0 B31R3.1432153258 C#Cc1cccc(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100000735509_100015188311 [0,0,0,0,0,0|0,0,0]=0 1 B31R3.1432153258 C=Cc1cc(ccn1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100009845566_100015188311 [0,0,0,0,0,0|2,0,2]=4 2 B31R3.1432153258 C=Cc1cc(ccn1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100009845566 [0,0,0,0,0,0|2,0,2]=4 3 B31R3.1432153258 C=Cc1cccc(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100011827668_100015188311 [0,0,0,0,0,0|0,0,2]=2 4 B31R3.1432153258 C=Cc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100011215241_100015188311 [0,0,0,0,0,0|1,0,2]=3 5 B31R3.1432153258 C=Cc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100011215241 [0,0,0,0,0,0|1,0,2]=3 6 B31R3.1432153258 C=Cc1cncc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_200012180632 [0,0,0,0,0,0|2,0,2]=4 7 B31R3.1432153258 C=Cc1cncc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_200012180632_100015188311 [0,0,0,0,0,0|2,0,2]=4 8 B31R3.1432153258 CCc1cc(ccn1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100009820011_100015188311 [0,0,0,0,0,0|2,0,2]=4 9 B31R3.1432153258 CCc1cc(ccn1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100009820011 [0,0,0,0,0,0|2,0,2]=4 10 B31R3.1432153258 CCc1cccc(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100000211250_100015188311 [0,0,0,0,0,0|0,0,2]=2 11 B31R3.1432153258 CCc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100011263222_100015188311 [0,0,0,0,0,0|1,0,2]=3 12 B31R3.1432153258 CCc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100011263222 [0,0,0,0,0,0|1,0,2]=3 13 B31R3.1432153258 CCc1cccc(n1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100009856026_100015188311 [0,0,0,0,0,0|2,0,2]=4 14 B31R3.1432153258 CCc1cccc(n1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100009856026 [0,0,0,0,0,0|2,0,2]=4 15 B31R3.1432153258 CCc1ccnc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100009817561_100015188311 [0,0,0,0,0,0|2,0,2]=4 16 B31R3.1432153258 CCc1ccnc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100009817561 [0,0,0,0,0,0|2,0,2]=4 17 B31R3.1432153258 CCc1cncc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_200009819073 [0,0,0,0,0,0|2,0,2]=4 18 B31R3.1432153258 CCc1cncc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_200009819073_100015188311 [0,0,0,0,0,0|2,0,2]=4 19 B31R3.1432153258 CNc1cc(ccn1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100009819592_100015188311 [0,0,0,0,0,0|3,0,1]=4 20 B31R3.1432153258 CNc1cc(ccn1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100009819592 [0,0,0,0,0,0|3,0,1]=4 21 B31R3.1432153258 CNc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000219648_100015188311 [0,0,0,0,0,0|2,0,1]=3 22 B31R3.1432153258 CNc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000219648 [0,0,0,0,0,0|2,0,1]=3 23 B31R3.1432153258 CNc1cccc(n1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000703281_100015188311 [0,0,0,0,0,0|3,0,1]=4 24 B31R3.1432153258 CNc1cccc(n1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000703281 [0,0,0,0,0,0|3,0,1]=4 25 B31R3.1432153258 CNc1ccnc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100009869472_100015188311 [0,0,0,0,0,0|3,0,1]=4 26 B31R3.1432153258 CNc1ccnc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100009869472 [0,0,0,0,0,0|3,0,1]=4 27 B31R3.1432153258 CNc1cncc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100012184536_100015188311 [0,0,0,0,0,0|3,0,1]=4 28 B31R3.1432153258 CNc1cncc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100012184536 [0,0,0,0,0,0|3,0,1]=4 29 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C#N 27a_100000210922_100015188311 [0,0,0,0,0,0|1,0,0]=1 30 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)CF 27a_100000126320_100015188311 [0,0,0,0,0,0|1,0,1]=2 31 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)CO 27a_100000211919_100015188311 [0,0,0,0,0,0|1,0,1]=2 32 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)OC 27a_100000210024_100015188311 [0,0,0,0,0,0|1,0,1]=2 33 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)SC 27a_100000210049_100015188311 [0,0,0,0,0,0|1,0,1]=2 34 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)C#N 62a_100015188311_100011291639 [0,0,0,0,0,0|3,0,0]=3 35 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)C=O 62a_100011290808_100015188311 [0,0,0,0,0,0|3,0,1]=4 36 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)C=O 62a_100015188311_100011290808 [0,0,0,0,0,0|3,0,1]=4 37 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)CN 62a_100015188311_100025757509 [0,0,0,0,0,0|3,0,1]=4 38 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)CN 62a_100025757509_100015188311 [0,0,0,0,0,0|3,0,1]=4 39 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)CO 62a_100009814636_100015188311 [0,0,0,0,0,0|3,0,1]=4 40 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)CO 62a_100015188311_100009814636 [0,0,0,0,0,0|3,0,1]=4 41 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)NN 62a_100000089018_100015188311 [0,0,0,0,0,0|4,0,0]=4 42 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)NN 62a_100015188311_100000089018 [0,0,0,0,0,0|4,0,0]=4 43 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)OC 62a_100009817693_100015188311 [0,0,0,0,0,0|3,0,1]=4 44 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)OC 62a_100015188311_100011216251 [0,0,0,0,0,0|3,0,1]=4 45 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)SC 62a_100010883326_100015188311 [0,0,0,0,0,0|3,0,1]=4 46 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)SC 62a_100015188311_100010883326 [0,0,0,0,0,0|3,0,1]=4 47 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ncn3)C#N 62a_100015188311_100000092509 [0,0,0,0,0,0|4,0,0]=4 48 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C#N 62a_100015188311_100000189340 [0,0,0,0,0,0|2,0,0]=2 49 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C=O 62a_100000014684_100015188311 [0,0,0,0,0,0|2,0,1]=3 50 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C=O 62a_100015188311_100000014684 [0,0,0,0,0,0|2,0,1]=3 51 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CF 62a_100010878472_100015188311 [0,0,0,0,0,0|2,0,1]=3 52 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CF 62a_100015188311_100010878472 [0,0,0,0,0,0|2,0,1]=3 53 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CN 62a_100000106179_100015188311 [0,0,0,0,0,0|2,0,1]=3 54 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CN 62a_100015188311_100000106179 [0,0,0,0,0,0|2,0,1]=3 55 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CO 62a_100000687537_100015188311 [0,0,0,0,0,0|2,0,1]=3 56 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CO 62a_100015188311_100000687537 [0,0,0,0,0,0|2,0,1]=3 57 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)NN 62a_100000217339_100015188311 [0,0,0,0,0,0|3,0,0]=3 58 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)NN 62a_100015188311_100000217339 [0,0,0,0,0,0|3,0,0]=3 59 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)OC 62a_100015188311_100000170001 [0,0,0,0,0,0|2,0,1]=3 60 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)SC 62a_100011215954_100015188311 [0,0,0,0,0,0|2,0,1]=3 61 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)SC 62a_100015188311_100011215954 [0,0,0,0,0,0|2,0,1]=3 62 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)C#N 62a_100015188311_100011934037 [0,0,0,0,0,0|3,0,0]=3 63 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)C=O 62a_100000688028_100015188311 [0,0,0,0,0,0|3,0,1]=4 64 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)C=O 62a_100015188311_100000688028 [0,0,0,0,0,0|3,0,1]=4 65 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)CN 62a_100015188311_100016990191 [0,0,0,0,0,0|3,0,1]=4 66 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)CN 62a_100016990191_100015188311 [0,0,0,0,0,0|3,0,1]=4 67 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)CO 62a_100000694195_100015188311 [0,0,0,0,0,0|3,0,1]=4 68 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)CO 62a_100015188311_100000694195 [0,0,0,0,0,0|3,0,1]=4 69 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)NN 62a_100009817029_100015188311 [0,0,0,0,0,0|4,0,0]=4 70 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)NN 62a_100015188311_100009817029 [0,0,0,0,0,0|4,0,0]=4 71 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)OC 62a_100000760917_100015188311 [0,0,0,0,0,0|3,0,1]=4 72 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)OC 62a_100015188311_100000760917 [0,0,0,0,0,0|3,0,1]=4 73 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)SC 62a_100011960944_100015188311 [0,0,0,0,0,0|3,0,1]=4 74 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)SC 62a_100015188311_100011960944 [0,0,0,0,0,0|3,0,1]=4 75 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)C#N 62a_100015188311_100000685610 [0,0,0,0,0,0|3,0,0]=3 76 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)C=O 62a_100011998288_100015188311 [0,0,0,0,0,0|3,0,1]=4 77 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)C=O 62a_100015188311_100011998288 [0,0,0,0,0,0|3,0,1]=4 78 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)CN 62a_100000085674_100015188311 [0,0,0,0,0,0|3,0,1]=4 79 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)CN 62a_100015188311_100000085674 [0,0,0,0,0,0|3,0,1]=4 80 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)CO 62a_100000748867_100015188311 [0,0,0,0,0,0|3,0,1]=4 81 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)CO 62a_100015188311_100000748867 [0,0,0,0,0,0|3,0,1]=4 82 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)NN 62a_100000764631_100015188311 [0,0,0,0,0,0|4,0,0]=4 83 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)NN 62a_100015188311_100000764631 [0,0,0,0,0,0|4,0,0]=4 84 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)OC 62a_100000117307_100015188311 [0,0,0,0,0,0|3,0,1]=4 85 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)OC 62a_100015188311_100000117307 [0,0,0,0,0,0|3,0,1]=4 86 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(n3)C#N 62a_100015188311_100000092507 [0,0,0,0,0,0|4,0,0]=4 87 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)C#N 62a_100015188311_100000686085 [0,0,0,0,0,0|3,0,0]=3 88 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)C=O 62a_100000687066_100015188311 [0,0,0,0,0,0|3,0,1]=4 89 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)C=O 62a_100015188311_100000687066 [0,0,0,0,0,0|3,0,1]=4 90 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)CN 62a_100011249555_100015188311 [0,0,0,0,0,0|3,0,1]=4 91 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)CN 62a_100015188311_100011249555 [0,0,0,0,0,0|3,0,1]=4 92 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)CO 62a_100011259137_100015188311 [0,0,0,0,0,0|3,0,1]=4 93 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)CO 62a_100015188311_100011259137 [0,0,0,0,0,0|3,0,1]=4 94 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)NN 62a_100000727789_100015188311 [0,0,0,0,0,0|4,0,0]=4 95 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)NN 62a_100015188311_100000727789 [0,0,0,0,0,0|4,0,0]=4 96 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)OC 62a_100000050176_100015188311 [0,0,0,0,0,0|3,0,1]=4 97 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)OC 62a_100015188311_100000050176 [0,0,0,0,0,0|3,0,1]=4 98 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)SC 62a_100009816972_100015188311 [0,0,0,0,0,0|3,0,1]=4 99 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)SC 62a_100015188311_100009816972 [0,0,0,0,0,0|3,0,1]=4 100 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(n3)C#N 62a_100015188311_100009817212 [0,0,0,0,0,0|4,0,0]=4 101 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3nccc(n3)C#N 62a_100015188311_100000066186 [0,0,0,0,0,0|4,0,0]=4 102 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)Br 27a_100000210019_100015188311 [1,0,0,0,0,0|1,0,0]=2 103 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C 27a_100000188690_100015188311 [1,0,0,0,0,0|0,0,1]=2 104 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)Cl 27a_100000185859_100015188311 [1,0,0,0,0,0|1,0,0]=2 105 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)F 27a_100000210047_100015188311 [1,0,0,0,0,0|1,0,0]=2 106 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)I 27a_100000211102_100015188311 [1,0,0,0,0,0|1,0,0]=2 107 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)O 27a_100000210217_100015188311 [1,0,0,0,0,0|1,0,0]=2 108 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(=O)cc[nH]3 62a_100009817434_100015188311 [1,0,0,0,0,0|3,0,0]=4 109 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)C 62a_100000750283_100015188311 [1,0,0,0,0,0|2,0,1]=4 110 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)C 62a_100015188311_100000750283 [1,0,0,0,0,0|2,0,1]=4 111 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)Cl 62a_100010167805_100015188311 [1,0,0,0,0,0|3,0,0]=4 112 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)Cl 62a_100015188311_100010167805 [1,0,0,0,0,0|3,0,0]=4 113 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)F 62a_100000764206_100015188311 [1,0,0,0,0,0|3,0,0]=4 114 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)F 62a_100015188311_100000764206 [1,0,0,0,0,0|3,0,0]=4 115 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)N 62a_100009814236_100015188311 [1,0,0,0,0,0|3,0,0]=4 116 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)N 62a_100015188311_100009814236 [1,0,0,0,0,0|3,0,0]=4 117 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)O 62a_100015188311_100000762945 [1,0,0,0,0,0|3,0,0]=4 118 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc[nH]c(=O)c3 62a_100009816521_100015188311 [1,0,0,0,0,0|3,0,0]=4 119 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc[nH]c(=O)c3 62a_100015188311_100009816521 [1,0,0,0,0,0|3,0,0]=4 120 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc[n+](c3)C 62a_100009996589_100015188311 [1,0,0,0,0,0|2,0,1]=4 121 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc[n+](c3)C 62a_100015188311_100009996589 [1,0,0,0,0,0|2,0,1]=4 122 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc[n+](c3)[O-] 62a_100015188311_100009815978 [1,0,0,0,0,0|3,0,0]=4 123 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(=O)[nH]3 62a_100015188311_100000752884 [1,0,0,0,0,0|3,0,0]=4 124 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)Br 62a_100000691529_100015188311 [1,0,0,0,0,0|2,0,0]=3 125 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)Br 62a_100015188311_100000691529 [1,0,0,0,0,0|2,0,0]=3 126 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C 62a_100011215228_100015188311 [1,0,0,0,0,0|1,0,1]=3 127 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C 62a_100015188311_100011215228 [1,0,0,0,0,0|1,0,1]=3 128 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)Cl 62a_100000699651_100015188311 [1,0,0,0,0,0|2,0,0]=3 129 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)Cl 62a_100015188311_100000699651 [1,0,0,0,0,0|2,0,0]=3 130 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)F 62a_100000685547_100015188311 [1,0,0,0,0,0|2,0,0]=3 131 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)F 62a_100015188311_100000685547 [1,0,0,0,0,0|2,0,0]=3 132 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)N 62a_100000210019_100015188311 [1,0,0,0,0,0|2,0,0]=3 133 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)N 62a_100015188311_100000210019 [1,0,0,0,0,0|2,0,0]=3 134 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)O 62a_100015188311_100000211634 [1,0,0,0,0,0|2,0,0]=3 135 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)[S] 62a_100015188311_114929384022 [1,0,0,0,0,0|2,0,0]=3 136 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)[S] 62a_114929384022_100015188311 [1,0,0,0,0,0|2,0,0]=3 137 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)Br 62a_100000684672_100015188311 [1,0,0,0,0,0|3,0,0]=4 138 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)Br 62a_100015188311_100000684672 [1,0,0,0,0,0|3,0,0]=4 139 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)C 62a_100000742759_100015188311 [1,0,0,0,0,0|2,0,1]=4 140 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)C 62a_100015188311_100000742759 [1,0,0,0,0,0|2,0,1]=4 141 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)Cl 62a_100000051397_100015188311 [1,0,0,0,0,0|3,0,0]=4 142 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)Cl 62a_100015188311_100000051397 [1,0,0,0,0,0|3,0,0]=4 143 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)F 62a_100009815982_100015188311 [1,0,0,0,0,0|3,0,0]=4 144 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)F 62a_100015188311_100009815982 [1,0,0,0,0,0|3,0,0]=4 145 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)N 62a_100000740741_100015188311 [1,0,0,0,0,0|3,0,0]=4 146 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)N 62a_100015188311_100000740741 [1,0,0,0,0,0|3,0,0]=4 147 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)Br 62a_100009814637_100015188311 [1,0,0,0,0,0|3,0,0]=4 148 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)Br 62a_100015188311_100009814637 [1,0,0,0,0,0|3,0,0]=4 149 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)C 62a_100000758586_100015188311 [1,0,0,0,0,0|2,0,1]=4 150 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)C 62a_100015188311_100000758586 [1,0,0,0,0,0|2,0,1]=4 151 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)Cl 62a_100000035001_100015188311 [1,0,0,0,0,0|3,0,0]=4 152 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)Cl 62a_100015188311_100000035001 [1,0,0,0,0,0|3,0,0]=4 153 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)F 62a_100009816116_100015188311 [1,0,0,0,0,0|3,0,0]=4 154 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)F 62a_100015188311_100009816116 [1,0,0,0,0,0|3,0,0]=4 155 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)N 62a_100000049665_100015188311 [1,0,0,0,0,0|3,0,0]=4 156 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)N 62a_100015188311_100000049665 [1,0,0,0,0,0|3,0,0]=4 157 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)Br 62a_100000728054_100015188311 [1,0,0,0,0,0|3,0,0]=4 158 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)Br 62a_100015188311_100000728054 [1,0,0,0,0,0|3,0,0]=4 159 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)C 62a_100000760492_100015188311 [1,0,0,0,0,0|2,0,1]=4 160 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)C 62a_100015188311_100000760492 [1,0,0,0,0,0|2,0,1]=4 161 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)Cl 62a_100000049639_100015188311 [1,0,0,0,0,0|3,0,0]=4 162 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)Cl 62a_100015188311_100000049639 [1,0,0,0,0,0|3,0,0]=4 163 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)F 62a_100000744099_100015188311 [1,0,0,0,0,0|3,0,0]=4 164 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)F 62a_100015188311_100000744099 [1,0,0,0,0,0|3,0,0]=4 165 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)N 62a_100000687067_100015188311 [1,0,0,0,0,0|3,0,0]=4 166 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)N 62a_100015188311_100000687067 [1,0,0,0,0,0|3,0,0]=4 167 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)O 62a_100000754920_100015188311 [1,0,0,0,0,0|3,0,0]=4 168 B30R3.1471168631 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)O 62a_100015188311_100000754920 [1,0,0,0,0,0|3,0,0]=4 169 B32R3.245946630 CCc1cc(cc(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC)Br 27a_100010074814_100015188311 [0,1,0,0,0,0|0,0,2]=3 170 B32R3.245946630 CCc1cc(cc(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC)C 27a_100012022893_100015188311 [0,1,0,0,0,0|0,0,2]=3 171 B32R3.245946630 CCc1cc(cc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)N 62a_100010074814_100015188311 [0,1,0,0,0,0|1,0,2]=4 172 B32R3.245946630 CCc1cc(cc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)N 62a_100015188311_100010074814 [0,1,0,0,0,0|1,0,2]=4 173 B32R3.245946630 CNc1cc(cc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)F 62a_100015188311_106741647397 [0,1,0,0,0,0|2,0,1]=4 174 B32R3.245946630 CNc1cc(cc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)F 62a_106741647397_100015188311 [0,1,0,0,0,0|2,0,1]=4 175 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)C#N)Br 27a_100012002331_100015188311 [0,1,0,0,0,0|1,0,0]=2 176 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)C#N)C 27a_100012017395_100015188311 [0,1,0,0,0,0|1,0,0]=2 177 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)C#N)Cl 27a_100000068067_100015188311 [0,1,0,0,0,0|1,0,0]=2 178 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)C#N)F 27a_100011362962_100015188311 [0,1,0,0,0,0|1,0,0]=2 179 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)CO)Cl 27a_100012002482_100015188311 [0,1,0,0,0,0|1,0,1]=3 180 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)CO)O 27a_200000124675_100015188311 [0,1,0,0,0,0|1,0,1]=3 181 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)OC)Br 27a_100000750983_100015188311 [0,1,0,0,0,0|1,0,1]=3 182 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)OC)C 27a_100012001870_100015188311 [0,1,0,0,0,0|1,0,1]=3 183 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)OC)Cl 27a_100000051436_100015188311 [0,1,0,0,0,0|1,0,1]=3 184 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)OC)F 27a_100000687699_100015188311 [0,1,0,0,0,0|1,0,1]=3 185 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)OC)O 27a_200000692186_100015188311 [0,1,0,0,0,0|1,0,1]=3 186 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C#N)Br 62a_100015188311_100009997436 [0,1,0,0,0,0|2,0,0]=3 187 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C#N)C 62a_100015188311_100011998626 [0,1,0,0,0,0|2,0,0]=3 188 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C#N)Cl 62a_100015188311_100009827952 [0,1,0,0,0,0|2,0,0]=3 189 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C#N)F 62a_100015188311_100000756176 [0,1,0,0,0,0|2,0,0]=3 190 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C#N)N 62a_100015188311_100012002331 [0,1,0,0,0,0|2,0,0]=3 191 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C#N)O 62a_100015188311_100012180112 [0,1,0,0,0,0|2,0,0]=3 192 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)Br 62a_100010185649_100015188311 [0,1,0,0,0,0|2,0,1]=4 193 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)Br 62a_100015188311_100010185649 [0,1,0,0,0,0|2,0,1]=4 194 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)C 62a_100000686105_100015188311 [0,1,0,0,0,0|2,0,1]=4 195 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)C 62a_100015188311_100000686105 [0,1,0,0,0,0|2,0,1]=4 196 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)F 62a_100011794424_100015188311 [0,1,0,0,0,0|2,0,1]=4 197 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)F 62a_100015188311_100011794424 [0,1,0,0,0,0|2,0,1]=4 198 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)O 62a_100010176088_100015188311 [0,1,0,0,0,0|2,0,1]=4 199 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)O 62a_100015188311_100010176088 [0,1,0,0,0,0|2,0,1]=4 200 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CN)F 62a_100015188311_100020611034 [0,1,0,0,0,0|2,0,1]=4 201 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CN)F 62a_100020611034_100015188311 [0,1,0,0,0,0|2,0,1]=4 202 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CO)Br 62a_100009814756_100015188311 [0,1,0,0,0,0|2,0,1]=4 203 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CO)Br 62a_100015188311_100009814756 [0,1,0,0,0,0|2,0,1]=4 204 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CO)C 62a_100000720511_100015188311 [0,1,0,0,0,0|2,0,1]=4 205 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CO)C 62a_100015188311_100000720511 [0,1,0,0,0,0|2,0,1]=4 206 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CO)F 62a_100000766897_100015188311 [0,1,0,0,0,0|2,0,1]=4 207 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CO)F 62a_100015188311_100000766897 [0,1,0,0,0,0|2,0,1]=4 208 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)Br 62a_100010141301_100015188311 [0,1,0,0,0,0|2,0,1]=4 209 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)Br 62a_100015188311_100010141301 [0,1,0,0,0,0|2,0,1]=4 210 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)C 62a_100015188311_100010187550 [0,1,0,0,0,0|2,0,1]=4 211 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)Cl 62a_100010147680_100015188311 [0,1,0,0,0,0|2,0,1]=4 212 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)Cl 62a_100015188311_100010147680 [0,1,0,0,0,0|2,0,1]=4 213 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)F 62a_100011934182_100015188311 [0,1,0,0,0,0|2,0,1]=4 214 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)F 62a_100015188311_100011934182 [0,1,0,0,0,0|2,0,1]=4 215 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)N 62a_100000750983_100015188311 [0,1,0,0,0,0|2,0,1]=4 216 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)N 62a_100015188311_100000750983 [0,1,0,0,0,0|2,0,1]=4 217 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)O 62a_100015188311_100010068927 [0,1,0,0,0,0|2,0,1]=4 218 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)SC)C 62a_100015188311_200010709730 [0,1,0,0,0,0|2,0,1]=4 219 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)SC)C 62a_200010709730_100015188311 [0,1,0,0,0,0|2,0,1]=4 220 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)SC)F 62a_100015188311_200010245467 [0,1,0,0,0,0|2,0,1]=4 221 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)SC)F 62a_200010245467_100015188311 [0,1,0,0,0,0|2,0,1]=4 222 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(n3)C)C#N 62a_100015188311_100000692097 [0,1,0,0,0,0|3,0,0]=4 223 B32R3.245946630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(nc(c3)C#N)C 62a_100015188311_100000085694 [0,1,0,0,0,0|3,0,0]=4 224 B32R3.245964967 C=C(C)c1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100012123953_100015188311 [0,1,0,0,0,0|1,0,2]=4 225 B32R3.245964967 C=C(C)c1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100012123953 [0,1,0,0,0,0|1,0,2]=4 226 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C(=O)N 27a_100000217337_100015188311 [0,1,0,0,0,0|1,0,1]=3 227 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C(=S)N 27a_200011830438_100015188311 [0,1,0,0,0,0|1,0,1]=3 228 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C(C)C 27a_100000211879_100015188311 [0,1,0,0,0,0|0,0,2]=3 229 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C(C)O 27a_100011217120_100015188311 [0,1,0,0,0,0|0,0,2]=3 230 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C(F)F 27a_100000058342_100015188311 [0,1,0,0,0,0|1,0,1]=3 231 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)N(C)C 27a_100000209982_100015188311 [0,1,0,0,0,0|1,0,1]=3 232 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)[N+](=O)[O-] 27a_100000184103_100015188311 [0,1,0,0,0,0|2,0,0]=3 233 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)B(O)O 62a_100000687717_100015188311 [0,1,0,0,0,0|3,0,0]=4 234 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)B(O)O 62a_100015188311_100000687717 [0,1,0,0,0,0|3,0,0]=4 235 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(=O)C 62a_100000210093_100015188311 [0,1,0,0,0,0|1,0,2]=4 236 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(=O)C 62a_100015188311_100000210093 [0,1,0,0,0,0|1,0,2]=4 237 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(=O)N 62a_100000162208_100015188311 [0,1,0,0,0,0|2,0,1]=4 238 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(=O)N 62a_100015188311_100000162208 [0,1,0,0,0,0|2,0,1]=4 239 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(C)C 62a_100011214899_100015188311 [0,1,0,0,0,0|1,0,2]=4 240 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(C)C 62a_100015188311_100011214899 [0,1,0,0,0,0|1,0,2]=4 241 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(C)N 62a_100015188311_100020642005 [0,1,0,0,0,0|1,0,2]=4 242 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(C)N 62a_100020642005_100015188311 [0,1,0,0,0,0|1,0,2]=4 243 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(C)O 62a_100000246457_100015188311 [0,1,0,0,0,0|1,0,2]=4 244 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(C)O 62a_100015188311_100000246457 [0,1,0,0,0,0|1,0,2]=4 245 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(F)F 62a_100009892619_100015188311 [0,1,0,0,0,0|2,0,1]=4 246 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(F)F 62a_100015188311_100009892619 [0,1,0,0,0,0|2,0,1]=4 247 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)N(C)C 62a_100011215952_100015188311 [0,1,0,0,0,0|2,0,1]=4 248 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)N(C)C 62a_100015188311_100011215952 [0,1,0,0,0,0|2,0,1]=4 249 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)S(=O)C 62a_100009816267_100015188311 [0,1,0,0,0,0|2,0,1]=4 250 B32R3.245964967 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)S(=O)C 62a_100015188311_100009816267 [0,1,0,0,0,0|2,0,1]=4 251 B32R3.245964968 C=Cc1cccc(c1F)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100010741937_100015188311 [0,1,0,0,0,0|1,0,2]=4 252 B32R3.245964968 C=Cc1cccc(c1F)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100010741937 [0,1,0,0,0,0|1,0,2]=4 253 B32R3.245964968 CCc1cccc(c1O)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_200010001580 [0,1,0,0,0,0|1,0,2]=4 254 B32R3.245964968 CCc1cccc(c1O)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_200010001580_100015188311 [0,1,0,0,0,0|1,0,2]=4 255 B32R3.245964968 CNc1cccc(c1N)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000695761_100015188311 [0,1,0,0,0,0|2,0,1]=4 256 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)CO 27a_102495339961_100015188311 [0,1,0,0,0,0|1,0,1]=3 257 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)OC 27a_100011244893_100015188311 [0,1,0,0,0,0|1,0,1]=3 258 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3Cl)C#N 27a_100012184300_100015188311 [0,1,0,0,0,0|1,0,0]=2 259 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3Cl)OC 27a_100000089720_100015188311 [0,1,0,0,0,0|1,0,1]=3 260 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3F)C#N 27a_100000087142_100015188311 [0,1,0,0,0,0|1,0,0]=2 261 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3F)CO 27a_100012023829_100015188311 [0,1,0,0,0,0|1,0,1]=3 262 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3F)OC 27a_100000100910_100015188311 [0,1,0,0,0,0|1,0,1]=3 263 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)C#N 27a_200010145139_100015188311 [0,1,0,0,0,0|1,0,0]=2 264 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)OC 27a_100010245509_100015188311 [0,1,0,0,0,0|1,0,1]=3 265 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3O)OC 27a_100000123586_100015188311 [0,1,0,0,0,0|1,0,1]=3 266 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3c[nH]cc(c3=O)C#N 62a_100015188311_100009951290 [0,1,0,0,0,0|3,0,0]=4 267 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)CO 62a_100010240205_100015188311 [0,1,0,0,0,0|2,0,1]=4 268 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)CO 62a_100015188311_100010240205 [0,1,0,0,0,0|2,0,1]=4 269 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)OC 62a_100010146559_100015188311 [0,1,0,0,0,0|2,0,1]=4 270 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)OC 62a_100015188311_100010146559 [0,1,0,0,0,0|2,0,1]=4 271 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)C#N 62a_100015188311_100000721996 [0,1,0,0,0,0|2,0,0]=3 272 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)C=O 62a_100012179384_100015188311 [0,1,0,0,0,0|2,0,1]=4 273 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)C=O 62a_100015188311_100012179384 [0,1,0,0,0,0|2,0,1]=4 274 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)CN 62a_100000724210_100015188311 [0,1,0,0,0,0|2,0,1]=4 275 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)CN 62a_100015188311_100000724210 [0,1,0,0,0,0|2,0,1]=4 276 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)CO 62a_100000694458_100015188311 [0,1,0,0,0,0|2,0,1]=4 277 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)CO 62a_100015188311_100000694458 [0,1,0,0,0,0|2,0,1]=4 278 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)OC 62a_100010002647_100015188311 [0,1,0,0,0,0|2,0,1]=4 279 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)OC 62a_100015188311_100010002647 [0,1,0,0,0,0|2,0,1]=4 280 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)OC 62a_100010147677_100015188311 [0,1,0,0,0,0|2,0,1]=4 281 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)OC 62a_100015188311_100010147677 [0,1,0,0,0,0|2,0,1]=4 282 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)C#N 62a_100015188311_100000239898 [0,1,0,0,0,0|2,0,0]=3 283 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)C=O 62a_100000766533_100015188311 [0,1,0,0,0,0|2,0,1]=4 284 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)C=O 62a_100015188311_100000766533 [0,1,0,0,0,0|2,0,1]=4 285 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)CN 62a_100015188311_100015189953 [0,1,0,0,0,0|2,0,1]=4 286 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)CN 62a_100015189953_100015188311 [0,1,0,0,0,0|2,0,1]=4 287 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)CO 62a_100011935076_100015188311 [0,1,0,0,0,0|2,0,1]=4 288 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)CO 62a_100015188311_100011935076 [0,1,0,0,0,0|2,0,1]=4 289 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)OC 62a_100010185846_100015188311 [0,1,0,0,0,0|2,0,1]=4 290 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)OC 62a_100015188311_100010185846 [0,1,0,0,0,0|2,0,1]=4 291 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)C#N 62a_100015188311_100011934406 [0,1,0,0,0,0|2,0,0]=3 292 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)C=O 62a_100010144990_100015188311 [0,1,0,0,0,0|2,0,1]=4 293 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)CO 62a_100012349457_100015188311 [0,1,0,0,0,0|2,0,1]=4 294 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)CO 62a_100015188311_100012349457 [0,1,0,0,0,0|2,0,1]=4 295 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)OC 62a_100000708083_100015188311 [0,1,0,0,0,0|2,0,1]=4 296 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)C#N 62a_100015188311_100009817103 [0,1,0,0,0,0|2,0,0]=3 297 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)C=O 62a_100015188311_100010171435 [0,1,0,0,0,0|2,0,1]=4 298 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)OC 62a_100015188311_100000686866 [0,1,0,0,0,0|2,0,1]=4 299 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3C)C#N 62a_100015188311_100000085680 [0,1,0,0,0,0|3,0,0]=4 300 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3F)C#N 62a_100015188311_100010009571 [0,1,0,0,0,0|3,0,0]=4 301 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3C)C#N 62a_100015188311_100009818027 [0,1,0,0,0,0|3,0,0]=4 302 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3nccc(c3C)C#N 62a_100015188311_100009841936 [0,1,0,0,0,0|3,0,0]=4 303 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3nccc(c3F)C#N 62a_100015188311_100000144631 [0,1,0,0,0,0|3,0,0]=4 304 B32R3.245964968 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3nccc(c3N)C#N 62a_100015188311_200000144456 [0,1,0,0,0,0|3,0,0]=4 305 B32R3.245964970 C=CCc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100009816576_100015188311 [0,1,0,0,0,0|1,0,2]=4 306 B32R3.245964970 C=CCc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100009816576 [0,1,0,0,0,0|1,0,2]=4 307 B32R3.245964970 CC#Cc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_200009843338 [0,1,0,0,0,0|1,0,0]=2 308 B32R3.245964970 CCCc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000694964_100015188311 [0,1,0,0,0,0|1,0,2]=4 309 B32R3.245964970 CCCc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000694964 [0,1,0,0,0,0|1,0,2]=4 310 B32R3.245964970 CCNc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000738899 [0,1,0,0,0,0|1,0,2]=4 311 B32R3.245964970 CCOc1cccc(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100000742568_100015188311 [0,1,0,0,0,0|0,0,2]=3 312 B32R3.245964970 CCOc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000170002 [0,1,0,0,0,0|1,0,2]=4 313 B32R3.245964970 CCSc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000703699_100015188311 [0,1,0,0,0,0|1,0,2]=4 314 B32R3.245964970 CCSc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000703699 [0,1,0,0,0,0|1,0,2]=4 315 B32R3.245964970 CNCc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000187585_100015188311 [0,1,0,0,0,0|1,0,2]=4 316 B32R3.245964970 CNCc1cccc(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000187585 [0,1,0,0,0,0|1,0,2]=4 317 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)CC#N 27a_100000017804_100015188311 [0,1,0,0,0,0|0,0,1]=2 318 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)CCO 27a_100011996697_100015188311 [0,1,0,0,0,0|0,0,2]=3 319 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)COC 27a_100000737370_100015188311 [0,1,0,0,0,0|0,0,2]=3 320 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)CC#N 62a_100009819943_100015188311 [0,1,0,0,0,0|2,0,1]=4 321 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)CC#N 62a_100015188311_100009819943 [0,1,0,0,0,0|2,0,1]=4 322 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CC#N 62a_100000034040_100015188311 [0,1,0,0,0,0|1,0,1]=3 323 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CC#N 62a_100015188311_100000034040 [0,1,0,0,0,0|1,0,1]=3 324 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CC=O 62a_100015188311_200000698211 [0,1,0,0,0,0|1,0,2]=4 325 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CC=O 62a_200000698211_100015188311 [0,1,0,0,0,0|1,0,2]=4 326 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CCN 62a_100011207229_100015188311 [0,1,0,0,0,0|1,0,2]=4 327 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CCN 62a_100015188311_100011207229 [0,1,0,0,0,0|1,0,2]=4 328 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CCO 62a_100011217444_100015188311 [0,1,0,0,0,0|1,0,2]=4 329 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CCO 62a_100015188311_100011217444 [0,1,0,0,0,0|1,0,2]=4 330 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CNN 62a_100000686200_100015188311 [0,1,0,0,0,0|2,0,1]=4 331 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CNN 62a_100015188311_100000686200 [0,1,0,0,0,0|2,0,1]=4 332 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)COC 62a_100011493687_100015188311 [0,1,0,0,0,0|1,0,2]=4 333 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)COC 62a_100015188311_100011493687 [0,1,0,0,0,0|1,0,2]=4 334 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)N=[N+]=[N-] 62a_100015188311_100000735707 [0,1,0,0,0,0|3,0,0]=4 335 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)NC#N 62a_100015188311_100011685342 [0,1,0,0,0,0|2,0,0]=3 336 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)CC#N 62a_100000727631_100015188311 [0,1,0,0,0,0|2,0,1]=4 337 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)CC#N 62a_100015188311_100000727631 [0,1,0,0,0,0|2,0,1]=4 338 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)CC#N 62a_100009875060_100015188311 [0,1,0,0,0,0|2,0,1]=4 339 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)CC#N 62a_100015188311_100009875060 [0,1,0,0,0,0|2,0,1]=4 340 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)CC#N 62a_100015188311_100015508350 [0,1,0,0,0,0|2,0,1]=4 341 B32R3.245964970 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)CC#N 62a_100015508350_100015188311 [0,1,0,0,0,0|2,0,1]=4 342 B32R3.245964973 C#Cc1cc(ccc1C)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_200012017271_100015188311 [0,1,0,0,0,0|0,0,0]=1 343 B32R3.245964973 C#Cc1cc(ccc1Cl)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_103624766972_100015188311 [0,1,0,0,0,0|0,0,0]=1 344 B32R3.245964973 C#Cc1cc(ccc1F)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_200011999510_100015188311 [0,1,0,0,0,0|0,0,0]=1 345 B32R3.245964973 C=Cc1cc(ccc1F)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000688377_100015188311 [0,1,0,0,0,0|1,0,2]=4 346 B32R3.245964973 C=Cc1cc(ccc1F)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000688377 [0,1,0,0,0,0|1,0,2]=4 347 B32R3.245964973 CCc1cc(ccc1Br)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100010109747_100015188311 [0,1,0,0,0,0|0,0,2]=3 348 B32R3.245964973 CCc1cc(ccc1Br)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100010244631_100015188311 [0,1,0,0,0,0|1,0,2]=4 349 B32R3.245964973 CCc1cc(ccc1Br)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100010244631 [0,1,0,0,0,0|1,0,2]=4 350 B32R3.245964973 CCc1cc(ccc1F)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100010244625_100015188311 [0,1,0,0,0,0|1,0,2]=4 351 B32R3.245964973 CCc1cc(ccc1F)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100010244625 [0,1,0,0,0,0|1,0,2]=4 352 B32R3.245964973 CCc1cc(ccc1N)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000686106_100015188311 [0,1,0,0,0,0|1,0,2]=4 353 B32R3.245964973 CCc1cc(ccc1N)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100000686106 [0,1,0,0,0,0|1,0,2]=4 354 B32R3.245964973 CCc1cc(ccc1O)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100012338938 [0,1,0,0,0,0|1,0,2]=4 355 B32R3.245964973 CNc1cc(ccc1C)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100020629602 [0,1,0,0,0,0|2,0,1]=4 356 B32R3.245964973 CNc1cc(ccc1C)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100020629602_100015188311 [0,1,0,0,0,0|2,0,1]=4 357 B32R3.245964973 CNc1cc(ccc1F)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100011314990_100015188311 [0,1,0,0,0,0|2,0,1]=4 358 B32R3.245964973 CNc1cc(ccc1F)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100011314990 [0,1,0,0,0,0|2,0,1]=4 359 B32R3.245964973 CNc1cc(ccc1N)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100000694363_100015188311 [0,1,0,0,0,0|2,0,1]=4 360 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C#N)Br 27a_100011934039_100015188311 [0,1,0,0,0,0|1,0,0]=2 361 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C#N)C 27a_100011216687_100015188311 [0,1,0,0,0,0|1,0,0]=2 362 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C#N)Cl 27a_100000239497_100015188311 [0,1,0,0,0,0|1,0,0]=2 363 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C#N)F 27a_100000748589_100015188311 [0,1,0,0,0,0|1,0,0]=2 364 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C#N)O 27a_100011249283_100015188311 [0,1,0,0,0,0|1,0,0]=2 365 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)CO)Br 27a_100012347228_100015188311 [0,1,0,0,0,0|1,0,1]=3 366 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)CO)Cl 27a_100011273577_100015188311 [0,1,0,0,0,0|1,0,1]=3 367 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)CO)F 27a_100011218011_100015188311 [0,1,0,0,0,0|1,0,1]=3 368 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)Br 27a_100000765947_100015188311 [0,1,0,0,0,0|1,0,1]=3 369 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)C 27a_100011279678_100015188311 [0,1,0,0,0,0|1,0,1]=3 370 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)Cl 27a_100000742311_100015188311 [0,1,0,0,0,0|1,0,1]=3 371 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)F 27a_100000701188_100015188311 [0,1,0,0,0,0|1,0,1]=3 372 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)I 27a_100000746945_100015188311 [0,1,0,0,0,0|1,0,1]=3 373 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)O 27a_100000726020_100015188311 [0,1,0,0,0,0|1,0,1]=3 374 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(cn3)F)C#N 62a_100015188311_100000709737 [0,1,0,0,0,0|3,0,0]=4 375 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)Br 62a_100012355174_100015188311 [0,1,0,0,0,0|2,0,0]=3 376 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)Br 62a_100015188311_100012355174 [0,1,0,0,0,0|2,0,0]=3 377 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)C 62a_100015188311_100011356939 [0,1,0,0,0,0|2,0,0]=3 378 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)Cl 62a_100015188311_100011356831 [0,1,0,0,0,0|2,0,0]=3 379 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)F 62a_100015188311_100000037165 [0,1,0,0,0,0|2,0,0]=3 380 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)N 62a_100015188311_100000688460 [0,1,0,0,0,0|2,0,0]=3 381 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)O 62a_100015188311_100000687585 [0,1,0,0,0,0|2,0,0]=3 382 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)Br 62a_100010185652_100015188311 [0,1,0,0,0,0|2,0,1]=4 383 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)Br 62a_100015188311_100010185652 [0,1,0,0,0,0|2,0,1]=4 384 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)C 62a_100011361606_100015188311 [0,1,0,0,0,0|2,0,1]=4 385 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)C 62a_100015188311_100011361606 [0,1,0,0,0,0|2,0,1]=4 386 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)Cl 62a_100010254384_100015188311 [0,1,0,0,0,0|2,0,1]=4 387 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)Cl 62a_100015188311_100010254384 [0,1,0,0,0,0|2,0,1]=4 388 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)F 62a_100000050626_100015188311 [0,1,0,0,0,0|2,0,1]=4 389 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)F 62a_100015188311_100000050626 [0,1,0,0,0,0|2,0,1]=4 390 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)N 62a_100011935258_100015188311 [0,1,0,0,0,0|2,0,1]=4 391 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C=O)O 62a_100015188311_100000186750 [0,1,0,0,0,0|2,0,1]=4 392 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CN)F 62a_100009815772_100015188311 [0,1,0,0,0,0|2,0,1]=4 393 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CN)F 62a_100015188311_100009815772 [0,1,0,0,0,0|2,0,1]=4 394 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CN)N 62a_100012349119_100015188311 [0,1,0,0,0,0|2,0,1]=4 395 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CN)N 62a_100015188311_100012349119 [0,1,0,0,0,0|2,0,1]=4 396 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CN)O 62a_100000730032_100015188311 [0,1,0,0,0,0|2,0,1]=4 397 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CN)O 62a_100015188311_100000730032 [0,1,0,0,0,0|2,0,1]=4 398 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)Br 62a_100012359683_100015188311 [0,1,0,0,0,0|2,0,1]=4 399 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)Br 62a_100015188311_100012359683 [0,1,0,0,0,0|2,0,1]=4 400 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)C 62a_100000700630_100015188311 [0,1,0,0,0,0|2,0,1]=4 401 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)C 62a_100015188311_100000700630 [0,1,0,0,0,0|2,0,1]=4 402 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)Cl 62a_100010128486_100015188311 [0,1,0,0,0,0|2,0,1]=4 403 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)Cl 62a_100015188311_100010128486 [0,1,0,0,0,0|2,0,1]=4 404 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)F 62a_100000246282_100015188311 [0,1,0,0,0,0|2,0,1]=4 405 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)F 62a_100015188311_100000246282 [0,1,0,0,0,0|2,0,1]=4 406 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)N 62a_100012353972_100015188311 [0,1,0,0,0,0|2,0,1]=4 407 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)N 62a_100015188311_100012353972 [0,1,0,0,0,0|2,0,1]=4 408 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)O 62a_100000184703_100015188311 [0,1,0,0,0,0|2,0,1]=4 409 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CO)O 62a_100015188311_100000184703 [0,1,0,0,0,0|2,0,1]=4 410 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)NN)F 62a_100015188311_100020610843 [0,1,0,0,0,0|3,0,0]=4 411 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)NN)F 62a_100020610843_100015188311 [0,1,0,0,0,0|3,0,0]=4 412 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)Br 62a_100012353699_100015188311 [0,1,0,0,0,0|2,0,1]=4 413 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)Br 62a_100015188311_100012353699 [0,1,0,0,0,0|2,0,1]=4 414 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)C 62a_100011830276_100015188311 [0,1,0,0,0,0|2,0,1]=4 415 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)C 62a_100015188311_100011830276 [0,1,0,0,0,0|2,0,1]=4 416 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)Cl 62a_100011356853_100015188311 [0,1,0,0,0,0|2,0,1]=4 417 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)Cl 62a_100015188311_100011356853 [0,1,0,0,0,0|2,0,1]=4 418 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)F 62a_100011934186_100015188311 [0,1,0,0,0,0|2,0,1]=4 419 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)F 62a_100015188311_100011934186 [0,1,0,0,0,0|2,0,1]=4 420 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)N 62a_100011279103_100015188311 [0,1,0,0,0,0|2,0,1]=4 421 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)N 62a_100015188311_100015196925 [0,1,0,0,0,0|2,0,1]=4 422 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)OC)O 62a_100015188311_100000694246 [0,1,0,0,0,0|2,0,1]=4 423 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)SC)F 62a_100010341305_100015188311 [0,1,0,0,0,0|2,0,1]=4 424 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)SC)F 62a_100015188311_100010341305 [0,1,0,0,0,0|2,0,1]=4 425 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(n3)C#N)C 62a_100015188311_100009885930 [0,1,0,0,0,0|3,0,0]=4 426 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(n3)C#N)F 62a_100015188311_100000722900 [0,1,0,0,0,0|3,0,0]=4 427 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(n3)C#N)N 62a_100015188311_100000068710 [0,1,0,0,0,0|3,0,0]=4 428 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cnc(c(c3)C#N)C 62a_100015188311_200016216807 [0,1,0,0,0,0|3,0,0]=4 429 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cnc(c(c3)C#N)Cl 62a_100015188311_100012357031 [0,1,0,0,0,0|3,0,0]=4 430 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cnc(c(c3)C#N)F 62a_100015188311_100010136711 [0,1,0,0,0,0|3,0,0]=4 431 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cnc(c(c3)C#N)N 62a_100015188311_100000693231 [0,1,0,0,0,0|3,0,0]=4 432 B32R3.245964973 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cnc(c(c3)C#N)O 62a_100015188311_100000697733 [0,1,0,0,0,0|3,0,0]=4 433 B32R3.245965243 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)C#N 27a_100000221292_100015188311 [0,1,0,0,0,0|1,0,0]=2 434 B32R3.245965243 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)OC 27a_100000219725_100015188311 [0,1,0,0,0,0|1,0,1]=3 435 B32R3.245965243 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)SC 27a_100020672454_100015188311 [0,1,0,0,0,0|1,0,1]=3 436 B32R3.2558035603 C#Cc1ccc(c(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC)C 27a_100012022948_100015188311 [0,1,0,0,0,0|0,0,0]=1 437 B32R3.2558035603 C#Cc1ccc(c(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC)F 27a_100000100531_100015188311 [0,1,0,0,0,0|0,0,0]=1 438 B32R3.2558035603 CCc1ccc(c(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC)C 27a_200012022522_100015188311 [0,1,0,0,0,0|0,0,2]=3 439 B32R3.2558035603 CCc1ccc(c(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC)O 27a_100000765835_100015188311 [0,1,0,0,0,0|0,0,2]=3 440 B32R3.2558035603 CCc1ccc(c(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)F 62a_100015188311_200010244628 [0,1,0,0,0,0|1,0,2]=4 441 B32R3.2558035603 CCc1ccc(c(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)F 62a_200010244628_100015188311 [0,1,0,0,0,0|1,0,2]=4 442 B32R3.2558035603 CCc1ccc(c(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)N 62a_100012339725_100015188311 [0,1,0,0,0,0|1,0,2]=4 443 B32R3.2558035603 CCc1ccc(c(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)N 62a_100015188311_100012339725 [0,1,0,0,0,0|1,0,2]=4 444 B32R3.2558035603 CCc1ccc(c(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)O 62a_100012339963_100015188311 [0,1,0,0,0,0|1,0,2]=4 445 B32R3.2558035603 CCc1ccc(c(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)O 62a_100015188311_100012339963 [0,1,0,0,0,0|1,0,2]=4 446 B32R3.2558035603 CNc1ccc(c(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)C 62a_100000707694_100015188311 [0,1,0,0,0,0|2,0,1]=4 447 B32R3.2558035603 CNc1ccc(c(c1)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)C 62a_100015188311_100000707694 [0,1,0,0,0,0|2,0,1]=4 448 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3Br)CO 27a_100012347568_100015188311 [0,1,0,0,0,0|1,0,1]=3 449 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)C#N 27a_100000748024_100015188311 [0,1,0,0,0,0|1,0,0]=2 450 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)CO 27a_100000758420_100015188311 [0,1,0,0,0,0|1,0,1]=3 451 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)OC 27a_100000760359_100015188311 [0,1,0,0,0,0|1,0,1]=3 452 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3Cl)CO 27a_106256033963_100015188311 [0,1,0,0,0,0|1,0,1]=3 453 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)CO 27a_102125399562_100015188311 [0,1,0,0,0,0|1,0,1]=3 454 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)OC 27a_100000764331_100015188311 [0,1,0,0,0,0|1,0,1]=3 455 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3I)OC 27a_100000748021_100015188311 [0,1,0,0,0,0|1,0,1]=3 456 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)C#N 27a_100000766272_100015188311 [0,1,0,0,0,0|1,0,0]=2 457 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)CO 27a_100000123545_100015188311 [0,1,0,0,0,0|1,0,1]=3 458 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)OC 27a_100000188146_100015188311 [0,1,0,0,0,0|1,0,1]=3 459 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)C#N 62a_100015188311_100012349583 [0,1,0,0,0,0|2,0,0]=3 460 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)C=O 62a_100010146563_100015188311 [0,1,0,0,0,0|2,0,1]=4 461 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)C=O 62a_100015188311_100010146563 [0,1,0,0,0,0|2,0,1]=4 462 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)OC 62a_100009992028_100015188311 [0,1,0,0,0,0|2,0,1]=4 463 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)OC 62a_100015188311_100009992028 [0,1,0,0,0,0|2,0,1]=4 464 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)C#N 62a_100015188311_100000690169 [0,1,0,0,0,0|2,0,0]=3 465 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)C=O 62a_100000695567_100015188311 [0,1,0,0,0,0|2,0,1]=4 466 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)C=O 62a_100015188311_100000695567 [0,1,0,0,0,0|2,0,1]=4 467 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)CO 62a_100000708995_100015188311 [0,1,0,0,0,0|2,0,1]=4 468 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)CO 62a_100015188311_100000708995 [0,1,0,0,0,0|2,0,1]=4 469 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)NN 62a_100015188311_100016991967 [0,1,0,0,0,0|3,0,0]=4 470 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)NN 62a_100016991967_100015188311 [0,1,0,0,0,0|3,0,0]=4 471 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)OC 62a_100012349166_100015188311 [0,1,0,0,0,0|2,0,1]=4 472 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)OC 62a_100015188311_100012349166 [0,1,0,0,0,0|2,0,1]=4 473 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)C#N 62a_100015188311_100010199462 [0,1,0,0,0,0|2,0,0]=3 474 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)C=O 62a_100010209939_100015188311 [0,1,0,0,0,0|2,0,1]=4 475 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)C=O 62a_100015188311_100010209939 [0,1,0,0,0,0|2,0,1]=4 476 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)OC 62a_100011356938_100015188311 [0,1,0,0,0,0|2,0,1]=4 477 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)OC 62a_100015188311_100011356938 [0,1,0,0,0,0|2,0,1]=4 478 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)C#N 62a_100015188311_100000188605 [0,1,0,0,0,0|2,0,0]=3 479 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)C=O 62a_100000211747_100015188311 [0,1,0,0,0,0|2,0,1]=4 480 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)C=O 62a_100015188311_100000211747 [0,1,0,0,0,0|2,0,1]=4 481 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)CN 62a_100015188311_100015193890 [0,1,0,0,0,0|2,0,1]=4 482 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)CN 62a_100015193890_100015188311 [0,1,0,0,0,0|2,0,1]=4 483 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)CO 62a_100000246287_100015188311 [0,1,0,0,0,0|2,0,1]=4 484 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)CO 62a_100015188311_100000246287 [0,1,0,0,0,0|2,0,1]=4 485 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)NN 62a_100015188311_200025705588 [0,1,0,0,0,0|3,0,0]=4 486 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)NN 62a_200025705588_100015188311 [0,1,0,0,0,0|3,0,0]=4 487 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)OC 62a_100000699733_100015188311 [0,1,0,0,0,0|2,0,1]=4 488 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)OC 62a_100015188311_100000699733 [0,1,0,0,0,0|2,0,1]=4 489 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)SC 62a_100015188311_200010708804 [0,1,0,0,0,0|2,0,1]=4 490 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)SC 62a_200010708804_100015188311 [0,1,0,0,0,0|2,0,1]=4 491 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)C#N 62a_100015188311_100000736769 [0,1,0,0,0,0|2,0,0]=3 492 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)OC 62a_100015188311_100015195136 [0,1,0,0,0,0|2,0,1]=4 493 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)OC 62a_100015195136_100015188311 [0,1,0,0,0,0|2,0,1]=4 494 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)C#N 62a_100015188311_100000725478 [0,1,0,0,0,0|2,0,0]=3 495 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)C=O 62a_100000184552_100015188311 [0,1,0,0,0,0|2,0,1]=4 496 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)C=O 62a_100015188311_100000184552 [0,1,0,0,0,0|2,0,1]=4 497 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)CO 62a_100011191544_100015188311 [0,1,0,0,0,0|2,0,1]=4 498 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)CO 62a_100015188311_100011191544 [0,1,0,0,0,0|2,0,1]=4 499 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)OC 62a_100015188311_100000685887 [0,1,0,0,0,0|2,0,1]=4 500 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cnc3Cl)C#N 62a_100015188311_100010075213 [0,1,0,0,0,0|3,0,0]=4 501 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cnc3N)C#N 62a_100015188311_100009816625 [0,1,0,0,0,0|3,0,0]=4 502 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cnc3O)C#N 62a_100015188311_100009819929 [0,1,0,0,0,0|3,0,0]=4 503 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ncc3C)C#N 62a_100015188311_100010281125 [0,1,0,0,0,0|3,0,0]=4 504 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3nc(ccc3C)C#N 62a_100015188311_100009852034 [0,1,0,0,0,0|3,0,0]=4 505 B32R3.2558035603 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3nc(ccc3N)C#N 62a_100015188311_200010137462 [0,1,0,0,0,0|3,0,0]=4 506 B32R4.149751567 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc4c(c3)CC4 62a_100009818592_100015188311 [0,0,0,1,0,0|1,0,2]=4 507 B32R4.149751567 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc4c(c3)CC4 62a_100015188311_100009818592 [0,0,0,1,0,0|1,0,2]=4 508 B30R3.249116510 C=Cc1cccc(c1)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 271570a_100010046461_100015188311 [0,0,0,0,1,0|0,0,2]=3 509 B30R3.249116510 CCc1cccc(c1)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 271570a_100012343334_100015188311 [0,0,0,0,1,0|0,0,2]=3 510 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C#N 271570a_100011218837_100015188311 [0,0,0,0,1,0|1,0,0]=2 511 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C=O 271570a_100000039908_100015188311 [0,0,0,0,1,0|1,0,1]=3 512 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)CO 271570a_100011830409_100015188311 [0,0,0,0,1,0|1,0,1]=3 513 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)OC 271570a_100000751105_100015188311 [0,0,0,0,1,0|1,0,1]=3 514 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)SC 271570a_100011218859_100015188311 [0,0,0,0,1,0|1,0,1]=3 515 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(n3)C#N 271570a_100000068790_100015188311 [0,0,0,0,1,0|2,0,0]=3 516 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(n3)OC 271570a_100000062350_100015188311 [0,0,0,0,1,0|2,0,1]=4 517 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccnc(c3)C#N 271570a_100010205036_100015188311 [0,0,0,0,1,0|2,0,0]=3 518 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccnc(c3)C=O 271570a_100010248655_100015188311 [0,0,0,0,1,0|2,0,1]=4 519 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccnc(c3)OC 271570a_100011356756_100015188311 [0,0,0,0,1,0|2,0,1]=4 520 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)C#N 271570a_100011934762_100015188311 [0,0,0,0,1,0|2,0,0]=3 521 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)C=O 271570a_100010138477_100015188311 [0,0,0,0,1,0|2,0,1]=4 522 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)CO 271570a_100010080868_100015188311 [0,0,0,0,1,0|2,0,1]=4 523 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)OC 271570a_100011934342_100015188311 [0,0,0,0,1,0|2,0,1]=4 524 B30R3.249116510 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)SC 271570a_100000049377_100015188311 [0,0,0,0,1,0|2,0,1]=4 525 B30R3.1471168630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccsc3C#N 62a_100015188311_100011215142 [0,0,0,0,1,0|3,0,0]=4 526 B30R3.1471168630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cscc3C#N 62a_100015188311_100011934119 [0,0,0,0,1,0|3,0,0]=4 527 B30R3.1471168630 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3sccc3C#N 62a_100015188311_100009817073 [0,0,0,0,1,0|3,0,0]=4 528 B30R3.1471168637 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3c[nH]c(c3)C#N 62a_100015188311_100009952751 [0,0,0,0,1,0|3,0,0]=4 529 B30R3.1471168637 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(o3)C#N 62a_100015188311_100000764468 [0,0,0,0,1,0|3,0,0]=4 530 B30R3.1471168637 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(s3)C#N 62a_100015188311_100000737243 [0,0,0,0,1,0|3,0,0]=4 531 B30R3.1471168637 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3csc(c3)C#N 62a_100015188311_100000742465 [0,0,0,0,1,0|3,0,0]=4 532 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)C=Cc3cccc(c3)OC 271570a_100010186523_100015188311 [0,0,0,0,0,1|2,0,1]=4 533 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(ccn3)OC 27a_100000706253_100015188311 [0,0,0,0,0,1|2,0,1]=4 534 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)C#N 27a_100000755147_100015188311 [0,0,0,0,0,1|1,0,0]=2 535 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)CO 27a_100011269909_100015188311 [0,0,0,0,0,1|1,0,1]=3 536 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)OC 27a_100000174954_100015188311 [0,0,0,0,0,1|1,0,1]=3 537 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(n3)OC 27a_100000746380_100015188311 [0,0,0,0,0,1|2,0,1]=4 538 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccnc(c3)CO 27a_100020589248_100015188311 [0,0,0,0,0,1|2,0,1]=4 539 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccnc(c3)OC 27a_100102525109_100015188311 [0,0,0,0,0,1|2,0,1]=4 540 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cncc(c3)OC 27a_100020589029_100015188311 [0,0,0,0,0,1|2,0,1]=4 541 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)C#N 62a_100015188311_100000233786 [0,0,0,0,0,1|2,0,0]=3 542 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)C=O 62a_100009816774_100015188311 [0,0,0,0,0,1|2,0,1]=4 543 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)C=O 62a_100015188311_100009816774 [0,0,0,0,0,1|2,0,1]=4 544 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)CO 62a_100010188025_100015188311 [0,0,0,0,0,1|2,0,1]=4 545 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)CO 62a_100015188311_100010188025 [0,0,0,0,0,1|2,0,1]=4 546 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)OC 62a_100000688526_100015188311 [0,0,0,0,0,1|2,0,1]=4 547 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)OC 62a_100015188311_100000211672 [0,0,0,0,0,1|2,0,1]=4 548 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(n3)C#N 62a_100015188311_100000097530 [0,0,0,0,0,1|3,0,0]=4 549 B32R3.245966842 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cncc(c3)C#N 62a_100015188311_200020634941 [0,0,0,0,0,1|3,0,0]=4 550 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccccc3 27a_100000106764_100015188311 [2,0,0,0,0,0|0,0,0]=2 551 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccccc3 62a_100000719477_100015188311 [2,0,0,0,0,0|1,0,0]=3 552 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccccc3 62a_100015188311_100000041952 [2,0,0,0,0,0|1,0,0]=3 553 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccccn3 62a_100011216584_100015188311 [2,0,0,0,0,0|2,0,0]=4 554 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccccn3 62a_100015188311_100011216584 [2,0,0,0,0,0|2,0,0]=4 555 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccnc3 62a_100000210063_100015188311 [2,0,0,0,0,0|2,0,0]=4 556 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccnc3 62a_100015188311_100000210063 [2,0,0,0,0,0|2,0,0]=4 557 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccncc3 62a_100000728582_100015188311 [2,0,0,0,0,0|2,0,0]=4 558 B29R3.24997741 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccncc3 62a_100015188311_100000728582 [2,0,0,0,0,0|2,0,0]=4 559 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Br)Br 27a_100012047176_100015188311 [1,1,0,0,0,0|1,0,0]=3 560 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Br)C 27a_100000695972_100015188311 [1,1,0,0,0,0|0,0,1]=3 561 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Br)Cl 27a_100011934539_100015188311 [1,1,0,0,0,0|1,0,0]=3 562 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Br)F 27a_100000705686_100015188311 [1,1,0,0,0,0|1,0,0]=3 563 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)C)C 27a_100000210930_100015188311 [1,1,0,0,0,0|0,0,1]=3 564 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Cl)C 27a_100012022512_100015188311 [1,1,0,0,0,0|0,0,1]=3 565 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Cl)Cl 27a_100000210456_100015188311 [1,1,0,0,0,0|1,0,0]=3 566 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Cl)F 27a_100000686136_100015188311 [1,1,0,0,0,0|1,0,0]=3 567 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Cl)O 27a_100000123917_100015188311 [1,1,0,0,0,0|1,0,0]=3 568 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)F)C 27a_100000742734_100015188311 [1,1,0,0,0,0|0,0,1]=3 569 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)F)F 27a_100000233717_100015188311 [1,1,0,0,0,0|1,0,0]=3 570 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)I)Br 27a_100009814763_100015188311 [1,1,0,0,0,0|1,0,0]=3 571 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)I)Cl 27a_100010147676_100015188311 [1,1,0,0,0,0|1,0,0]=3 572 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)I)F 27a_100011356972_100015188311 [1,1,0,0,0,0|1,0,0]=3 573 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)I)I 27a_200000696836_100015188311 [1,1,0,0,0,0|1,0,0]=3 574 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)O)C 27a_100011995906_100015188311 [1,1,0,0,0,0|0,0,1]=3 575 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)O)O 27a_100000043371_100015188311 [1,1,0,0,0,0|1,0,0]=3 576 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)Br 62a_100009814770_100015188311 [1,1,0,0,0,0|2,0,0]=4 577 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)Br 62a_100015188311_100009814770 [1,1,0,0,0,0|2,0,0]=4 578 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)Cl 62a_100009814755_100015188311 [1,1,0,0,0,0|2,0,0]=4 579 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)Cl 62a_100015188311_100009814755 [1,1,0,0,0,0|2,0,0]=4 580 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)F 62a_100009814764_100015188311 [1,1,0,0,0,0|2,0,0]=4 581 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)F 62a_100015188311_100009814764 [1,1,0,0,0,0|2,0,0]=4 582 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)N 62a_100009814763_100015188311 [1,1,0,0,0,0|2,0,0]=4 583 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)N 62a_100015188311_100009814763 [1,1,0,0,0,0|2,0,0]=4 584 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)O 62a_100010068917_100015188311 [1,1,0,0,0,0|2,0,0]=4 585 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)O 62a_100015188311_100010068917 [1,1,0,0,0,0|2,0,0]=4 586 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C)C 62a_100011215608_100015188311 [1,1,0,0,0,0|1,0,1]=4 587 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C)C 62a_100015188311_100011215608 [1,1,0,0,0,0|1,0,1]=4 588 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)C 62a_100010172791_100015188311 [1,1,0,0,0,0|1,0,1]=4 589 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)C 62a_100015188311_100010172791 [1,1,0,0,0,0|1,0,1]=4 590 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)Cl 62a_100000747138_100015188311 [1,1,0,0,0,0|2,0,0]=4 591 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)Cl 62a_100015188311_100000747138 [1,1,0,0,0,0|2,0,0]=4 592 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)F 62a_100013859453_100015188311 [1,1,0,0,0,0|2,0,0]=4 593 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)F 62a_100015188311_100013859453 [1,1,0,0,0,0|2,0,0]=4 594 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)N 62a_100010147676_100015188311 [1,1,0,0,0,0|2,0,0]=4 595 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)N 62a_100015188311_100010147676 [1,1,0,0,0,0|2,0,0]=4 596 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)O 62a_100010068924_100015188311 [1,1,0,0,0,0|2,0,0]=4 597 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)O 62a_100015188311_100010068924 [1,1,0,0,0,0|2,0,0]=4 598 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)F)C 62a_100011356977_100015188311 [1,1,0,0,0,0|1,0,1]=4 599 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)F)C 62a_100015188311_100011356977 [1,1,0,0,0,0|1,0,1]=4 600 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)F)F 62a_100000233788_100015188311 [1,1,0,0,0,0|2,0,0]=4 601 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)F)F 62a_100015188311_100000233788 [1,1,0,0,0,0|2,0,0]=4 602 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)F)N 62a_100011356972_100015188311 [1,1,0,0,0,0|2,0,0]=4 603 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)F)N 62a_100015188311_100011356972 [1,1,0,0,0,0|2,0,0]=4 604 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)F)O 62a_100000688818_100015188311 [1,1,0,0,0,0|2,0,0]=4 605 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)F)O 62a_100015188311_100000688818 [1,1,0,0,0,0|2,0,0]=4 606 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)N)C 62a_100000695972_100015188311 [1,1,0,0,0,0|1,0,1]=4 607 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)N)C 62a_100015188311_100000695972 [1,1,0,0,0,0|1,0,1]=4 608 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)N)N 62a_100011999608_100015188311 [1,1,0,0,0,0|2,0,0]=4 609 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)N)N 62a_100015188311_100011999608 [1,1,0,0,0,0|2,0,0]=4 610 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)O)C 62a_100015188311_100011999630 [1,1,0,0,0,0|1,0,1]=4 611 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)O)O 62a_100015188311_100009868816 [1,1,0,0,0,0|2,0,0]=4 612 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3Br)C 27a_100000684715_100015188311 [1,1,0,0,0,0|0,0,1]=3 613 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3Br)Cl 27a_100000687072_100015188311 [1,1,0,0,0,0|1,0,0]=3 614 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)Br 27a_100000750434_100015188311 [1,1,0,0,0,0|1,0,0]=3 615 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)C 27a_100000210026_100015188311 [1,1,0,0,0,0|0,0,1]=3 616 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)Cl 27a_100000210441_100015188311 [1,1,0,0,0,0|1,0,0]=3 617 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)F 27a_100000745574_100015188311 [1,1,0,0,0,0|1,0,0]=3 618 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)I 27a_100000761887_100015188311 [1,1,0,0,0,0|1,0,0]=3 619 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)O 27a_100011216573_100015188311 [1,1,0,0,0,0|1,0,0]=3 620 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3Cl)C 27a_100000765562_100015188311 [1,1,0,0,0,0|0,0,1]=3 621 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3Cl)Cl 27a_100000185733_100015188311 [1,1,0,0,0,0|1,0,0]=3 622 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3Cl)O 27a_100012002038_100015188311 [1,1,0,0,0,0|1,0,0]=3 623 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3F)C 27a_100000697159_100015188311 [1,1,0,0,0,0|0,0,1]=3 624 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3F)Cl 27a_100000199060_100015188311 [1,1,0,0,0,0|1,0,0]=3 625 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)Br 27a_100020590159_100015188311 [1,1,0,0,0,0|1,0,0]=3 626 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)C 27a_100000761888_100015188311 [1,1,0,0,0,0|0,0,1]=3 627 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)Cl 27a_100000049713_100015188311 [1,1,0,0,0,0|1,0,0]=3 628 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)F 27a_100000690935_100015188311 [1,1,0,0,0,0|1,0,0]=3 629 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3O)Br 27a_100011934915_100015188311 [1,1,0,0,0,0|1,0,0]=3 630 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3O)C 27a_100000756359_100015188311 [1,1,0,0,0,0|0,0,1]=3 631 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3O)Cl 27a_100000754742_100015188311 [1,1,0,0,0,0|1,0,0]=3 632 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3O)F 27a_100011934987_100015188311 [1,1,0,0,0,0|1,0,0]=3 633 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3O)I 27a_100010084371_100015188311 [1,1,0,0,0,0|1,0,0]=3 634 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)Br 62a_100010175083_100015188311 [1,1,0,0,0,0|2,0,0]=4 635 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)Br 62a_100015188311_100010175083 [1,1,0,0,0,0|2,0,0]=4 636 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)C 62a_100012362457_100015188311 [1,1,0,0,0,0|1,0,1]=4 637 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)C 62a_100015188311_100012362457 [1,1,0,0,0,0|1,0,1]=4 638 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)Cl 62a_100014021842_100015188311 [1,1,0,0,0,0|2,0,0]=4 639 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)Cl 62a_100015188311_100014021842 [1,1,0,0,0,0|2,0,0]=4 640 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)F 62a_100010202630_100015188311 [1,1,0,0,0,0|2,0,0]=4 641 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)F 62a_100015188311_100010202630 [1,1,0,0,0,0|2,0,0]=4 642 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)O 62a_100010187914_100015188311 [1,1,0,0,0,0|2,0,0]=4 643 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)O 62a_100015188311_100010187914 [1,1,0,0,0,0|2,0,0]=4 644 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)Br 62a_100012353703_100015188311 [1,1,0,0,0,0|2,0,0]=4 645 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)Br 62a_100015188311_100012353703 [1,1,0,0,0,0|2,0,0]=4 646 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)C 62a_100011214922_100015188311 [1,1,0,0,0,0|1,0,1]=4 647 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)C 62a_100015188311_100011214922 [1,1,0,0,0,0|1,0,1]=4 648 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)Cl 62a_100000726075_100015188311 [1,1,0,0,0,0|2,0,0]=4 649 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)Cl 62a_100015188311_100000726075 [1,1,0,0,0,0|2,0,0]=4 650 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)F 62a_100011216893_100015188311 [1,1,0,0,0,0|2,0,0]=4 651 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)F 62a_100015188311_100011216893 [1,1,0,0,0,0|2,0,0]=4 652 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)N 62a_100000761887_100015188311 [1,1,0,0,0,0|2,0,0]=4 653 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)N 62a_100015188311_100000761887 [1,1,0,0,0,0|2,0,0]=4 654 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)O 62a_100012002258_100015188311 [1,1,0,0,0,0|2,0,0]=4 655 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)O 62a_100015188311_100012002258 [1,1,0,0,0,0|2,0,0]=4 656 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)Br 62a_100010142854_100015188311 [1,1,0,0,0,0|2,0,0]=4 657 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)Br 62a_100015188311_100010142854 [1,1,0,0,0,0|2,0,0]=4 658 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)C 62a_100015188311_200012352035 [1,1,0,0,0,0|1,0,1]=4 659 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)C 62a_200012352035_100015188311 [1,1,0,0,0,0|1,0,1]=4 660 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)Cl 62a_100011215384_100015188311 [1,1,0,0,0,0|2,0,0]=4 661 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)Cl 62a_100015188311_100011215384 [1,1,0,0,0,0|2,0,0]=4 662 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)F 62a_100015188311_200010234923 [1,1,0,0,0,0|2,0,0]=4 663 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)F 62a_200010234923_100015188311 [1,1,0,0,0,0|2,0,0]=4 664 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)O 62a_100015188311_100000049636 [1,1,0,0,0,0|2,0,0]=4 665 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)Br 62a_100000702267_100015188311 [1,1,0,0,0,0|2,0,0]=4 666 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)Br 62a_100015188311_100000702267 [1,1,0,0,0,0|2,0,0]=4 667 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)C 62a_100000717567_100015188311 [1,1,0,0,0,0|1,0,1]=4 668 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)C 62a_100015188311_100000717567 [1,1,0,0,0,0|1,0,1]=4 669 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)Cl 62a_100011217346_100015188311 [1,1,0,0,0,0|2,0,0]=4 670 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)Cl 62a_100015188311_100011217346 [1,1,0,0,0,0|2,0,0]=4 671 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)F 62a_100000694657_100015188311 [1,1,0,0,0,0|2,0,0]=4 672 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)F 62a_100015188311_100000694657 [1,1,0,0,0,0|2,0,0]=4 673 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)N 62a_100011935091_100015188311 [1,1,0,0,0,0|2,0,0]=4 674 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)N 62a_100015188311_100011935091 [1,1,0,0,0,0|2,0,0]=4 675 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)O 62a_100009817021_100015188311 [1,1,0,0,0,0|2,0,0]=4 676 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)O 62a_100015188311_100009817021 [1,1,0,0,0,0|2,0,0]=4 677 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)Br 62a_100010146558_100015188311 [1,1,0,0,0,0|2,0,0]=4 678 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)Br 62a_100015188311_100010146558 [1,1,0,0,0,0|2,0,0]=4 679 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)C 62a_100011834072_100015188311 [1,1,0,0,0,0|1,0,1]=4 680 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)C 62a_100015188311_100011834072 [1,1,0,0,0,0|1,0,1]=4 681 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)Cl 62a_100010190421_100015188311 [1,1,0,0,0,0|2,0,0]=4 682 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)Cl 62a_100015188311_100010190421 [1,1,0,0,0,0|2,0,0]=4 683 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)F 62a_100000042321_100015188311 [1,1,0,0,0,0|2,0,0]=4 684 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)F 62a_100015188311_100000042321 [1,1,0,0,0,0|2,0,0]=4 685 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)N 62a_100015191791_100015188311 [1,1,0,0,0,0|2,0,0]=4 686 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3N)O 62a_100015188311_100011934926 [1,1,0,0,0,0|2,0,0]=4 687 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)Br 62a_100010084509_100015188311 [1,1,0,0,0,0|2,0,0]=4 688 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)Br 62a_100015188311_100010084509 [1,1,0,0,0,0|2,0,0]=4 689 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)C 62a_100009817157_100015188311 [1,1,0,0,0,0|1,0,1]=4 690 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)C 62a_100015188311_100009817157 [1,1,0,0,0,0|1,0,1]=4 691 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)Cl 62a_100010202889_100015188311 [1,1,0,0,0,0|2,0,0]=4 692 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)Cl 62a_100015188311_100010202889 [1,1,0,0,0,0|2,0,0]=4 693 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)F 62a_100009813666_100015188311 [1,1,0,0,0,0|2,0,0]=4 694 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)F 62a_100015188311_100009813666 [1,1,0,0,0,0|2,0,0]=4 695 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)N 62a_100011934915_100015188311 [1,1,0,0,0,0|2,0,0]=4 696 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)N 62a_100015188311_100010084371 [1,1,0,0,0,0|2,0,0]=4 697 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3O)O 62a_100015188311_100009815950 [1,1,0,0,0,0|2,0,0]=4 698 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Br)Br 27a_100011306057_100015188311 [1,1,0,0,0,0|1,0,0]=3 699 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Br)C 27a_100000736455_100015188311 [1,1,0,0,0,0|1,0,0]=3 700 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Br)Cl 27a_100000686031_100015188311 [1,1,0,0,0,0|1,0,0]=3 701 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Br)F 27a_100000760356_100015188311 [1,1,0,0,0,0|1,0,0]=3 702 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Br)I 27a_100000750458_100015188311 [1,1,0,0,0,0|1,0,0]=3 703 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Br)O 27a_100011534360_100015188311 [1,1,0,0,0,0|1,0,0]=3 704 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C)Br 27a_100000210723_100015188311 [1,1,0,0,0,0|0,0,1]=3 705 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C)C 27a_100000724040_100015188311 [1,1,0,0,0,0|0,0,1]=3 706 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C)Cl 27a_100000187808_100015188311 [1,1,0,0,0,0|0,0,1]=3 707 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C)F 27a_100000750164_100015188311 [1,1,0,0,0,0|0,0,1]=3 708 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C)I 27a_100000198070_100015188311 [1,1,0,0,0,0|0,0,1]=3 709 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C)O 27a_100011218179_100015188311 [1,1,0,0,0,0|0,0,1]=3 710 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Cl)Br 27a_100000687081_100015188311 [1,1,0,0,0,0|1,0,0]=3 711 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Cl)C 27a_100000188892_100015188311 [1,1,0,0,0,0|1,0,0]=3 712 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Cl)Cl 27a_100000184108_100015188311 [1,1,0,0,0,0|1,0,0]=3 713 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Cl)F 27a_100000211060_100015188311 [1,1,0,0,0,0|1,0,0]=3 714 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Cl)I 27a_100000761885_100015188311 [1,1,0,0,0,0|1,0,0]=3 715 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Cl)O 27a_100000744943_100015188311 [1,1,0,0,0,0|1,0,0]=3 716 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)F)Br 27a_100000759894_100015188311 [1,1,0,0,0,0|1,0,0]=3 717 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)F)C 27a_100000210958_100015188311 [1,1,0,0,0,0|1,0,0]=3 718 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)F)Cl 27a_100000739366_100015188311 [1,1,0,0,0,0|1,0,0]=3 719 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)F)F 27a_100000210724_100015188311 [1,1,0,0,0,0|1,0,0]=3 720 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)F)I 27a_100011356925_100015188311 [1,1,0,0,0,0|1,0,0]=3 721 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)F)O 27a_100011220035_100015188311 [1,1,0,0,0,0|1,0,0]=3 722 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)I)Br 27a_100000750459_100015188311 [1,1,0,0,0,0|1,0,0]=3 723 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)I)C 27a_100000184131_100015188311 [1,1,0,0,0,0|1,0,0]=3 724 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)I)Cl 27a_100012360549_100015188311 [1,1,0,0,0,0|1,0,0]=3 725 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)I)F 27a_114828291077_100015188311 [1,1,0,0,0,0|1,0,0]=3 726 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)O)C 27a_100000759471_100015188311 [1,1,0,0,0,0|1,0,0]=3 727 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)O)Cl 27a_100011934209_100015188311 [1,1,0,0,0,0|1,0,0]=3 728 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)O)F 27a_100012017398_100015188311 [1,1,0,0,0,0|1,0,0]=3 729 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)O)O 27a_100102946323_100015188311 [1,1,0,0,0,0|1,0,0]=3 730 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)Br 62a_100012356285_100015188311 [1,1,0,0,0,0|2,0,0]=4 731 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)Br 62a_100015188311_100012356285 [1,1,0,0,0,0|2,0,0]=4 732 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)C 62a_100011847877_100015188311 [1,1,0,0,0,0|2,0,0]=4 733 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)C 62a_100015188311_100011847877 [1,1,0,0,0,0|2,0,0]=4 734 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)Cl 62a_100012353702_100015188311 [1,1,0,0,0,0|2,0,0]=4 735 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)Cl 62a_100015188311_100012353702 [1,1,0,0,0,0|2,0,0]=4 736 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)F 62a_100012047266_100015188311 [1,1,0,0,0,0|2,0,0]=4 737 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)F 62a_100015188311_100012047266 [1,1,0,0,0,0|2,0,0]=4 738 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)N 62a_100000750455_100015188311 [1,1,0,0,0,0|2,0,0]=4 739 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)N 62a_100015188311_100000750455 [1,1,0,0,0,0|2,0,0]=4 740 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)O 62a_100012361655_100015188311 [1,1,0,0,0,0|2,0,0]=4 741 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)O 62a_100015188311_100012361655 [1,1,0,0,0,0|2,0,0]=4 742 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)Br 62a_100009813585_100015188311 [1,1,0,0,0,0|1,0,1]=4 743 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)Br 62a_100015188311_100009813585 [1,1,0,0,0,0|1,0,1]=4 744 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)C 62a_100011215607_100015188311 [1,1,0,0,0,0|1,0,1]=4 745 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)C 62a_100015188311_100011215607 [1,1,0,0,0,0|1,0,1]=4 746 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)Cl 62a_100000049509_100015188311 [1,1,0,0,0,0|1,0,1]=4 747 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)Cl 62a_100015188311_100000049509 [1,1,0,0,0,0|1,0,1]=4 748 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)F 62a_100011218330_100015188311 [1,1,0,0,0,0|1,0,1]=4 749 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)F 62a_100015188311_100011218330 [1,1,0,0,0,0|1,0,1]=4 750 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)N 62a_100000211769_100015188311 [1,1,0,0,0,0|1,0,1]=4 751 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)N 62a_100015188311_100000211769 [1,1,0,0,0,0|1,0,1]=4 752 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C)O 62a_100015188311_100000186361 [1,1,0,0,0,0|1,0,1]=4 753 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)Br 62a_100012047281_100015188311 [1,1,0,0,0,0|2,0,0]=4 754 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)Br 62a_100015188311_100012047281 [1,1,0,0,0,0|2,0,0]=4 755 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)C 62a_100011216363_100015188311 [1,1,0,0,0,0|2,0,0]=4 756 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)C 62a_100015188311_100011216363 [1,1,0,0,0,0|2,0,0]=4 757 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)Cl 62a_100011214914_100015188311 [1,1,0,0,0,0|2,0,0]=4 758 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)Cl 62a_100015188311_100011214914 [1,1,0,0,0,0|2,0,0]=4 759 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)F 62a_100011215976_100015188311 [1,1,0,0,0,0|2,0,0]=4 760 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)F 62a_100015188311_100011215976 [1,1,0,0,0,0|2,0,0]=4 761 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)N 62a_100011218065_100015188311 [1,1,0,0,0,0|2,0,0]=4 762 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)N 62a_100015188311_100011218065 [1,1,0,0,0,0|2,0,0]=4 763 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)O 62a_100012360047_100015188311 [1,1,0,0,0,0|2,0,0]=4 764 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)O 62a_100015188311_100012360047 [1,1,0,0,0,0|2,0,0]=4 765 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)Br 62a_100000685389_100015188311 [1,1,0,0,0,0|2,0,0]=4 766 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)Br 62a_100015188311_100000685389 [1,1,0,0,0,0|2,0,0]=4 767 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)C 62a_100000720648_100015188311 [1,1,0,0,0,0|2,0,0]=4 768 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)C 62a_100015188311_100000720648 [1,1,0,0,0,0|2,0,0]=4 769 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)Cl 62a_100011216805_100015188311 [1,1,0,0,0,0|2,0,0]=4 770 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)Cl 62a_100015188311_100011216805 [1,1,0,0,0,0|2,0,0]=4 771 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)F 62a_100000703953_100015188311 [1,1,0,0,0,0|2,0,0]=4 772 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)F 62a_100015188311_100000703953 [1,1,0,0,0,0|2,0,0]=4 773 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)N 62a_100011215594_100015188311 [1,1,0,0,0,0|2,0,0]=4 774 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)N 62a_100015188311_100011215594 [1,1,0,0,0,0|2,0,0]=4 775 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)O 62a_100000185481_100015188311 [1,1,0,0,0,0|2,0,0]=4 776 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)F)O 62a_100015188311_100000185481 [1,1,0,0,0,0|2,0,0]=4 777 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)Br 62a_100000750456_100015188311 [1,1,0,0,0,0|2,0,0]=4 778 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)Br 62a_100015188311_100000750456 [1,1,0,0,0,0|2,0,0]=4 779 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)C 62a_100000761890_100015188311 [1,1,0,0,0,0|2,0,0]=4 780 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)C 62a_100015188311_100000761890 [1,1,0,0,0,0|2,0,0]=4 781 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)Cl 62a_100015188311_200000761891 [1,1,0,0,0,0|2,0,0]=4 782 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)Cl 62a_200000761891_100015188311 [1,1,0,0,0,0|2,0,0]=4 783 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)F 62a_100000740924_100015188311 [1,1,0,0,0,0|2,0,0]=4 784 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)F 62a_100015188311_100000740924 [1,1,0,0,0,0|2,0,0]=4 785 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)N 62a_100000741789_100015188311 [1,1,0,0,0,0|2,0,0]=4 786 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)N 62a_100015188311_100011534411 [1,1,0,0,0,0|2,0,0]=4 787 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)O 62a_100000752626_100015188311 [1,1,0,0,0,0|2,0,0]=4 788 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)N)O 62a_100015188311_100000752626 [1,1,0,0,0,0|2,0,0]=4 789 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)Br 62a_100012356990_100015188311 [1,1,0,0,0,0|2,0,0]=4 790 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)Br 62a_100015188311_100012356990 [1,1,0,0,0,0|2,0,0]=4 791 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)C 62a_100000685420_100015188311 [1,1,0,0,0,0|2,0,0]=4 792 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)C 62a_100015188311_100000685420 [1,1,0,0,0,0|2,0,0]=4 793 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)Cl 62a_100011356854_100015188311 [1,1,0,0,0,0|2,0,0]=4 794 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)Cl 62a_100015188311_100011356854 [1,1,0,0,0,0|2,0,0]=4 795 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)F 62a_100000686035_100015188311 [1,1,0,0,0,0|2,0,0]=4 796 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)F 62a_100015188311_100000686035 [1,1,0,0,0,0|2,0,0]=4 797 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)N 62a_100000739049_100015188311 [1,1,0,0,0,0|2,0,0]=4 798 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)N 62a_100015188311_100000739049 [1,1,0,0,0,0|2,0,0]=4 799 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)O)O 62a_100015188311_100009813601 [1,1,0,0,0,0|2,0,0]=4 800 B31R3.1432153445 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)Br 27a_100000219648_100015188311 [1,1,0,0,0,0|1,0,0]=3 801 B31R3.1432153445 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)C 27a_100000219674_100015188311 [1,1,0,0,0,0|0,0,1]=3 802 B31R3.1432153445 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)Cl 27a_100000220044_100015188311 [1,1,0,0,0,0|1,0,0]=3 803 B31R3.1432153445 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)F 27a_100020633736_100015188311 [1,1,0,0,0,0|1,0,0]=3 804 B31R3.1432153445 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)I 27a_100000221217_100015188311 [1,1,0,0,0,0|1,0,0]=3 805 B31R3.1432153445 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)O 27a_100000756613_100015188311 [1,1,0,0,0,0|1,0,0]=3 806 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3Br)C 27a_100000745044_100015188311 [1,1,0,0,0,0|0,0,1]=3 807 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)Br 27a_100000741167_100015188311 [1,1,0,0,0,0|1,0,0]=3 808 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)C 27a_100000185781_100015188311 [1,1,0,0,0,0|0,0,1]=3 809 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)Cl 27a_100000211374_100015188311 [1,1,0,0,0,0|1,0,0]=3 810 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)I 27a_100000761890_100015188311 [1,1,0,0,0,0|1,0,0]=3 811 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)O 27a_100011216113_100015188311 [1,1,0,0,0,0|1,0,0]=3 812 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3Cl)C 27a_100011215360_100015188311 [1,1,0,0,0,0|0,0,1]=3 813 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)Br 27a_100000740924_100015188311 [1,1,0,0,0,0|1,0,0]=3 814 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)C 27a_100000211285_100015188311 [1,1,0,0,0,0|0,0,1]=3 815 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)Cl 27a_100000212115_100015188311 [1,1,0,0,0,0|1,0,0]=3 816 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)F 27a_100000210742_100015188311 [1,1,0,0,0,0|1,0,0]=3 817 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)I 27a_100011464823_100015188311 [1,1,0,0,0,0|1,0,0]=3 818 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)O 27a_100012017239_100015188311 [1,1,0,0,0,0|1,0,0]=3 819 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3I)C 27a_100011216686_100015188311 [1,1,0,0,0,0|0,0,1]=3 820 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)Br 27a_100000752626_100015188311 [1,1,0,0,0,0|1,0,0]=3 821 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)C 27a_100011215204_100015188311 [1,1,0,0,0,0|0,0,1]=3 822 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)Cl 27a_100000210500_100015188311 [1,1,0,0,0,0|1,0,0]=3 823 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)F 27a_100000759472_100015188311 [1,1,0,0,0,0|1,0,0]=3 824 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)I 27a_100000753495_100015188311 [1,1,0,0,0,0|1,0,0]=3 825 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)Br 62a_100011483371_100015188311 [1,1,0,0,0,0|2,0,0]=4 826 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)Br 62a_100015188311_100011483371 [1,1,0,0,0,0|2,0,0]=4 827 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)C 62a_100012353751_100015188311 [1,1,0,0,0,0|1,0,1]=4 828 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)C 62a_100015188311_100012353751 [1,1,0,0,0,0|1,0,1]=4 829 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)Cl 62a_100012339723_100015188311 [1,1,0,0,0,0|2,0,0]=4 830 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)Cl 62a_100015188311_100012339723 [1,1,0,0,0,0|2,0,0]=4 831 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)F 62a_100011217576_100015188311 [1,1,0,0,0,0|2,0,0]=4 832 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)F 62a_100015188311_100011217576 [1,1,0,0,0,0|2,0,0]=4 833 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)N 62a_100000750459_100015188311 [1,1,0,0,0,0|2,0,0]=4 834 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)N 62a_100015188311_100000750459 [1,1,0,0,0,0|2,0,0]=4 835 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)O 62a_100012339312_100015188311 [1,1,0,0,0,0|2,0,0]=4 836 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)O 62a_100015188311_100012339312 [1,1,0,0,0,0|2,0,0]=4 837 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)Br 62a_100011344865_100015188311 [1,1,0,0,0,0|2,0,0]=4 838 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)Br 62a_100015188311_100011344865 [1,1,0,0,0,0|2,0,0]=4 839 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)C 62a_100000210833_100015188311 [1,1,0,0,0,0|1,0,1]=4 840 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)C 62a_100015188311_100000210833 [1,1,0,0,0,0|1,0,1]=4 841 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)Cl 62a_100011263213_100015188311 [1,1,0,0,0,0|2,0,0]=4 842 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)Cl 62a_100015188311_100011263213 [1,1,0,0,0,0|2,0,0]=4 843 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)F 62a_100011218078_100015188311 [1,1,0,0,0,0|2,0,0]=4 844 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)F 62a_100015188311_100011218078 [1,1,0,0,0,0|2,0,0]=4 845 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)N 62a_100000736455_100015188311 [1,1,0,0,0,0|2,0,0]=4 846 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)N 62a_100015188311_100000736455 [1,1,0,0,0,0|2,0,0]=4 847 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)O 62a_100011380479_100015188311 [1,1,0,0,0,0|2,0,0]=4 848 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C)O 62a_100015188311_100011380479 [1,1,0,0,0,0|2,0,0]=4 849 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)Br 62a_100011772130_100015188311 [1,1,0,0,0,0|2,0,0]=4 850 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)Br 62a_100015188311_100011772130 [1,1,0,0,0,0|2,0,0]=4 851 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)C 62a_100012356289_100015188311 [1,1,0,0,0,0|1,0,1]=4 852 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)C 62a_100015188311_100012356289 [1,1,0,0,0,0|1,0,1]=4 853 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)Cl 62a_100000707729_100015188311 [1,1,0,0,0,0|2,0,0]=4 854 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)Cl 62a_100015188311_100000707729 [1,1,0,0,0,0|2,0,0]=4 855 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)F 62a_100011217299_100015188311 [1,1,0,0,0,0|2,0,0]=4 856 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)F 62a_100015188311_100011217299 [1,1,0,0,0,0|2,0,0]=4 857 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)N 62a_100012360549_100015188311 [1,1,0,0,0,0|2,0,0]=4 858 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)N 62a_100015188311_100012360549 [1,1,0,0,0,0|2,0,0]=4 859 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)O 62a_100000049588_100015188311 [1,1,0,0,0,0|2,0,0]=4 860 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)O 62a_100015188311_100000049588 [1,1,0,0,0,0|2,0,0]=4 861 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)Br 62a_100011217312_100015188311 [1,1,0,0,0,0|2,0,0]=4 862 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)Br 62a_100015188311_100011217312 [1,1,0,0,0,0|2,0,0]=4 863 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)C 62a_100000736223_100015188311 [1,1,0,0,0,0|1,0,1]=4 864 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)C 62a_100015188311_100000736223 [1,1,0,0,0,0|1,0,1]=4 865 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)Cl 62a_100011218116_100015188311 [1,1,0,0,0,0|2,0,0]=4 866 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)Cl 62a_100015188311_100011218116 [1,1,0,0,0,0|2,0,0]=4 867 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)F 62a_100011219198_100015188311 [1,1,0,0,0,0|2,0,0]=4 868 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)F 62a_100015188311_100011219198 [1,1,0,0,0,0|2,0,0]=4 869 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)N 62a_100000760356_100015188311 [1,1,0,0,0,0|2,0,0]=4 870 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)N 62a_100015188311_100000760356 [1,1,0,0,0,0|2,0,0]=4 871 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)O 62a_100000693481_100015188311 [1,1,0,0,0,0|2,0,0]=4 872 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)O 62a_100015188311_100000693481 [1,1,0,0,0,0|2,0,0]=4 873 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)Br 62a_100000187925_100015188311 [1,1,0,0,0,0|2,0,0]=4 874 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)Br 62a_100015188311_100000187925 [1,1,0,0,0,0|2,0,0]=4 875 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)C 62a_100011356834_100015188311 [1,1,0,0,0,0|1,0,1]=4 876 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)C 62a_100015188311_100011356834 [1,1,0,0,0,0|1,0,1]=4 877 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)Cl 62a_100000761889_100015188311 [1,1,0,0,0,0|2,0,0]=4 878 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)Cl 62a_100015188311_100000761889 [1,1,0,0,0,0|2,0,0]=4 879 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)F 62a_100000760547_100015188311 [1,1,0,0,0,0|2,0,0]=4 880 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)F 62a_100015188311_100000760547 [1,1,0,0,0,0|2,0,0]=4 881 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)N 62a_100011534242_100015188311 [1,1,0,0,0,0|2,0,0]=4 882 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)N 62a_100015188311_100011534242 [1,1,0,0,0,0|2,0,0]=4 883 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)O 62a_100012001276_100015188311 [1,1,0,0,0,0|2,0,0]=4 884 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)O 62a_100015188311_100012001276 [1,1,0,0,0,0|2,0,0]=4 885 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)Br 62a_100012355227_100015188311 [1,1,0,0,0,0|2,0,0]=4 886 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)Br 62a_100015188311_100012355227 [1,1,0,0,0,0|2,0,0]=4 887 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)C 62a_100000765521_100015188311 [1,1,0,0,0,0|1,0,1]=4 888 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)C 62a_100015188311_100000765521 [1,1,0,0,0,0|1,0,1]=4 889 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)Cl 62a_100011356953_100015188311 [1,1,0,0,0,0|2,0,0]=4 890 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)Cl 62a_100015188311_100011356953 [1,1,0,0,0,0|2,0,0]=4 891 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)F 62a_100000211999_100015188311 [1,1,0,0,0,0|2,0,0]=4 892 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)F 62a_100015188311_100000211999 [1,1,0,0,0,0|2,0,0]=4 893 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)N 62a_100011534360_100015188311 [1,1,0,0,0,0|2,0,0]=4 894 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)N 62a_100015188311_100011534360 [1,1,0,0,0,0|2,0,0]=4 895 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3O)O 62a_100015188311_100009813629 [1,1,0,0,0,0|2,0,0]=4 896 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C(=O)C 271570a_100000067831_100015188311 [0,1,0,0,1,0|0,0,2]=4 897 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C(=O)N 271570a_100000067779_100015188311 [0,1,0,0,1,0|1,0,1]=4 898 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C(=S)N 271570a_100137510062_100015188311 [0,1,0,0,1,0|1,0,1]=4 899 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C(C)C 271570a_100000750175_100015188311 [0,1,0,0,1,0|0,0,2]=4 900 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C(C)O 271570a_100000117165_100015188311 [0,1,0,0,1,0|0,0,2]=4 901 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C(F)F 271570a_100009857662_100015188311 [0,1,0,0,1,0|1,0,1]=4 902 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)N(C)C 271570a_100016987616_100015188311 [0,1,0,0,1,0|1,0,1]=4 903 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)S(=O)C 271570a_100010046206_100015188311 [0,1,0,0,1,0|1,0,1]=4 904 B31R3.1432135883 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)[N+](=O)[O-] 271570a_100000744860_100015188311 [0,1,0,0,1,0|2,0,0]=4 905 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3C)C#N 271570a_100010144306_100015188311 [0,1,0,0,1,0|1,0,0]=3 906 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3C)OC 271570a_100009847017_100015188311 [0,1,0,0,1,0|1,0,1]=4 907 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3Cl)CO 271570a_100010042584_100015188311 [0,1,0,0,1,0|1,0,1]=4 908 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3Cl)OC 271570a_100000118068_100015188311 [0,1,0,0,1,0|1,0,1]=4 909 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3F)C#N 271570a_100010239799_100015188311 [0,1,0,0,1,0|1,0,0]=3 910 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3F)C=O 271570a_100010090736_100015188311 [0,1,0,0,1,0|1,0,1]=4 911 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3F)CO 271570a_100009857139_100015188311 [0,1,0,0,1,0|1,0,1]=4 912 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3F)OC 271570a_100011216728_100015188311 [0,1,0,0,1,0|1,0,1]=4 913 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3O)C#N 271570a_200009869585_100015188311 [0,1,0,0,1,0|1,0,0]=3 914 B31R3.1432135884 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3O)OC 271570a_200000089636_100015188311 [0,1,0,0,1,0|1,0,1]=4 915 B31R3.1432135886 CC#Cc1cncc(c1)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 271570a_200009878111_100015188311 [0,1,0,0,1,0|1,0,0]=3 916 B31R3.1432135886 CCCc1cccc(c1)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 271570a_100013575481_100015188311 [0,1,0,0,1,0|0,0,2]=4 917 B31R3.1432135886 CCOc1cccc(c1)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 271570a_100000718754_100015188311 [0,1,0,0,1,0|0,0,2]=4 918 B31R3.1432135886 CCSc1cccc(c1)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 271570a_200000049230_100015188311 [0,1,0,0,1,0|0,0,2]=4 919 B31R3.1432135886 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C=NO 271570a_200015191381_100015188311 [0,1,0,0,1,0|1,0,1]=4 920 B31R3.1432135886 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)CC#N 271570a_100000042927_100015188311 [0,1,0,0,1,0|0,0,1]=3 921 B31R3.1432135886 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)CCO 271570a_100010046509_100015188311 [0,1,0,0,1,0|0,0,2]=4 922 B31R3.1432135886 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)COC 271570a_100012352018_100015188311 [0,1,0,0,1,0|0,0,2]=4 923 B31R3.1432135886 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)N=C=O 271570a_100000068223_100015188311 [0,1,0,0,1,0|1,0,1]=4 924 B31R3.1432135886 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)NC=O 271570a_200000040257_100015188311 [0,1,0,0,1,0|1,0,1]=4 925 B31R3.1432135889 CCc1cc(ccc1Cl)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 271570a_100000099142_100015188311 [0,1,0,0,1,0|0,0,2]=4 926 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C#N)C 271570a_100012348253_100015188311 [0,1,0,0,1,0|1,0,0]=3 927 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C#N)Cl 271570a_100000049296_100015188311 [0,1,0,0,1,0|1,0,0]=3 928 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C#N)F 271570a_100000068090_100015188311 [0,1,0,0,1,0|1,0,0]=3 929 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C#N)N 271570a_100010082930_100015188311 [0,1,0,0,1,0|1,0,0]=3 930 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C#N)O 271570a_100010081597_100015188311 [0,1,0,0,1,0|1,0,0]=3 931 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C=O)C 271570a_100010043634_100015188311 [0,1,0,0,1,0|1,0,1]=4 932 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C=O)Cl 271570a_200011083945_100015188311 [0,1,0,0,1,0|1,0,1]=4 933 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C=O)F 271570a_100000038468_100015188311 [0,1,0,0,1,0|1,0,1]=4 934 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)C=O)O 271570a_100010244724_100015188311 [0,1,0,0,1,0|1,0,1]=4 935 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)CO)C 271570a_100000106454_100015188311 [0,1,0,0,1,0|1,0,1]=4 936 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)CO)F 271570a_100010042581_100015188311 [0,1,0,0,1,0|1,0,1]=4 937 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)CO)O 271570a_100010042596_100015188311 [0,1,0,0,1,0|1,0,1]=4 938 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)OC)C 271570a_100010045235_100015188311 [0,1,0,0,1,0|1,0,1]=4 939 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)OC)Cl 271570a_100000739040_100015188311 [0,1,0,0,1,0|1,0,1]=4 940 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)OC)F 271570a_100011356763_100015188311 [0,1,0,0,1,0|1,0,1]=4 941 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)OC)N 271570a_100000068085_100015188311 [0,1,0,0,1,0|1,0,1]=4 942 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)OC)O 271570a_100000040328_100015188311 [0,1,0,0,1,0|1,0,1]=4 943 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(c(c3)SC)F 271570a_200010713127_100015188311 [0,1,0,0,1,0|1,0,1]=4 944 B31R3.1432135889 COCCOc1cc2ncnc(c2cc1OCCOC)c3cnc(c(c3)C#N)N 271570a_100010082189_100015188311 [0,1,0,0,1,0|2,0,0]=4 945 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)C#N)C 271570a_100010144420_100015188311 [0,1,0,0,1,0|1,0,0]=3 946 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)C#N)Cl 271570a_100010074718_100015188311 [0,1,0,0,1,0|1,0,0]=3 947 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)C#N)F 271570a_100012360558_100015188311 [0,1,0,0,1,0|1,0,0]=3 948 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)C#N)N 271570a_100010712952_100015188311 [0,1,0,0,1,0|1,0,0]=3 949 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)C=O)Br 271570a_100010231469_100015188311 [0,1,0,0,1,0|1,0,1]=4 950 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)C=O)C 271570a_100010043635_100015188311 [0,1,0,0,1,0|1,0,1]=4 951 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)C=O)Cl 271570a_200000091716_100015188311 [0,1,0,0,1,0|1,0,1]=4 952 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)C=O)F 271570a_100010082983_100015188311 [0,1,0,0,1,0|1,0,1]=4 953 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)CN)F 271570a_100138413732_100015188311 [0,1,0,0,1,0|1,0,1]=4 954 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)CO)C 271570a_100009870542_100015188311 [0,1,0,0,1,0|1,0,1]=4 955 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)CO)Cl 271570a_200010385081_100015188311 [0,1,0,0,1,0|1,0,1]=4 956 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)CO)F 271570a_100009889100_100015188311 [0,1,0,0,1,0|1,0,1]=4 957 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)OC)Br 271570a_100009814751_100015188311 [0,1,0,0,1,0|1,0,1]=4 958 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)OC)C 271570a_100000097198_100015188311 [0,1,0,0,1,0|1,0,1]=4 959 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)OC)Cl 271570a_100010068875_100015188311 [0,1,0,0,1,0|1,0,1]=4 960 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)OC)F 271570a_100011356766_100015188311 [0,1,0,0,1,0|1,0,1]=4 961 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(cc(c3)OC)N 271570a_100010780367_100015188311 [0,1,0,0,1,0|1,0,1]=4 962 B31R3.1432154806 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(nc(c3)C#N)Cl 271570a_200010082433_100015188311 [0,1,0,0,1,0|2,0,0]=4 963 B31R3.2635618327 CCc1ccc(c(c1)c2ncnc3c2cc(c(c3)OCCOC)OCCOC)F 271570a_100000144087_100015188311 [0,1,0,0,1,0|0,0,2]=4 964 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3C)C#N 271570a_100010243657_100015188311 [0,1,0,0,1,0|1,0,0]=3 965 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3C)C=O 271570a_100010043636_100015188311 [0,1,0,0,1,0|1,0,1]=4 966 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3C)CO 271570a_100010042590_100015188311 [0,1,0,0,1,0|1,0,1]=4 967 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3C)OC 271570a_100011996904_100015188311 [0,1,0,0,1,0|1,0,1]=4 968 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3Cl)C#N 271570a_100000068296_100015188311 [0,1,0,0,1,0|1,0,0]=3 969 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3Cl)C=O 271570a_100010043632_100015188311 [0,1,0,0,1,0|1,0,1]=4 970 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3Cl)CO 271570a_100000068295_100015188311 [0,1,0,0,1,0|1,0,1]=4 971 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3Cl)OC 271570a_100011356759_100015188311 [0,1,0,0,1,0|1,0,1]=4 972 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3F)C#N 271570a_100010178989_100015188311 [0,1,0,0,1,0|1,0,0]=3 973 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3F)C=O 271570a_100000061915_100015188311 [0,1,0,0,1,0|1,0,1]=4 974 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3F)CO 271570a_100000061962_100015188311 [0,1,0,0,1,0|1,0,1]=4 975 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3F)OC 271570a_100011356801_100015188311 [0,1,0,0,1,0|1,0,1]=4 976 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3I)OC 271570a_100010977408_100015188311 [0,1,0,0,1,0|1,0,1]=4 977 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3N)C#N 271570a_200010254555_100015188311 [0,1,0,0,1,0|1,0,0]=3 978 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3N)OC 271570a_100010713012_100015188311 [0,1,0,0,1,0|1,0,1]=4 979 B33R3.225008972 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(cc(c3)C#N)Br 27a_114873767334_100015188311 [0,1,0,0,0,1|1,0,0]=3 980 B33R3.225008972 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(cc(c3)OC)Cl 27a_106744500063_100015188311 [0,1,0,0,0,1|1,0,1]=4 981 B33R3.225008972 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(cc(c3)OC)F 27a_100000696013_100015188311 [0,1,0,0,0,1|1,0,1]=4 982 B33R3.225008972 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cc(cc(c3)C#N)Br 62a_100010204237_100015188311 [0,1,0,0,0,1|2,0,0]=4 983 B33R3.225008972 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cc(cc(c3)C#N)Br 62a_100015188311_100010204237 [0,1,0,0,0,1|2,0,0]=4 984 B33R3.225008972 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cc(cc(c3)C#N)F 62a_100015188311_100012349702 [0,1,0,0,0,1|2,0,0]=4 985 B33R3.225008979 COCCOc1cc2ncnc(c2cc1OCCOC)NC(C)c3cccc(c3)C#N 27a_100016987922_100015188311 [0,1,0,0,0,1|1,0,0]=3 986 B33R3.225008979 COCCOc1cc2ncnc(c2cc1OCCOC)NC(C)c3cccc(c3)OC 27a_100000737859_100015188311 [0,1,0,0,0,1|1,0,1]=4 987 B33R3.225009869 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)Cc3cccc(c3)C#N 27a_100000168042_100015188311 [0,1,0,0,0,1|1,0,0]=3 988 B33R3.225009869 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)Cc3cccc(c3)OC 27a_100000184262_100015188311 [0,1,0,0,0,1|1,0,1]=4 989 B33R3.225009869 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)Cc3cccc(c3)SC 27a_100011934695_100015188311 [0,1,0,0,0,1|1,0,1]=4 990 B33R3.225009996 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)C(=O)N 27a_100000746036_100015188311 [0,1,0,0,0,1|1,0,1]=4 991 B33R3.225009996 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)N(C)C 27a_100000238546_100015188311 [0,1,0,0,0,1|1,0,1]=4 992 B33R3.225009996 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)[N+](=O)[O-] 27a_100000755791_100015188311 [0,1,0,0,0,1|2,0,0]=4 993 B33R3.225009997 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3F)OC 27a_100137345169_100015188311 [0,1,0,0,0,1|1,0,1]=4 994 B33R3.225009997 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3Br)C#N 62a_100010145452_100015188311 [0,1,0,0,0,1|2,0,0]=4 995 B33R3.225009997 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3Br)C#N 62a_100015188311_100010145452 [0,1,0,0,0,1|2,0,0]=4 996 B33R3.225009997 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3Cl)C#N 62a_100015188311_100010147161 [0,1,0,0,0,1|2,0,0]=4 997 B33R3.225009997 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3F)C#N 62a_100015188311_100000695645 [0,1,0,0,0,1|2,0,0]=4 998 B33R3.225009999 CCOc1cccc(c1)CNc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_106359896916_100015188311 [0,1,0,0,0,1|0,0,2]=4 999 B33R3.225010002 CCc1cc(ccc1F)CNc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_114873767189_100015188311 [0,1,0,0,0,1|0,0,2]=4 1000 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccc(c(c3)C#N)Cl 27a_100009846983_100015188311 [0,1,0,0,0,1|1,0,0]=3 1001 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccc(c(c3)C#N)F 27a_100016992121_100015188311 [0,1,0,0,0,1|1,0,0]=3 1002 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccc(c(c3)OC)Cl 27a_100015204853_100015188311 [0,1,0,0,0,1|1,0,1]=4 1003 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccc(c(c3)OC)F 27a_100020626639_100015188311 [0,1,0,0,0,1|1,0,1]=4 1004 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccc(c(c3)OC)O 27a_100000185554_100015188311 [0,1,0,0,0,1|1,0,1]=4 1005 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3ccc(c(c3)C#N)Br 62a_100010128727_100015188311 [0,1,0,0,0,1|2,0,0]=4 1006 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3ccc(c(c3)C#N)Br 62a_100015188311_100010128727 [0,1,0,0,0,1|2,0,0]=4 1007 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3ccc(c(c3)C#N)Cl 62a_100015188311_100010147165 [0,1,0,0,0,1|2,0,0]=4 1008 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3ccc(c(c3)C#N)F 62a_100000687583_100015188311 [0,1,0,0,0,1|2,0,0]=4 1009 B33R3.225010002 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3ccc(c(c3)C#N)F 62a_100015188311_100000687583 [0,1,0,0,0,1|2,0,0]=4 1010 B33R3.1677110612 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(ccc3Br)OC 27a_100000741592_100015188311 [0,1,0,0,0,1|1,0,1]=4 1011 B33R3.1677110612 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(ccc3C)OC 27a_100012180165_100015188311 [0,1,0,0,0,1|1,0,1]=4 1012 B33R3.1677110612 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(ccc3F)OC 27a_100016995475_100015188311 [0,1,0,0,0,1|1,0,1]=4 1013 B33R3.1677110612 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cc(ccc3Br)C#N 62a_100012145668_100015188311 [0,1,0,0,0,1|2,0,0]=4 1014 B33R3.1677110612 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cc(ccc3Br)C#N 62a_100015188311_100012145668 [0,1,0,0,0,1|2,0,0]=4 1015 B33R3.1677110612 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cc(ccc3F)C#N 62a_100015188311_100000239971 [0,1,0,0,0,1|2,0,0]=4 1016 B33R3.225000772 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CC#N)F 62a_100000729538_100015188311 [0,2,0,0,0,0|1,0,1]=4 1017 B33R3.225000772 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CC#N)F 62a_100015188311_100000729538 [0,2,0,0,0,0|1,0,1]=4 1018 B33R3.225000773 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)CO)CO 27a_100000089672_100015188311 [0,2,0,0,0,0|1,0,1]=4 1019 B33R3.225000773 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)OC)C#N 27a_100000125286_100015188311 [0,2,0,0,0,0|1,0,0]=3 1020 B33R3.225000773 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)OC)CO 27a_100012182899_100015188311 [0,2,0,0,0,0|1,0,1]=4 1021 B33R3.225000773 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)OC)OC 27a_100000210928_100015188311 [0,2,0,0,0,0|1,0,1]=4 1022 B33R3.225000773 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C#N)C#N 62a_100015188311_100010187553 [0,2,0,0,0,0|2,0,0]=4 1023 B33R3.225000773 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)C=O)C#N 62a_100015188311_100009814813 [0,2,0,0,0,0|2,0,0]=4 1024 B33R3.225000773 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)CN)C#N 62a_100015188311_114873767334 [0,2,0,0,0,0|2,0,0]=4 1025 B33R3.225000773 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)OC)C#N 62a_100015188311_100011934654 [0,2,0,0,0,0|2,0,0]=4 1026 B33R3.225000774 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)C(=O)N)F 27a_200011998915_100015188311 [0,2,0,0,0,0|1,0,1]=4 1027 B33R3.225000774 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)C(C)C)Br 27a_100010369243_100015188311 [0,2,0,0,0,0|0,0,2]=4 1028 B33R3.225000774 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)[N+](=O)[O-])Br 27a_100000728782_100015188311 [0,2,0,0,0,0|2,0,0]=4 1029 B33R3.225000774 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)[N+](=O)[O-])C 27a_100011707342_100015188311 [0,2,0,0,0,0|2,0,0]=4 1030 B33R3.225000774 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)[N+](=O)[O-])Cl 27a_100012181248_100015188311 [0,2,0,0,0,0|2,0,0]=4 1031 B33R3.225000774 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)[N+](=O)[O-])F 27a_100000756922_100015188311 [0,2,0,0,0,0|2,0,0]=4 1032 B33R3.1677098700 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(c(c(c3)C#N)F)F 27a_100009986430_100015188311 [0,2,0,0,0,0|1,0,0]=3 1033 B33R3.1677098700 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(c(c(c3)OC)Cl)Br 27a_100010131419_100015188311 [0,2,0,0,0,0|1,0,1]=4 1034 B33R3.1677098700 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(c(c3)C#N)C)F 62a_100015188311_100015693266 [0,2,0,0,0,0|2,0,0]=4 1035 B33R3.1677098700 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(c(c3)C#N)F)C 62a_100015188311_200010873580 [0,2,0,0,0,0|2,0,0]=4 1036 B33R3.1677098700 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(c(c3)C#N)F)F 62a_100015188311_100010290105 [0,2,0,0,0,0|2,0,0]=4 1037 B33R3.1677098700 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(c(c3)C#N)N)C 62a_100015188311_100012771665 [0,2,0,0,0,0|2,0,0]=4 1038 B33R3.1677098700 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(c(c3)C#N)N)F 62a_100015188311_200012344957 [0,2,0,0,0,0|2,0,0]=4 1039 B33R3.1677098700 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(c(c3)C#N)O)C 62a_100015188311_100010195408 [0,2,0,0,0,0|2,0,0]=4 1040 B33R3.2705428053 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3F)F)C#N 62a_100015188311_100010259550 [0,2,0,0,0,0|2,0,0]=4 1041 B33R3.2705428053 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3N)C)C#N 62a_100015188311_100010208250 [0,2,0,0,0,0|2,0,0]=4 1042 B33R3.2705428053 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3N)Cl)C#N 62a_100015188311_200000050118 [0,2,0,0,0,0|2,0,0]=4 1043 B33R3.2705428053 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3N)F)C#N 62a_100015188311_100010187407 [0,2,0,0,0,0|2,0,0]=4 1044 B33R3.2705428053 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3N)N)C#N 62a_100015188311_100010589093 [0,2,0,0,0,0|2,0,0]=4 1045 B33R3.2705428053 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3O)O)C#N 62a_100015188311_100010672013 [0,2,0,0,0,0|2,0,0]=4 1046 B33R3.2705428054 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3C)C#N)C 27a_200000128225_100015188311 [0,2,0,0,0,0|1,0,0]=3 1047 B33R3.2705428054 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3F)C#N)C 62a_100015188311_200010161325 [0,2,0,0,0,0|2,0,0]=4 1048 B33R3.2705428054 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3F)C#N)F 62a_100015188311_200010988858 [0,2,0,0,0,0|2,0,0]=4 1049 B33R3.2705428054 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3N)C#N)Br 62a_100015188311_200010208226 [0,2,0,0,0,0|2,0,0]=4 1050 B33R3.2705428054 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3N)C#N)Br 62a_200010208226_100015188311 [0,2,0,0,0,0|2,0,0]=4 1051 B33R3.2705428054 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3N)C#N)F 62a_100015188311_100013085293 [0,2,0,0,0,0|2,0,0]=4 1052 B33R3.2705428054 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3O)C#N)F 62a_100015188311_100010674538 [0,2,0,0,0,0|2,0,0]=4 1053 B33R3.225008948 CNC(=O)c1cccc(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100000185133_100015188311 [0,2,0,0,0,0|0,0,2]=4 1054 B33R3.225008948 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C(=O)C#N 62a_100015188311_100010169886 [0,2,0,0,0,0|1,0,1]=4 1055 B33R3.225008949 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C(C)(C)C 27a_100000035496_100015188311 [0,2,0,0,0,0|0,0,2]=4 1056 B33R3.225008949 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C(C)(F)F 27a_100000709193_100015188311 [0,2,0,0,0,0|0,0,2]=4 1057 B33R3.225008949 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C(F)(F)F 27a_100000210057_100015188311 [0,2,0,0,0,0|1,0,1]=4 1058 B33R3.225008949 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)S(=O)(=O)C 27a_100000209861_100015188311 [0,2,0,0,0,0|1,0,1]=4 1059 B33R3.225008953 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)C(=O)N 27a_100000738810_100015188311 [0,2,0,0,0,0|1,0,1]=4 1060 B33R3.225008953 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)[N+](=O)[O-] 27a_100000211318_100015188311 [0,2,0,0,0,0|2,0,0]=4 1061 B33R3.225008953 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3Cl)[N+](=O)[O-] 27a_100000684894_100015188311 [0,2,0,0,0,0|2,0,0]=4 1062 B33R3.225008953 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3F)C(=O)N 27a_100014075672_100015188311 [0,2,0,0,0,0|1,0,1]=4 1063 B33R3.225008953 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3F)C(C)C 27a_100021981578_100015188311 [0,2,0,0,0,0|0,0,2]=4 1064 B33R3.225008953 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3F)[N+](=O)[O-] 27a_100000055607_100015188311 [0,2,0,0,0,0|2,0,0]=4 1065 B33R3.225008953 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3O)[N+](=O)[O-] 27a_100000079671_100015188311 [0,2,0,0,0,0|2,0,0]=4 1066 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C(=O)N)Br 27a_100015186447_100015188311 [0,2,0,0,0,0|1,0,1]=4 1067 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C(=O)N)C 27a_100000750465_100015188311 [0,2,0,0,0,0|1,0,1]=4 1068 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C(=O)N)F 27a_100000738046_100015188311 [0,2,0,0,0,0|1,0,1]=4 1069 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C(F)F)F 27a_100000048038_100015188311 [0,2,0,0,0,0|1,0,1]=4 1070 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)N(C)C)C 27a_100011708272_100015188311 [0,2,0,0,0,0|1,0,1]=4 1071 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)[N+](=O)[O-])C 27a_100000210030_100015188311 [0,2,0,0,0,0|2,0,0]=4 1072 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)[N+](=O)[O-])Cl 27a_100000209990_100015188311 [0,2,0,0,0,0|2,0,0]=4 1073 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)[N+](=O)[O-])F 27a_100000185763_100015188311 [0,2,0,0,0,0|2,0,0]=4 1074 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)[N+](=O)[O-])I 27a_100000049750_100015188311 [0,2,0,0,0,0|2,0,0]=4 1075 B33R3.225008955 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)[N+](=O)[O-])O 27a_100000032192_100015188311 [0,2,0,0,0,0|2,0,0]=4 1076 B33R3.225009165 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)C(F)F 27a_200016126983_100015188311 [0,2,0,0,0,0|1,0,1]=4 1077 B33R3.225009165 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)[N+](=O)[O-] 27a_102515432896_100015188311 [0,2,0,0,0,0|2,0,0]=4 1078 B33R3.1677109406 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)C(=O)N 27a_100000188646_100015188311 [0,2,0,0,0,0|1,0,1]=4 1079 B33R3.1677109406 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)C(C)C 27a_100011216979_100015188311 [0,2,0,0,0,0|0,0,2]=4 1080 B33R3.1677109406 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3Cl)C(=O)N 27a_100000736751_100015188311 [0,2,0,0,0,0|1,0,1]=4 1081 B33R3.1677109406 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)C(=O)N 27a_100000740466_100015188311 [0,2,0,0,0,0|1,0,1]=4 1082 B33R3.1677109406 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)C(F)F 27a_100010590353_100015188311 [0,2,0,0,0,0|1,0,1]=4 1083 B33R3.1677109406 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)[N+](=O)[O-] 27a_100000185768_100015188311 [0,2,0,0,0,0|2,0,0]=4 1084 B33R3.1677109406 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)C(C)C 27a_200000187366_100015188311 [0,2,0,0,0,0|0,0,2]=4 1085 B33R3.1677109406 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)[N+](=O)[O-] 27a_100000181223_100015188311 [0,2,0,0,0,0|2,0,0]=4 1086 B33R3.1677109375 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C#N)C#N 27a_200000123662_100015188311 [0,2,0,0,0,0|1,0,0]=3 1087 B33R3.1677109375 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C#N)OC 27a_100000092977_100015188311 [0,2,0,0,0,0|1,0,1]=4 1088 B33R3.1677109375 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3OC)C#N 27a_100000128487_100015188311 [0,2,0,0,0,0|1,0,0]=3 1089 B33R3.1677109375 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3OC)OC 27a_100011217386_100015188311 [0,2,0,0,0,0|1,0,1]=4 1090 B33R3.1677109375 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C#N)C#N 62a_100015188311_200009889540 [0,2,0,0,0,0|2,0,0]=4 1091 B33R3.1677109375 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3OC)C#N 62a_100015188311_100009817008 [0,2,0,0,0,0|2,0,0]=4 1092 B33R3.1677109376 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)CC#N 62a_100010147028_100015188311 [0,2,0,0,0,0|1,0,1]=4 1093 B33R3.1677109376 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3C)CC#N 62a_100015188311_100010147028 [0,2,0,0,0,0|1,0,1]=4 1094 B33R3.1677109376 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)CC#N 62a_100009817020_100015188311 [0,2,0,0,0,0|1,0,1]=4 1095 B33R3.1677109376 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3F)CC#N 62a_100015188311_100009817020 [0,2,0,0,0,0|1,0,1]=4 1096 B33R3.1677109418 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3F)C#N)C 62a_100015188311_100015641138 [0,2,0,0,0,0|2,0,0]=4 1097 B33R3.1677109418 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3F)C#N)F 62a_100010080413_100015188311 [0,2,0,0,0,0|2,0,0]=4 1098 B33R3.1677109418 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3F)C#N)F 62a_100015188311_100000062002 [0,2,0,0,0,0|2,0,0]=4 1099 B33R3.1677109418 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3F)C#N)N 62a_100015188311_100010169826 [0,2,0,0,0,0|2,0,0]=4 1100 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3c(ccc(c3C)OC)C 27a_100000089760_100015188311 [0,2,0,0,0,0|1,0,1]=4 1101 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3c(ccc(c3Cl)OC)Cl 27a_100009956855_100015188311 [0,2,0,0,0,0|1,0,1]=4 1102 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3c(ccc(c3Cl)OC)F 27a_100000061512_100015188311 [0,2,0,0,0,0|1,0,1]=4 1103 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3c(ccc(c3F)OC)Cl 27a_100000061519_100015188311 [0,2,0,0,0,0|1,0,1]=4 1104 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3c(ccc(c3F)OC)F 27a_200000062051_100015188311 [0,2,0,0,0,0|1,0,1]=4 1105 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3c(ccc(c3F)C#N)F 62a_100015188311_200000117298 [0,2,0,0,0,0|2,0,0]=4 1106 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3c(ccc(c3F)C#N)N 62a_100015188311_100020669540 [0,2,0,0,0,0|2,0,0]=4 1107 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3c(ccc(c3N)C#N)F 62a_100015188311_100010128265 [0,2,0,0,0,0|2,0,0]=4 1108 B33R3.2705428041 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3c(ccc(c3O)C#N)F 62a_100015188311_100010128267 [0,2,0,0,0,0|2,0,0]=4 1109 B33R3.225008951 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)CC(=O)N 27a_200011690101_100015188311 [0,2,0,0,0,0|0,0,2]=4 1110 B33R3.225008951 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)CN(C)C 27a_100000738294_100015188311 [0,2,0,0,0,0|0,0,2]=4 1111 B33R3.225008951 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)NC(=O)C 27a_100000749408_100015188311 [0,2,0,0,0,0|0,0,2]=4 1112 B33R3.225008951 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)NC(=O)N 27a_100000736001_100015188311 [0,2,0,0,0,0|1,0,1]=4 1113 B33R3.225008951 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)OC(C)C 27a_100011194262_100015188311 [0,2,0,0,0,0|0,0,2]=4 1114 B33R3.225008951 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)OC(F)F 27a_100000217533_100015188311 [0,2,0,0,0,0|1,0,1]=4 1115 B33R3.225008952 CCCCc1cccc(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_200012017287_100015188311 [0,2,0,0,0,0|0,0,2]=4 1116 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)CCCO 27a_200000698965_100015188311 [0,2,0,0,0,0|0,0,2]=4 1117 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)OCC#N 27a_100000739570_100015188311 [0,2,0,0,0,0|0,0,1]=3 1118 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)OCCO 27a_100011232151_100015188311 [0,2,0,0,0,0|0,0,2]=4 1119 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)OCOC 27a_100012265470_100015188311 [0,2,0,0,0,0|0,0,2]=4 1120 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C#CCO 62a_100009814051_100015188311 [0,2,0,0,0,0|1,0,0]=3 1121 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)C#CCO 62a_100015188311_100009814051 [0,2,0,0,0,0|1,0,0]=3 1122 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CCC#N 62a_100011219771_100015188311 [0,2,0,0,0,0|1,0,1]=4 1123 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CCC#N 62a_100015188311_100011219771 [0,2,0,0,0,0|1,0,1]=4 1124 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CSC#N 62a_100015188311_200010199461 [0,2,0,0,0,0|1,0,1]=4 1125 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)CSC#N 62a_200010199461_100015188311 [0,2,0,0,0,0|1,0,1]=4 1126 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)OCC#N 62a_100015188311_200000169433 [0,2,0,0,0,0|1,0,1]=4 1127 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)OCC#N 62a_200000169433_100015188311 [0,2,0,0,0,0|1,0,1]=4 1128 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)SCC#N 62a_100015188311_200011756096 [0,2,0,0,0,0|1,0,1]=4 1129 B33R3.225008952 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3)SCC#N 62a_200011756096_100015188311 [0,2,0,0,0,0|1,0,1]=4 1130 B33R3.1677109421 CCOc1cc(ccc1Br)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_200016990551_100015188311 [0,2,0,0,0,0|0,0,2]=4 1131 B33R3.1677109421 CCOc1cc(ccc1Cl)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100011964961_100015188311 [0,2,0,0,0,0|0,0,2]=4 1132 B33R3.1677109421 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CC#N)Br 62a_100010146707_100015188311 [0,2,0,0,0,0|1,0,1]=4 1133 B33R3.1677109421 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CC#N)Br 62a_100015188311_100010146707 [0,2,0,0,0,0|1,0,1]=4 1134 B33R3.1677109421 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CC#N)C 62a_100010147029_100015188311 [0,2,0,0,0,0|1,0,1]=4 1135 B33R3.1677109421 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CC#N)C 62a_100015188311_100010147029 [0,2,0,0,0,0|1,0,1]=4 1136 B33R3.1677109421 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CC#N)F 62a_100000739769_100015188311 [0,2,0,0,0,0|1,0,1]=4 1137 B33R3.1677109421 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CC#N)F 62a_100015188311_100000739769 [0,2,0,0,0,0|1,0,1]=4 1138 B33R3.1677109421 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CC#N)N 62a_100010188562_100015188311 [0,2,0,0,0,0|1,0,1]=4 1139 B33R3.1677109421 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)CC#N)N 62a_100015188311_100010188562 [0,2,0,0,0,0|1,0,1]=4 1140 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3Br)COC 27a_200013033220_100015188311 [0,2,0,0,0,0|0,0,2]=4 1141 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)CC#N 62a_100000742998_100015188311 [0,2,0,0,0,0|1,0,1]=4 1142 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)CC#N 62a_100015188311_100000742998 [0,2,0,0,0,0|1,0,1]=4 1143 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)SC#N 62a_100015188311_100025703566 [0,2,0,0,0,0|2,0,0]=4 1144 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3F)SC#N 62a_100025703566_100015188311 [0,2,0,0,0,0|2,0,0]=4 1145 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)CC#N 62a_100010188563_100015188311 [0,2,0,0,0,0|1,0,1]=4 1146 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)CC#N 62a_100015188311_100010188563 [0,2,0,0,0,0|1,0,1]=4 1147 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)SC#N 62a_100000683425_100015188311 [0,2,0,0,0,0|2,0,0]=4 1148 B33R3.2705428038 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3N)SC#N 62a_100015188311_100000683425 [0,2,0,0,0,0|2,0,0]=4 1149 B33R3.225009170 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3ccc(c(c3)OC)F 27a_200012002703_100015188311 [0,2,0,0,0,0|1,0,1]=4 1150 B33R3.1677109422 CNc1ccc(cc1C#N)Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC 62a_100015188311_100013037436 [0,2,0,0,0,0|2,0,0]=4 1151 B33R3.1677109422 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C#N)C#N 27a_100000758296_100015188311 [0,2,0,0,0,0|1,0,0]=3 1152 B33R3.1677109422 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C#N)OC 27a_100011204338_100015188311 [0,2,0,0,0,0|1,0,0]=3 1153 B33R3.1677109422 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)C#N 27a_100011999456_100015188311 [0,2,0,0,0,0|1,0,1]=4 1154 B33R3.1677109422 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)CO 27a_100012183141_100015188311 [0,2,0,0,0,0|1,0,1]=4 1155 B33R3.1677109422 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)OC)OC 27a_100000187404_100015188311 [0,2,0,0,0,0|1,0,1]=4 1156 B33R3.1677109422 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)C#N 62a_100015188311_100000016123 [0,2,0,0,0,0|2,0,0]=4 1157 B33R3.1677109422 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)C=O 62a_100015188311_100012001787 [0,2,0,0,0,0|2,0,0]=4 1158 B33R3.1677109422 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)C#N)OC 62a_100015188311_100000188252 [0,2,0,0,0,0|2,0,0]=4 1159 B33R3.2705422105 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(c(cc3C)C)C#N 27a_100012023469_100015188311 [0,2,0,0,0,0|1,0,0]=3 1160 B33R3.2705422105 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(c(cc3C)F)C#N 27a_100014259206_100015188311 [0,2,0,0,0,0|1,0,0]=3 1161 B33R3.2705422105 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(cc3C)F)C#N 62a_100015188311_100010159637 [0,2,0,0,0,0|2,0,0]=4 1162 B33R3.2705422105 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(cc3F)F)C#N 62a_100015188311_100000084146 [0,2,0,0,0,0|2,0,0]=4 1163 B33R3.2705422105 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(cc3F)N)C#N 62a_100015188311_100010741936 [0,2,0,0,0,0|2,0,0]=4 1164 B33R3.2705422105 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(cc3N)F)C#N 62a_100015188311_200015809822 [0,2,0,0,0,0|2,0,0]=4 1165 B33R3.2705422105 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(c(cc3O)F)C#N 62a_100015188311_100011015635 [0,2,0,0,0,0|2,0,0]=4 1166 B33R3.1677098707 C#Cc1cccc(c1)N(CC)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100000751626_100015188311 [0,2,0,0,0,0|0,0,0]=2 1167 B33R3.1677098707 CCN(c1cccc(c1)OC)c2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100000219733_100015188311 [0,2,0,0,0,0|1,0,1]=4 1168 B33R3.2705428037 CCc1ccc(c(c1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC)OC 27a_100012035449_100015188311 [0,2,0,0,0,0|0,0,2]=4 1169 B33R3.2705428037 CNc1ccc(cc1Sc2ncnc3c2cc(c(c3)OCCOC)OCCOC)C#N 62a_100015188311_200020994358 [0,2,0,0,0,0|2,0,0]=4 1170 B33R3.2705428037 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C#N)OC 27a_100000687564_100015188311 [0,2,0,0,0,0|1,0,1]=4 1171 B33R3.2705428037 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3CO)OC 27a_100011998734_100015188311 [0,2,0,0,0,0|1,0,1]=4 1172 B33R3.2705428037 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3OC)CO 27a_100011269841_100015188311 [0,2,0,0,0,0|1,0,1]=4 1173 B33R3.2705428037 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3OC)OC 27a_100000184736_100015188311 [0,2,0,0,0,0|1,0,1]=4 1174 B33R3.2705428037 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3C=O)C#N 62a_100015188311_100012355658 [0,2,0,0,0,0|2,0,0]=4 1175 B33R3.2705428037 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3CN)C#N 62a_100015188311_114948178924 [0,2,0,0,0,0|2,0,0]=4 1176 B33R3.2705428037 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3CO)C#N 62a_100015188311_100010214422 [0,2,0,0,0,0|2,0,0]=4 1177 B33R3.2705428037 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3OC)C#N 62a_100015188311_100000188253 [0,2,0,0,0,0|2,0,0]=4 1178 B31R4.174069871 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc4c(c3)CC4 271570a_100160486115_100015188311 [0,0,0,1,1,0|0,0,2]=4 1179 B33R4.1094932208 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3)C4CC4 27a_100025755985_100015188311 [0,1,0,1,0,0|0,0,2]=4 1180 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3CCC4 27a_100000043548_100015188311 [0,1,0,1,0,0|0,0,2]=4 1181 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3CCO4 27a_100000084147_100015188311 [0,1,0,1,0,0|0,0,2]=4 1182 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3COC4 27a_100000125316_100015188311 [0,1,0,1,0,0|0,0,2]=4 1183 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3OCC4 27a_100000102157_100015188311 [0,1,0,1,0,0|0,0,2]=4 1184 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3OCO4 27a_100000699912_100015188311 [0,1,0,1,0,0|1,0,1]=4 1185 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3[nH]nn4 27a_100000022823_100015188311 [0,1,0,1,0,0|2,0,0]=4 1186 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3ccs4 27a_100020628958_100015188311 [0,1,0,1,0,0|0,0,2]=4 1187 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3cn[nH]4 27a_100000046203_100015188311 [0,1,0,1,0,0|1,0,1]=4 1188 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3ncs4 27a_100000046379_100015188311 [0,1,0,1,0,0|1,0,1]=4 1189 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3non4 27a_100000028140_100015188311 [0,1,0,1,0,0|2,0,0]=4 1190 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3nsn4 27a_100000013547_100015188311 [0,1,0,1,0,0|2,0,0]=4 1191 B33R4.1094932204 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc4c3scn4 27a_100000099145_100015188311 [0,1,0,1,0,0|1,0,1]=4 1192 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4[nH]ccc4c3 27a_100011201678_100015188311 [0,1,0,1,0,0|0,0,2]=4 1193 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4[nH]cnc4c3 27a_100000185997_100015188311 [0,1,0,1,0,0|1,0,1]=4 1194 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4[nH]ncc4c3 27a_100000187683_100015188311 [0,1,0,1,0,0|1,0,1]=4 1195 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4[nH]nnc4c3 27a_100000747742_100015188311 [0,1,0,1,0,0|2,0,0]=4 1196 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4c(c3)CCC4 27a_100000211504_100015188311 [0,1,0,1,0,0|0,0,2]=4 1197 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4c(c3)CCO4 27a_100000736984_100015188311 [0,1,0,1,0,0|0,0,2]=4 1198 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4c(c3)COC4 27a_100011728444_100015188311 [0,1,0,1,0,0|0,0,2]=4 1199 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4c(c3)OCO4 27a_100000209953_100015188311 [0,1,0,1,0,0|1,0,1]=4 1200 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4cc[nH]c4c3 27a_100000743810_100015188311 [0,1,0,1,0,0|0,0,2]=4 1201 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4ccoc4c3 27a_100000102395_100015188311 [0,1,0,1,0,0|0,0,2]=4 1202 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4ncsc4c3 27a_100011215093_100015188311 [0,1,0,1,0,0|1,0,1]=4 1203 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4nnsc4c3 27a_100009955171_100015188311 [0,1,0,1,0,0|2,0,0]=4 1204 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4nsnc4c3 27a_100000042151_100015188311 [0,1,0,1,0,0|2,0,0]=4 1205 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4occc4c3 27a_106430523501_100015188311 [0,1,0,1,0,0|0,0,2]=4 1206 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4sccc4c3 27a_100000681076_100015188311 [0,1,0,1,0,0|0,0,2]=4 1207 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4scnc4c3 27a_100000047738_100015188311 [0,1,0,1,0,0|1,0,1]=4 1208 B33R4.151133064 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc4sncc4c3 27a_100000077742_100015188311 [0,1,0,1,0,0|1,0,1]=4 1209 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccn3)C 271570a_100000049243_100015188311 [1,0,0,0,1,0|1,0,1]=4 1210 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccn3)F 271570a_200000087102_100015188311 [1,0,0,0,1,0|2,0,0]=4 1211 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)C 271570a_100000749446_100015188311 [1,0,0,0,1,0|0,0,1]=3 1212 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)Cl 271570a_100011214927_100015188311 [1,0,0,0,1,0|1,0,0]=3 1213 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)F 271570a_100012349223_100015188311 [1,0,0,0,1,0|1,0,0]=3 1214 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)I 271570a_100000043368_100015188311 [1,0,0,0,1,0|1,0,0]=3 1215 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)N 271570a_100000699968_100015188311 [1,0,0,0,1,0|1,0,0]=3 1216 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(c3)O 271570a_100000693801_100015188311 [1,0,0,0,1,0|1,0,0]=3 1217 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(n3)C 271570a_100000046275_100015188311 [1,0,0,0,1,0|1,0,1]=4 1218 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(n3)Cl 271570a_100000062326_100015188311 [1,0,0,0,1,0|2,0,0]=4 1219 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(n3)F 271570a_100000090185_100015188311 [1,0,0,0,1,0|2,0,0]=4 1220 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cccc(n3)O 271570a_100010195584_100015188311 [1,0,0,0,1,0|2,0,0]=4 1221 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccnc(c3)C 271570a_100011830414_100015188311 [1,0,0,0,1,0|1,0,1]=4 1222 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccnc(c3)Cl 271570a_100000049459_100015188311 [1,0,0,0,1,0|2,0,0]=4 1223 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccnc(c3)F 271570a_100000062321_100015188311 [1,0,0,0,1,0|2,0,0]=4 1224 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccnc(c3)N 271570a_102125402725_100015188311 [1,0,0,0,1,0|2,0,0]=4 1225 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccnc(c3)O 271570a_100010237957_100015188311 [1,0,0,0,1,0|2,0,0]=4 1226 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)Br 271570a_200009814628_100015188311 [1,0,0,0,1,0|2,0,0]=4 1227 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)C 271570a_100012355712_100015188311 [1,0,0,0,1,0|1,0,1]=4 1228 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)Cl 271570a_100000049213_100015188311 [1,0,0,0,1,0|2,0,0]=4 1229 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)F 271570a_100000757375_100015188311 [1,0,0,0,1,0|2,0,0]=4 1230 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)N 271570a_100000069896_100015188311 [1,0,0,0,1,0|2,0,0]=4 1231 B29R3.1374155356 COCCOc1cc2ncnc(c2cc1OCCOC)c3cncc(c3)O 271570a_100010248756_100015188311 [1,0,0,0,1,0|2,0,0]=4 1232 B29R3.1374155362 COCCOc1cc2ncnc(c2cc1OCCOC)c3ccc(s3)C#N 271570a_100000035585_100015188311 [0,0,0,0,2,0|2,0,0]=4 1233 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)C=Cc3cccc(c3)C 271570a_200135466880_100015188311 [1,0,0,0,0,1|1,0,1]=4 1234 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)C=Cc3cccc(c3)Cl 271570a_100102525933_100015188311 [1,0,0,0,0,1|2,0,0]=4 1235 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)C=Cc3cccc(c3)F 271570a_100102525537_100015188311 [1,0,0,0,0,1|2,0,0]=4 1236 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(ccn3)Br 27a_100009818019_100015188311 [1,0,0,0,0,1|2,0,0]=4 1237 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(ccn3)C 27a_100011934573_100015188311 [1,0,0,0,0,1|1,0,1]=4 1238 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cc(ccn3)Cl 27a_100000085674_100015188311 [1,0,0,0,0,1|2,0,0]=4 1239 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)Br 27a_100000174977_100015188311 [1,0,0,0,0,1|1,0,0]=3 1240 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)C 27a_100000185548_100015188311 [1,0,0,0,0,1|0,0,1]=3 1241 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)Cl 27a_100000174878_100015188311 [1,0,0,0,0,1|1,0,0]=3 1242 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)F 27a_100000174948_100015188311 [1,0,0,0,0,1|1,0,0]=3 1243 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)I 27a_100000106179_100015188311 [1,0,0,0,0,1|1,0,0]=3 1244 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)O 27a_100000743036_100015188311 [1,0,0,0,0,1|1,0,0]=3 1245 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(n3)Br 27a_100016987751_100015188311 [1,0,0,0,0,1|2,0,0]=4 1246 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(n3)C 27a_100000701342_100015188311 [1,0,0,0,0,1|1,0,1]=4 1247 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(n3)Cl 27a_100016990191_100015188311 [1,0,0,0,0,1|2,0,0]=4 1248 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(n3)F 27a_100015188798_100015188311 [1,0,0,0,0,1|2,0,0]=4 1249 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccnc(c3)Br 27a_100025757509_100015188311 [1,0,0,0,0,1|2,0,0]=4 1250 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccnc(c3)C 27a_100011934566_100015188311 [1,0,0,0,0,1|1,0,1]=4 1251 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccnc(c3)Cl 27a_100015205668_100015188311 [1,0,0,0,0,1|2,0,0]=4 1252 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccnc(c3)F 27a_100015188774_100015188311 [1,0,0,0,0,1|2,0,0]=4 1253 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3ccnc(c3)O 27a_100000748557_100015188311 [1,0,0,0,0,1|2,0,0]=4 1254 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cncc(c3)Br 27a_100011249555_100015188311 [1,0,0,0,0,1|2,0,0]=4 1255 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cncc(c3)C 27a_100000692839_100015188311 [1,0,0,0,0,1|1,0,1]=4 1256 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cncc(c3)Cl 27a_200020614424_100015188311 [1,0,0,0,0,1|2,0,0]=4 1257 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cncc(c3)F 27a_100011962886_100015188311 [1,0,0,0,0,1|2,0,0]=4 1258 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)Br 62a_100000211773_100015188311 [1,0,0,0,0,1|2,0,0]=4 1259 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)Br 62a_100015188311_100000211773 [1,0,0,0,0,1|2,0,0]=4 1260 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)C 62a_100000211840_100015188311 [1,0,0,0,0,1|1,0,1]=4 1261 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)C 62a_100015188311_100000211840 [1,0,0,0,0,1|1,0,1]=4 1262 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)Cl 62a_100000187163_100015188311 [1,0,0,0,0,1|2,0,0]=4 1263 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)Cl 62a_100015188311_100000187163 [1,0,0,0,0,1|2,0,0]=4 1264 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)F 62a_100000230114_100015188311 [1,0,0,0,0,1|2,0,0]=4 1265 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)F 62a_100015188311_100000230114 [1,0,0,0,0,1|2,0,0]=4 1266 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)I 62a_100011218688_100015188311 [1,0,0,0,0,1|2,0,0]=4 1267 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)I 62a_100015188311_100011218688 [1,0,0,0,0,1|2,0,0]=4 1268 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)O 62a_100011660834_100015188311 [1,0,0,0,0,1|2,0,0]=4 1269 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)O 62a_100015188311_100011660834 [1,0,0,0,0,1|2,0,0]=4 1270 B31R3.1432153254 C#Cc1ccc(cc1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100011215031_100015188311 [0,0,0,0,1,1|0,0,0]=2 1271 B31R3.1432153254 C=Cc1ccc(cc1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100011218248_100015188311 [0,0,0,0,1,1|0,0,2]=4 1272 B31R3.1432153254 CCc1ccc(cc1)Nc2ncnc3c2cc(c(c3)OCCOC)OCCOC 27a_100000211069_100015188311 [0,0,0,0,1,1|0,0,2]=4 1273 B31R3.1432153254 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(cc3)CO 27a_100011215238_100015188311 [0,0,0,0,1,1|1,0,1]=4 1274 B31R3.1432153254 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(cc3)OC 27a_100000184247_100015188311 [0,0,0,0,1,1|1,0,1]=4 1275 B31R3.1432153254 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(cc3)SC 27a_100000212337_100015188311 [0,0,0,0,1,1|1,0,1]=4 1276 B31R3.1432153254 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(cc3)C#N 62a_100015188311_100000184291 [0,0,0,0,1,1|2,0,0]=4 1277 B31R3.1432153254 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(cn3)C#N 62a_100015188311_100000241038 [0,0,0,0,1,1|2,0,0]=4 1278 B31R3.1432153254 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(nc3)C#N 62a_100015188311_100000760455 [0,0,0,0,1,1|2,0,0]=4 1279 B33R3.225009979 COCCOc1cc2ncnc(c2cc1OCCOC)NCCc3cccc(c3)OC 27a_100000740386_100015188311 [0,0,0,0,0,2|1,0,1]=4