0 B28R3.824389970 CCCN(C/C=C/c1ccccc1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_100020603570_100000185366 [0,0,1,0,0,0|0,0,0]=1 1 B28R3.824389970 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)N(C/C=C/c3ccccc3)CCO 27a_100020603566_100000185366 [0,0,1,0,0,0|1,0,0]=2 2 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNC/C=C/c3ccccc3)n(c1=O)C 2230a_100020603302_100020672187 [0,0,1,0,0,0|0,0,0]=1 3 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNC/C=C/c3ccccc3)n(c1=O)C 34a_100020603302_100020672187 [0,0,1,0,0,0|0,0,0]=1 4 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCC#Cc3ccccc3)n(c1=O)C 34a_100000735379_100020672187 [0,0,1,0,0,0|0,0,2]=3 5 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCCc3ccccc3)n(c1=O)C 2230a_100000211184_100020672187 [0,0,1,0,0,0|0,0,2]=3 6 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCCc3ccccc3)n(c1=O)C 34a_100000211184_100020672187 [0,0,1,0,0,0|0,0,2]=3 7 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCCc3cccnc3)n(c1=O)C 2230a_100011532358_100020672187 [0,0,1,0,0,0|1,0,2]=4 8 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCCc3cccnc3)n(c1=O)C 34a_100011532358_100020672187 [0,0,1,0,0,0|1,0,2]=4 9 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCCc3ccncc3)n(c1=O)C 2230a_100011275580_100020672187 [0,0,1,0,0,0|1,0,2]=4 10 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccc3)n(c1=O)C 2230a_100000174943_100020672187 [0,0,1,0,0,0|1,0,1]=3 11 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccc3)n(c1=O)C 34a_100000174943_100020672187 [0,0,1,0,0,0|1,0,1]=3 12 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccn3)n(c1=O)C 2230a_106741647558_100020672187 [0,0,1,0,0,0|2,0,1]=4 13 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCOc3cccnc3)n(c1=O)C 2230a_100000754688_100020672187 [0,0,1,0,0,0|2,0,1]=4 14 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCNCCSc3ccccc3)n(c1=O)C 2230a_100000189519_100020672187 [0,0,1,0,0,0|1,0,1]=3 15 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOC/C=C/c3ccccc3)n(c1=O)C 34a_100000210256_100020672187 [0,0,1,0,0,0|1,0,0]=2 16 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOC/C=C/c3cccnc3)n(c1=O)C 34a_200102594124_100020672187 [0,0,1,0,0,0|2,0,0]=3 17 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOCC#Cc3ccccc3)n(c1=O)C 34a_100011217464_100020672187 [0,0,1,0,0,0|1,0,2]=4 18 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOCC#Cc3ccccc3)n(c1=O)C 7a_100011217464_100020672187 [0,0,1,0,0,0|1,0,2]=4 19 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOCCCc3ccccc3)n(c1=O)C 34a_100000210828_100020672187 [0,0,1,0,0,0|1,0,2]=4 20 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOCCCc3ccccc3)n(c1=O)C 7a_100000210828_100020672187 [0,0,1,0,0,0|1,0,2]=4 21 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOCCNc3ccccc3)n(c1=O)C 34a_100000211345_100020672187 [0,0,1,0,0,0|2,0,1]=4 22 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOCCOc3ccccc3)n(c1=O)C 34a_100000210260_100020672187 [0,0,1,0,0,0|2,0,1]=4 23 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOCCOc3ccccc3)n(c1=O)C 7a_100000210260_100020672187 [0,0,1,0,0,0|2,0,1]=4 24 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCOCCSc3ccccc3)n(c1=O)C 7a_100000230494_100020672187 [0,0,1,0,0,0|2,0,1]=4 25 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSC/C=C/c3ccccc3)n(c1=O)C 62a_100016265936_100020672187 [0,0,1,0,0,0|1,0,0]=2 26 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSC/C=C/c3ccccc3)n(c1=O)C 62a_100020672187_100016265936 [0,0,1,0,0,0|1,0,0]=2 27 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCC#Cc3ccccc3)n(c1=O)C 62a_100020672187_100011352542 [0,0,1,0,0,0|1,0,2]=4 28 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCCCc3ccccc3)n(c1=O)C 62a_100000211621_100020672187 [0,0,1,0,0,0|1,0,2]=4 29 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCCCc3ccccc3)n(c1=O)C 62a_100020672187_100000211621 [0,0,1,0,0,0|1,0,2]=4 30 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCCOc3ccccc3)n(c1=O)C 62a_100000184471_100020672187 [0,0,1,0,0,0|2,0,1]=4 31 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCCOc3ccccc3)n(c1=O)C 62a_100020672187_100000184471 [0,0,1,0,0,0|2,0,1]=4 32 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCCSc3ccccc3)n(c1=O)C 62a_100000246102_100020672187 [0,0,1,0,0,0|2,0,1]=4 33 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCCSc3ccccc3)n(c1=O)C 62a_100020672187_100000246102 [0,0,1,0,0,0|2,0,1]=4 34 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCOCc3ccccc3)n(c1=O)C 62a_100000763385_100020672187 [0,0,1,0,0,0|2,0,1]=4 35 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCOCc3ccccc3)n(c1=O)C 62a_100020672187_100000763385 [0,0,1,0,0,0|2,0,1]=4 36 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCSCc3ccccc3)n(c1=O)C 62a_100020672187_200011217039 [0,0,1,0,0,0|2,0,1]=4 37 B28R3.2044155475 Cn1c(=O)c2c(ncn2CCCSCSCc3ccccc3)n(c1=O)C 62a_200011217039_100020672187 [0,0,1,0,0,0|2,0,1]=4 38 B27R3.845894648 CCCN(C/C=C/c1ccccc1)c2nc3c([nH]2)c(=O)[nH]c(=O)n3C 27a_100020603570_100000239299 [1,0,1,0,0,0|0,0,0]=2 39 B27R3.845894648 Cn1c(=O)[nH]c(=O)c2c1nc([nH]2)N(C/C=C/c3ccccc3)CCO 27a_100020603566_100000239299 [1,0,1,0,0,0|1,0,0]=3 40 B27R3.1208004319 CCN(C/C=C/c1ccccc1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_100020603567_100000185366 [1,0,1,0,0,0|0,0,0]=2 41 B27R3.1208004319 CCN(CCOc1ccccc1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_100015187784_100000185366 [1,0,1,0,0,0|1,0,1]=4 42 B29R3.3243364427 CCCCN(C/C=C/c1ccccc1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_100020603575_100000185366 [0,1,1,0,0,0|0,0,0]=2 43 B29R3.3243364427 CCCCN(CCCc1ccccc1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_200000200706_100000185366 [0,1,1,0,0,0|0,0,2]=4 44 B29R3.3243364427 COCCN(C/C=C/c1ccccc1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_100020603577_100000185366 [0,1,1,0,0,0|0,0,0]=2 45 B29R3.3243364427 COCCN(CCOc1ccccc1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_100000223795_100000185366 [0,1,1,0,0,0|1,0,1]=4 46 B29R3.3243364427 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)N(C/C=C/c3ccccc3)CCCO 27a_100020603576_100000185366 [0,1,1,0,0,0|0,0,0]=2 47 B29R3.4702350943 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)N(CCO)CC(=O)Nc3ccccc3 27a_100000176203_100000185366 [0,1,1,0,0,0|2,0,0]=4 48 B29R3.11656283322 CCC(C)N(C/C=C/c1ccccc1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_100020603573_100000185366 [0,1,1,0,0,0|0,0,0]=2 49 B29R3.270869189 Cc1ccccc1OCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000743344_100020672187 [0,1,1,0,0,0|1,0,1]=4 50 B29R3.270869189 Cc1ccccc1OCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000743344_100020672187 [0,1,1,0,0,0|1,0,1]=4 51 B29R3.270869189 Cn1c(=O)c2c(ncn2CCCNCCCc3ccccc3F)n(c1=O)C 2230a_100000724733_100020672187 [0,1,1,0,0,0|0,0,2]=4 52 B29R3.270869189 Cn1c(=O)c2c(ncn2CCCNCCCc3ccccc3F)n(c1=O)C 34a_100000724733_100020672187 [0,1,1,0,0,0|0,0,2]=4 53 B29R3.270869189 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccc3Br)n(c1=O)C 2230a_100000744007_100020672187 [0,1,1,0,0,0|1,0,1]=4 54 B29R3.270869189 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccc3Br)n(c1=O)C 34a_100000744007_100020672187 [0,1,1,0,0,0|1,0,1]=4 55 B29R3.270869189 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccc3Cl)n(c1=O)C 2230a_100000174932_100020672187 [0,1,1,0,0,0|1,0,1]=4 56 B29R3.270869189 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccc3Cl)n(c1=O)C 34a_100000174932_100020672187 [0,1,1,0,0,0|1,0,1]=4 57 B29R3.270869189 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccc3F)n(c1=O)C 2230a_100000683764_100020672187 [0,1,1,0,0,0|1,0,1]=4 58 B29R3.270869189 Cn1c(=O)c2c(ncn2CCCNCCOc3ccccc3F)n(c1=O)C 34a_100000683764_100020672187 [0,1,1,0,0,0|1,0,1]=4 59 B29R3.1464137503 Cc1ccc(cc1)CCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100011236272_100020672187 [0,1,1,0,0,0|0,0,2]=4 60 B29R3.1464137503 Cc1ccc(cc1)CCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100011236272_100020672187 [0,1,1,0,0,0|0,0,2]=4 61 B29R3.1464137503 Cc1ccc(cc1)OCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100020666663_100020672187 [0,1,1,0,0,0|1,0,1]=4 62 B29R3.1464137503 Cc1ccc(cc1)OCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100020666663_100020672187 [0,1,1,0,0,0|1,0,1]=4 63 B29R3.1464137503 Cc1ccc(cc1)SCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000739754_100020672187 [0,1,1,0,0,0|1,0,1]=4 64 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCC#Cc3ccc(cc3)Cl)n(c1=O)C 2230a_100011352944_100020672187 [0,1,1,0,0,0|0,0,2]=4 65 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCC#Cc3ccc(cc3)Cl)n(c1=O)C 34a_100011352944_100020672187 [0,1,1,0,0,0|0,0,2]=4 66 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCCc3ccc(cc3)Br)n(c1=O)C 2230a_100011297623_100020672187 [0,1,1,0,0,0|0,0,2]=4 67 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCCc3ccc(cc3)Br)n(c1=O)C 34a_100011297623_100020672187 [0,1,1,0,0,0|0,0,2]=4 68 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCCc3ccc(cc3)Cl)n(c1=O)C 2230a_100000748451_100020672187 [0,1,1,0,0,0|0,0,2]=4 69 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCCc3ccc(cc3)Cl)n(c1=O)C 34a_100000748451_100020672187 [0,1,1,0,0,0|0,0,2]=4 70 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCCc3ccc(cc3)F)n(c1=O)C 2230a_100025745824_100020672187 [0,1,1,0,0,0|0,0,2]=4 71 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCCc3ccc(cc3)F)n(c1=O)C 34a_100025745824_100020672187 [0,1,1,0,0,0|0,0,2]=4 72 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCOc3ccc(cc3)Br)n(c1=O)C 2230a_100000746992_100020672187 [0,1,1,0,0,0|1,0,1]=4 73 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCOc3ccc(cc3)Br)n(c1=O)C 34a_100000746992_100020672187 [0,1,1,0,0,0|1,0,1]=4 74 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCOc3ccc(cc3)Cl)n(c1=O)C 2230a_100000697975_100020672187 [0,1,1,0,0,0|1,0,1]=4 75 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCOc3ccc(cc3)Cl)n(c1=O)C 34a_100000697975_100020672187 [0,1,1,0,0,0|1,0,1]=4 76 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCOc3ccc(cc3)F)n(c1=O)C 2230a_100000737420_100020672187 [0,1,1,0,0,0|1,0,1]=4 77 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCOc3ccc(cc3)F)n(c1=O)C 34a_100000737420_100020672187 [0,1,1,0,0,0|1,0,1]=4 78 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCSc3ccc(cc3)Br)n(c1=O)C 2230a_100000184645_100020672187 [0,1,1,0,0,0|1,0,1]=4 79 B29R3.1464137503 Cn1c(=O)c2c(ncn2CCCNCCSc3ccc(cc3)Cl)n(c1=O)C 2230a_100000174974_100020672187 [0,1,1,0,0,0|1,0,1]=4 80 B29R3.1481761251 Cc1cccc(c1)CCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_103496528808_100020672187 [0,1,1,0,0,0|0,0,2]=4 81 B29R3.1481761251 Cc1cccc(c1)CCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_103496528808_100020672187 [0,1,1,0,0,0|0,0,2]=4 82 B29R3.1481761251 Cc1cccc(c1)OCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100015185188_100020672187 [0,1,1,0,0,0|1,0,1]=4 83 B29R3.1481761251 Cc1cccc(c1)OCCNCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100015185188_100020672187 [0,1,1,0,0,0|1,0,1]=4 84 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCCc3cccc(c3)Br)n(c1=O)C 2230a_100000753791_100020672187 [0,1,1,0,0,0|0,0,2]=4 85 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCCc3cccc(c3)Br)n(c1=O)C 34a_100000753791_100020672187 [0,1,1,0,0,0|0,0,2]=4 86 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCCc3cccc(c3)Cl)n(c1=O)C 2230a_100000704586_100020672187 [0,1,1,0,0,0|0,0,2]=4 87 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCCc3cccc(c3)Cl)n(c1=O)C 34a_100000704586_100020672187 [0,1,1,0,0,0|0,0,2]=4 88 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCCc3cccc(c3)F)n(c1=O)C 2230a_100000754185_100020672187 [0,1,1,0,0,0|0,0,2]=4 89 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCCc3cccc(c3)F)n(c1=O)C 34a_100000754185_100020672187 [0,1,1,0,0,0|0,0,2]=4 90 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCOc3cccc(c3)Br)n(c1=O)C 2230a_100000743521_100020672187 [0,1,1,0,0,0|1,0,1]=4 91 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCOc3cccc(c3)Br)n(c1=O)C 34a_100000743521_100020672187 [0,1,1,0,0,0|1,0,1]=4 92 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCOc3cccc(c3)Cl)n(c1=O)C 2230a_100000740232_100020672187 [0,1,1,0,0,0|1,0,1]=4 93 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCOc3cccc(c3)Cl)n(c1=O)C 34a_100000740232_100020672187 [0,1,1,0,0,0|1,0,1]=4 94 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCOc3cccc(c3)F)n(c1=O)C 2230a_100000738948_100020672187 [0,1,1,0,0,0|1,0,1]=4 95 B29R3.1481761251 Cn1c(=O)c2c(ncn2CCCNCCOc3cccc(c3)F)n(c1=O)C 34a_100000738948_100020672187 [0,1,1,0,0,0|1,0,1]=4 96 B29R3.3560465403 CN(CCCc1ccccc1)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000693637_100020672187 [0,1,1,0,0,0|0,0,2]=4 97 B29R3.3560465403 CN(CCCc1ccccc1)CCCn2cnc3c2c(=O)n(c(=O)n3C)C 269982a_100000693637_100020672187 [0,1,1,0,0,0|0,0,2]=4 98 B29R3.3560465403 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCOc3ccccc3 2230a_100000184383_100020672187 [0,1,1,0,0,0|1,0,1]=4 99 B29R3.3560465403 CN(CCCn1cnc2c1c(=O)n(c(=O)n2C)C)CCOc3ccccc3 269982a_100000184383_100020672187 [0,1,1,0,0,0|1,0,1]=4 100 B29R3.3560465403 Cn1c(=O)c2c(ncn2CCCC(=O)C/C=C/c3ccccc3)n(c1=O)C 1458a_100000689370_100016265936 [0,1,1,0,0,0|1,0,0]=3 101 B29R3.3560465403 Cn1c(=O)c2c(ncn2CCCC(=O)C/C=C/c3ccccc3)n(c1=O)C 1458a_100011219626_100020672187 [0,1,1,0,0,0|1,0,0]=3 102 B29R3.3560465404 C/C(=C\c1ccccc1)/COCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_200025717232_100020672187 [0,1,1,0,0,0|1,0,0]=3 103 B29R3.3560465404 C/C(=C\c1ccccc1)/COCCCn2cnc3c2c(=O)n(c(=O)n3C)C 7a_200025717232_100020672187 [0,1,1,0,0,0|1,0,0]=3 104 B29R3.3560465404 CC(CNCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 2230a_100000755676_100020672187 [0,1,1,0,0,0|1,0,1]=4 105 B29R3.3560465404 CC(CNCCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccccc3 34a_100000755676_100020672187 [0,1,1,0,0,0|1,0,1]=4 106 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCNCC(O)Cc3ccccc3)n(c1=O)C 2230a_100000752270_100020672187 [0,1,1,0,0,0|0,0,2]=4 107 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCOCC(=O)Nc3ccccc3)n(c1=O)C 34a_100000246334_100020672187 [0,1,1,0,0,0|2,0,0]=4 108 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCSCC(=O)Cc3ccccc3)n(c1=O)C 62a_100000233483_100020672187 [0,1,1,0,0,0|1,0,1]=4 109 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCSCC(=O)Cc3ccccc3)n(c1=O)C 62a_100020672187_100000233483 [0,1,1,0,0,0|1,0,1]=4 110 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCSCC(=O)Nc3ccccc3)n(c1=O)C 62a_100012148978_100020672187 [0,1,1,0,0,0|2,0,0]=4 111 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCSCC(=O)Nc3ccccc3)n(c1=O)C 62a_100020672187_100000182850 [0,1,1,0,0,0|2,0,0]=4 112 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCSCC(=O)Oc3ccccc3)n(c1=O)C 62a_100009813826_100020672187 [0,1,1,0,0,0|2,0,0]=4 113 B29R3.3560465404 Cn1c(=O)c2c(ncn2CCCSCC(=O)Oc3ccccc3)n(c1=O)C 62a_100020672187_100009813826 [0,1,1,0,0,0|2,0,0]=4 114 B29R3.3560465405 CC(CCc1ccccc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000210798_100020672187 [0,1,1,0,0,0|0,0,2]=4 115 B29R3.3560465405 CC(CCc1ccccc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000210798_100020672187 [0,1,1,0,0,0|0,0,2]=4 116 B29R3.3560465405 CC(COc1ccccc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 2230a_100000746794_100020672187 [0,1,1,0,0,0|1,0,1]=4 117 B29R3.3560465405 CC(COc1ccccc1)NCCCn2cnc3c2c(=O)n(c(=O)n3C)C 34a_100000746794_100020672187 [0,1,1,0,0,0|1,0,1]=4 118 B29R3.3560465408 Cn1c(=O)c2c(ncn2CCCNCCC(O)c3ccccc3)n(c1=O)C 2230a_100000763605_100020672187 [0,1,1,0,0,0|0,0,2]=4 119 B29R3.3560465408 Cn1c(=O)c2c(ncn2CCCSCCC(=O)c3ccccc3)n(c1=O)C 62a_100000750707_100020672187 [0,1,1,0,0,0|1,0,1]=4 120 B29R3.3560465408 Cn1c(=O)c2c(ncn2CCCSCCC(=O)c3ccccc3)n(c1=O)C 62a_100020672187_100000750707 [0,1,1,0,0,0|1,0,1]=4 121 B29R3.3560465408 Cn1c(=O)c2c(ncn2CCCSCOC(=O)c3ccccc3)n(c1=O)C 62a_100000073877_100020672187 [0,1,1,0,0,0|2,0,0]=4 122 B29R3.3560465408 Cn1c(=O)c2c(ncn2CCCSCOC(=O)c3ccccc3)n(c1=O)C 62a_100020672187_100000073877 [0,1,1,0,0,0|2,0,0]=4 123 B29R4.259113280 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)N3CCCC(C3)Cc4ccccc4 27a_100000752525_100000185366 [0,0,1,1,0,0|0,0,2]=4 124 B29R4.259113280 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)N3CCCC(C3)Oc4ccccc4 27a_100015203908_100000185366 [0,0,1,1,0,0|1,0,1]=4 125 B29R4.259113299 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)N3CCCC3CCc4ccccc4 27a_100000741814_100000185366 [0,0,1,1,0,0|0,0,2]=4 126 B29R4.1691373021 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)N3CCCC(CC3)c4ccccc4 27a_100015185863_100000185366 [0,0,1,1,0,0|0,0,2]=4 127 B29R4.2131954721 CCCN(c1nc2c([nH]1)c(=O)n(c(=O)n2C)C)C3CCc4c3cccc4 27a_100000737437_100000185366 [0,0,1,1,0,0|0,0,2]=4 128 B29R4.3707264266 Cn1c(=O)c2[nH]c(nc2n(c1=O)C)N(C/C=C/c3ccccc3)C4CC4 27a_200020603568_100000185366 [0,0,1,1,0,0|0,0,0]=2 129 B29R4.1691378580 Cn1c(=O)c2c(ncn2CCCNC3COc4c3cccc4)n(c1=O)C 2230a_100000747519_100020672187 [0,0,1,1,0,0|1,0,1]=4 130 B29R4.1691378580 Cn1c(=O)c2c(ncn2CCCN[C@H]3CCc4c3cccc4)n(c1=O)C 2230a_100016989578_100020672187 [0,0,1,1,0,0|0,0,2]=4 131 B29R4.1691378580 Cn1c(=O)c2c(ncn2CCCN[C@H]3CCc4c3cccc4)n(c1=O)C 34a_100016989578_100020672187 [0,0,1,1,0,0|0,0,2]=4 132 B29R4.3706485159 Cn1c(=O)c2c(ncn2CCCN3CCC3c4ccccc4)n(c1=O)C 2230a_100000739605_100020672187 [0,0,1,1,0,0|0,0,2]=4 133 B29R4.3706485159 Cn1c(=O)c2c(ncn2CCCN3CCC3c4ccccc4)n(c1=O)C 269982a_100000739605_100020672187 [0,0,1,1,0,0|0,0,2]=4 134 B29R4.3706485167 Cn1c(=O)c2c(ncn2CCCN[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 2230a_100020588832_100020672187 [0,0,1,1,0,0|0,0,2]=4 135 B29R4.3706485167 Cn1c(=O)c2c(ncn2CCCN[C@H]3C[C@@H]3c4ccccc4)n(c1=O)C 34a_100020588832_100020672187 [0,0,1,1,0,0|0,0,2]=4 136 B29R4.3706485172 Cn1c(=O)c2c(ncn2CCCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 2230a_100016998360_100020672187 [0,0,1,1,0,0|0,0,2]=4 137 B29R4.3706485172 Cn1c(=O)c2c(ncn2CCCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 269982a_100016998360_100020672187 [0,0,1,1,0,0|0,0,2]=4 138 B29R4.3706485172 Cn1c(=O)c2c(ncn2CCCN3C[C@@H]3Cc4ccccc4)n(c1=O)C 34a_100016998360_100020672187 [0,0,1,1,0,0|0,0,2]=4 139 B27R3.1314858144 CCCN(CCc1ccccn1)c2nc3c([nH]2)c(=O)n(c(=O)n3C)C 27a_100000176852_100000185366 [0,0,1,0,1,0|1,0,1]=4 140 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCNCCc3ccccc3)n(c1=O)C 2230a_100000106460_100020672187 [0,0,1,0,1,0|0,0,1]=3 141 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCNCCc3ccccc3)n(c1=O)C 34a_100000106460_100020672187 [0,0,1,0,1,0|0,0,1]=3 142 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCNCCc3cccnc3)n(c1=O)C 2230a_100000736294_100020672187 [0,0,1,0,1,0|1,0,1]=4 143 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCOCCc3ccccc3)n(c1=O)C 34a_100000210268_100020672187 [0,0,1,0,1,0|1,0,1]=4 144 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCOCCc3ccccc3)n(c1=O)C 7a_100000210268_100020672187 [0,0,1,0,1,0|1,0,1]=4 145 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3ccccc3)n(c1=O)C 62a_100000765856_100020672187 [0,0,1,0,1,0|1,0,1]=4 146 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCCc3ccccc3)n(c1=O)C 62a_100020672187_100011218657 [0,0,1,0,1,0|1,0,1]=4 147 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCSc3ccccc3)n(c1=O)C 62a_100011218342_100020672187 [0,0,1,0,1,0|2,0,0]=4 148 B27R3.605750926 Cn1c(=O)c2c(ncn2CCCSCSc3ccccc3)n(c1=O)C 62a_100020672187_100011218342 [0,0,1,0,1,0|2,0,0]=4 149 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNC/C=C/c3ccccc3)n(c1=O)C 2230a_100020603302_100000039610 [0,0,1,0,1,0|0,0,0]=2 150 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNC/C=C/c3ccccc3)n(c1=O)C 34a_100020603302_100000039610 [0,0,1,0,1,0|0,0,0]=2 151 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCC#Cc3ccccc3)n(c1=O)C 34a_100000735379_100000039610 [0,0,1,0,1,0|0,0,2]=4 152 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCCc3ccccc3)n(c1=O)C 2230a_100000211184_100000039610 [0,0,1,0,1,0|0,0,2]=4 153 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCCc3ccccc3)n(c1=O)C 34a_100000211184_100000039610 [0,0,1,0,1,0|0,0,2]=4 154 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCOc3ccccc3)n(c1=O)C 2230a_100000174943_100000039610 [0,0,1,0,1,0|1,0,1]=4 155 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCOc3ccccc3)n(c1=O)C 34a_100000174943_100000039610 [0,0,1,0,1,0|1,0,1]=4 156 B27R3.605750926 Cn1c(=O)c2c(ncn2CCNCCSc3ccccc3)n(c1=O)C 2230a_100000189519_100000039610 [0,0,1,0,1,0|1,0,1]=4 157 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOC/C=C/c3ccccc3)n(c1=O)C 34a_100000210256_100000039610 [0,0,1,0,1,0|1,0,0]=3 158 B27R3.605750926 Cn1c(=O)c2c(ncn2CCOC/C=C/c3cccnc3)n(c1=O)C 34a_200102594124_100000039610 [0,0,1,0,1,0|2,0,0]=4 159 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSC/C=C/c3ccccc3)n(c1=O)C 62a_100000039610_100016265936 [0,0,1,0,1,0|1,0,0]=3 160 B27R3.605750926 Cn1c(=O)c2c(ncn2CCSC/C=C/c3ccccc3)n(c1=O)C 62a_100016265936_100000039610 [0,0,1,0,1,0|1,0,0]=3 161 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCCCc3ccccc3)n(c1=O)C 2230a_100015280158_100020672187 [0,0,1,0,0,1|0,0,2]=4 162 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCCCc3ccccc3)n(c1=O)C 34a_100015280158_100020672187 [0,0,1,0,0,1|0,0,2]=4 163 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCCOc3ccccc3)n(c1=O)C 2230a_100000216521_100020672187 [0,0,1,0,0,1|0,0,2]=4 164 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCCOc3ccccc3)n(c1=O)C 34a_100000216521_100020672187 [0,0,1,0,0,1|0,0,2]=4 165 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCCSc3ccccc3)n(c1=O)C 2230a_100000184639_100020672187 [0,0,1,0,0,1|0,0,2]=4 166 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCOCc3ccccc3)n(c1=O)C 2230a_100000753106_100020672187 [0,0,1,0,0,1|0,0,2]=4 167 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCOCc3ccccc3)n(c1=O)C 34a_100000753106_100020672187 [0,0,1,0,0,1|0,0,2]=4 168 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCSCc3ccccc3)n(c1=O)C 2230a_100000189534_100020672187 [0,0,1,0,0,1|0,0,2]=4 169 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCSCc3ccccc3)n(c1=O)C 34a_100000189534_100020672187 [0,0,1,0,0,1|0,0,2]=4 170 B29R3.3560465401 Cn1c(=O)c2c(ncn2CCCNCCSCc3ccccc3)n(c1=O)C 7a_100000189534_100020672187 [0,0,1,0,0,1|0,0,2]=4