0 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)NN 62a_100000089018_100015188311 [0,0,0,0,0,0|4,0,0]=4 1 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccn3)NN 62a_100015188311_100000089018 [0,0,0,0,0,0|4,0,0]=4 2 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ncn3)C#N 62a_100015188311_100000092509 [0,0,0,0,0,0|4,0,0]=4 3 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)NN 62a_100009817029_100015188311 [0,0,0,0,0,0|4,0,0]=4 4 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(n3)NN 62a_100015188311_100009817029 [0,0,0,0,0,0|4,0,0]=4 5 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)NN 62a_100000764631_100015188311 [0,0,0,0,0,0|4,0,0]=4 6 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(c3)NN 62a_100015188311_100000764631 [0,0,0,0,0,0|4,0,0]=4 7 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccnc(n3)C#N 62a_100015188311_100000092507 [0,0,0,0,0,0|4,0,0]=4 8 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)NN 62a_100000727789_100015188311 [0,0,0,0,0,0|4,0,0]=4 9 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(c3)NN 62a_100015188311_100000727789 [0,0,0,0,0,0|4,0,0]=4 10 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cncc(n3)C#N 62a_100015188311_100009817212 [0,0,0,0,0,0|4,0,0]=4 11 B31R3.1432153258 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3nccc(n3)C#N 62a_100015188311_100000066186 [0,0,0,0,0,0|4,0,0]=4 12 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)Br)Br 27a_100012047176_100015188311 [1,1,0,0,0,0|1,0,0]=3 13 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)I)Br 27a_100009814763_100015188311 [1,1,0,0,0,0|1,0,0]=3 14 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)I)Cl 27a_100010147676_100015188311 [1,1,0,0,0,0|1,0,0]=3 15 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)I)F 27a_100011356972_100015188311 [1,1,0,0,0,0|1,0,0]=3 16 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(cc(c3)I)I 27a_200000696836_100015188311 [1,1,0,0,0,0|1,0,0]=3 17 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)Br 62a_100009814770_100015188311 [1,1,0,0,0,0|2,0,0]=4 18 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)Br 62a_100015188311_100009814770 [1,1,0,0,0,0|2,0,0]=4 19 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)Cl 62a_100009814755_100015188311 [1,1,0,0,0,0|2,0,0]=4 20 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Br)Cl 62a_100015188311_100009814755 [1,1,0,0,0,0|2,0,0]=4 21 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)Cl 62a_100000747138_100015188311 [1,1,0,0,0,0|2,0,0]=4 22 B31R3.1432135904 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(cc(c3)Cl)Cl 62a_100015188311_100000747138 [1,1,0,0,0,0|2,0,0]=4 23 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3C)I 27a_100000761887_100015188311 [1,1,0,0,0,0|1,0,0]=3 24 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)Br 27a_100020590159_100015188311 [1,1,0,0,0,0|1,0,0]=3 25 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)C 27a_100000761888_100015188311 [1,1,0,0,0,0|0,0,1]=3 26 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)Cl 27a_100000049713_100015188311 [1,1,0,0,0,0|1,0,0]=3 27 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3I)F 27a_100000690935_100015188311 [1,1,0,0,0,0|1,0,0]=3 28 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cccc(c3O)I 27a_100010084371_100015188311 [1,1,0,0,0,0|1,0,0]=3 29 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)Br 62a_100010175083_100015188311 [1,1,0,0,0,0|2,0,0]=4 30 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)Br 62a_100015188311_100010175083 [1,1,0,0,0,0|2,0,0]=4 31 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)Cl 62a_100014021842_100015188311 [1,1,0,0,0,0|2,0,0]=4 32 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Br)Cl 62a_100015188311_100014021842 [1,1,0,0,0,0|2,0,0]=4 33 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)Br 62a_100010142854_100015188311 [1,1,0,0,0,0|2,0,0]=4 34 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)Br 62a_100015188311_100010142854 [1,1,0,0,0,0|2,0,0]=4 35 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)Cl 62a_100011215384_100015188311 [1,1,0,0,0,0|2,0,0]=4 36 B31R3.1432153256 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cccc(c3Cl)Cl 62a_100015188311_100011215384 [1,1,0,0,0,0|2,0,0]=4 37 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Br)Br 27a_100011306057_100015188311 [1,1,0,0,0,0|1,0,0]=3 38 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Br)I 27a_100000750458_100015188311 [1,1,0,0,0,0|1,0,0]=3 39 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)C)I 27a_100000198070_100015188311 [1,1,0,0,0,0|0,0,1]=3 40 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)Cl)I 27a_100000761885_100015188311 [1,1,0,0,0,0|1,0,0]=3 41 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)F)I 27a_100011356925_100015188311 [1,1,0,0,0,0|1,0,0]=3 42 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)I)Br 27a_100000750459_100015188311 [1,1,0,0,0,0|1,0,0]=3 43 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)I)C 27a_100000184131_100015188311 [1,1,0,0,0,0|1,0,0]=3 44 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)I)Cl 27a_100012360549_100015188311 [1,1,0,0,0,0|1,0,0]=3 45 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3ccc(c(c3)I)F 27a_114828291077_100015188311 [1,1,0,0,0,0|1,0,0]=3 46 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)Br 62a_100012356285_100015188311 [1,1,0,0,0,0|2,0,0]=4 47 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)Br 62a_100015188311_100012356285 [1,1,0,0,0,0|2,0,0]=4 48 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)Cl 62a_100012353702_100015188311 [1,1,0,0,0,0|2,0,0]=4 49 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Br)Cl 62a_100015188311_100012353702 [1,1,0,0,0,0|2,0,0]=4 50 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)Br 62a_100012047281_100015188311 [1,1,0,0,0,0|2,0,0]=4 51 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)Br 62a_100015188311_100012047281 [1,1,0,0,0,0|2,0,0]=4 52 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)Cl 62a_100011214914_100015188311 [1,1,0,0,0,0|2,0,0]=4 53 B31R3.1432153259 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3ccc(c(c3)Cl)Cl 62a_100015188311_100011214914 [1,1,0,0,0,0|2,0,0]=4 54 B31R3.1432153445 COCCOc1cc2ncnc(c2cc1OCCOC)N(C)c3cccc(c3)I 27a_100000221217_100015188311 [1,1,0,0,0,0|1,0,0]=3 55 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3C)I 27a_100000761890_100015188311 [1,1,0,0,0,0|1,0,0]=3 56 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3F)I 27a_100011464823_100015188311 [1,1,0,0,0,0|1,0,0]=3 57 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3I)C 27a_100011216686_100015188311 [1,1,0,0,0,0|0,0,1]=3 58 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Nc3cc(ccc3O)I 27a_100000753495_100015188311 [1,1,0,0,0,0|1,0,0]=3 59 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)Br 62a_100011483371_100015188311 [1,1,0,0,0,0|2,0,0]=4 60 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)Br 62a_100015188311_100011483371 [1,1,0,0,0,0|2,0,0]=4 61 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)Cl 62a_100012339723_100015188311 [1,1,0,0,0,0|2,0,0]=4 62 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Br)Cl 62a_100015188311_100012339723 [1,1,0,0,0,0|2,0,0]=4 63 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)Br 62a_100011772130_100015188311 [1,1,0,0,0,0|2,0,0]=4 64 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)Br 62a_100015188311_100011772130 [1,1,0,0,0,0|2,0,0]=4 65 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)Cl 62a_100000707729_100015188311 [1,1,0,0,0,0|2,0,0]=4 66 B31R3.2635642795 COCCOc1cc2ncnc(c2cc1OCCOC)Sc3cc(ccc3Cl)Cl 62a_100015188311_100000707729 [1,1,0,0,0,0|2,0,0]=4 67 B31R3.2635618327 COCCOc1cc2ncnc(c2cc1OCCOC)c3cc(ccc3I)OC 271570a_100010977408_100015188311 [0,1,0,0,1,0|1,0,1]=4 68 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)NCc3cccc(c3)I 27a_100000106179_100015188311 [1,0,0,0,0,1|1,0,0]=3 69 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)I 62a_100011218688_100015188311 [1,0,0,0,0,1|2,0,0]=4 70 B31R3.1432154936 COCCOc1cc2ncnc(c2cc1OCCOC)SCc3cccc(c3)I 62a_100015188311_100011218688 [1,0,0,0,0,1|2,0,0]=4