62a_100000729385_100020672187 [0,0,0,0,0,2|2,0,0]=4 1514 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCSC[C@@H](O)Cc3ccccc3)n(c1=O)C 62a_100020672187_100000729385 [0,0,0,0,0,2|2,0,0]=4