0 B27R3.260874737 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)CCc3ccccc3 62a_100012361361_200009996780 [0,0,0,0,0,0|3,0,0]=3 1 B27R3.260874737 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3ccccc3 62a_100000183539_200009996780 [0,0,0,0,0,0|2,0,0]=2 2 B27R3.260874737 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3ccccn3 62a_100000684169_200009996780 [0,0,0,0,0,0|1,0,0]=1 3 B27R3.260874737 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3cccnc3 62a_100000752408_200009996780 [0,0,0,0,0,0|3,0,0]=3 4 B27R3.260874737 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3ccncc3 62a_100011243468_200009996780 [0,0,0,0,0,0|3,0,0]=3 5 B27R3.260874737 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)OCc3ccccc3 62a_100000753625_200009996780 [0,0,0,0,0,0|3,0,0]=3 6 B26R3.4040073 Cc1c(c(nc2c1cccc2)O)SCC(=O)NCc3ccccn3 62a_100000684169_100009820873 [1,0,0,0,0,0|2,0,1]=4 7 B26R3.4040073 O=C(CCN1C(=O)Cc2ccccc2C1=O)NCc3ccccn3 240690a_100000210449_100000269930 [1,0,0,0,0,0|3,0,0]=4 8 B26R3.4040073 O=C(CSc1c(c2ccccc2oc1=O)O)NCc3ccccc3 62a_100000183539_100009994742 [1,0,0,0,0,0|3,0,0]=4 9 B26R3.4040073 O=C(CSc1c(c2ccccc2oc1=O)O)NCc3ccccn3 62a_100000684169_100009994742 [1,0,0,0,0,0|2,0,0]=3 10 B26R3.34138800 O=C(CSc1cc2ccc(cc2cc1O)O)NCc3ccccn3 62a_100000684169_100010179872 [1,0,0,0,0,0|2,0,1]=4 11 B28R3.244771725 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3cccc(c3)Br 62a_100011263252_200009996780 [0,1,0,0,0,0|2,0,0]=3 12 B28R3.244771725 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3cccc(c3)Cl 62a_100000181154_200009996780 [0,1,0,0,0,0|2,0,0]=3 13 B28R3.244771725 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3cccc(c3)F 62a_100000738998_200009996780 [0,1,0,0,0,0|2,0,0]=3 14 B28R3.244771725 Cc1cccc(c1)CNC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000754571_200009996780 [0,1,0,0,0,0|2,0,0]=3 15 B28R3.386197701 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NC(C)c3ccccc3 62a_200000243715_200009996780 [0,1,0,0,0,0|2,0,0]=3 16 B28R3.386197701 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N[C@@H](C)c3ccccc3 62a_100011939912_200009996780 [0,1,0,0,0,0|2,0,0]=3 17 B28R3.386198556 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3ccccc3 62a_100000182870_200009996780 [0,1,0,0,0,0|2,0,0]=3 18 B28R3.386198627 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NCc3ccccc3 62a_100000183842_200009996780 [0,1,0,0,0,0|2,0,0]=3 19 B28R3.386198627 Cc1c(c(=O)oc2c1ccc(c2)O)SC(F)C(=O)OCc3ccccc3 62a_100000036447_200009996780 [0,1,0,0,0,0|3,0,0]=4 20 B28R3.555921395 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3ccc(cc3)Cl 62a_100000183476_200009996780 [0,1,0,0,0,0|2,0,0]=3 21 B28R3.555921395 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3ccc(cc3)F 62a_100000182461_200009996780 [0,1,0,0,0,0|2,0,0]=3 22 B28R3.555921395 Cc1ccc(cc1)CNC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000183211_200009996780 [0,1,0,0,0,0|2,0,0]=3 23 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccccc3)C 1458a_100000734913_100000765856 [0,1,0,0,0,0|2,0,0]=3 24 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccccn3)C 1458a_100000734913_100015183660 [0,1,0,0,0,0|1,0,0]=2 25 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3cccnc3)C 1458a_100000734913_200011713674 [0,1,0,0,0,0|3,0,0]=4 26 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccncc3)C 1458a_100000734913_100000723409 [0,1,0,0,0,0|3,0,0]=4 27 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3)C 11a_100015324214_100000734913 [0,1,0,0,0,0|1,0,0]=2 28 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3)C 1626a_100015324214_100000734913 [0,1,0,0,0,0|1,0,0]=2 29 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3)C 240690a_100015324214_100000734913 [0,1,0,0,0,0|1,0,0]=2 30 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3)C 527a_100015324214_100000734913 [0,1,0,0,0,0|1,0,0]=2 31 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccn3)C 11a_100000210449_100000734913 [0,1,0,0,0,0|0,0,0]=1 32 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccn3)C 1626a_100000210449_100000734913 [0,1,0,0,0,0|0,0,0]=1 33 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccn3)C 240690a_100000210449_100000734913 [0,1,0,0,0,0|0,0,0]=1 34 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccn3)C 527a_100000210449_100000734913 [0,1,0,0,0,0|0,0,0]=1 35 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3)C 11a_100000210453_100000734913 [0,1,0,0,0,0|2,0,0]=3 36 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3)C 240690a_100000210453_100000734913 [0,1,0,0,0,0|2,0,0]=3 37 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3)C 527a_100000210453_100000734913 [0,1,0,0,0,0|2,0,0]=3 38 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnn3)C 11a_100159270163_100000734913 [0,1,0,0,0,0|1,0,0]=2 39 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnn3)C 240690a_100159270163_100000734913 [0,1,0,0,0,0|1,0,0]=2 40 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnn3)C 527a_100159270163_100000734913 [0,1,0,0,0,0|1,0,0]=2 41 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3)C 11a_100000210450_100000734913 [0,1,0,0,0,0|2,0,0]=3 42 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3)C 1626a_100000210450_100000734913 [0,1,0,0,0,0|2,0,0]=3 43 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3)C 240690a_100000210450_100000734913 [0,1,0,0,0,0|2,0,0]=3 44 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3)C 527a_100000210450_100000734913 [0,1,0,0,0,0|2,0,0]=3 45 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncn3)C 11a_100000736019_100000734913 [0,1,0,0,0,0|1,0,0]=2 46 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncn3)C 240690a_100000736019_100000734913 [0,1,0,0,0,0|1,0,0]=2 47 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncn3)C 527a_100000736019_100000734913 [0,1,0,0,0,0|1,0,0]=2 48 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnccn3)C 11a_100000737960_100000734913 [0,1,0,0,0,0|1,0,0]=2 49 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnccn3)C 240690a_100000737960_100000734913 [0,1,0,0,0,0|1,0,0]=2 50 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnccn3)C 527a_100000737960_100000734913 [0,1,0,0,0,0|1,0,0]=2 51 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncnc3)C 11a_100011243677_100000734913 [0,1,0,0,0,0|3,0,0]=4 52 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncnc3)C 240690a_100011243677_100000734913 [0,1,0,0,0,0|3,0,0]=4 53 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncnc3)C 527a_100011243677_100000734913 [0,1,0,0,0,0|3,0,0]=4 54 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccn3)C 11a_100015189908_100000734913 [0,1,0,0,0,0|1,0,0]=2 55 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccn3)C 240690a_100015189908_100000734913 [0,1,0,0,0,0|1,0,0]=2 56 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccn3)C 527a_100015189908_100000734913 [0,1,0,0,0,0|1,0,0]=2 57 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccccc3)C 22a_100015195140_100000734913 [0,1,0,0,0,0|2,0,0]=3 58 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccccn3)C 22a_100000183288_100000734913 [0,1,0,0,0,0|1,0,0]=2 59 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccnc3)C 22a_100000728903_100000734913 [0,1,0,0,0,0|3,0,0]=4 60 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccnn3)C 22a_100000757824_100000734913 [0,1,0,0,0,0|2,0,0]=3 61 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccncc3)C 22a_100000698918_100000734913 [0,1,0,0,0,0|3,0,0]=4 62 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccncn3)C 22a_100011438088_100000734913 [0,1,0,0,0,0|2,0,0]=3 63 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cnccn3)C 22a_100000736894_100000734913 [0,1,0,0,0,0|2,0,0]=3 64 B28R3.646949528 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncccn3)C 22a_100000736892_100000734913 [0,1,0,0,0,0|2,0,0]=3 65 B28R3.2231186467 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3ccccc3F 62a_100000190583_200009996780 [0,1,0,0,0,0|2,0,0]=3 66 B28R3.2231186467 Cc1ccccc1CNC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000230231_200009996780 [0,1,0,0,0,0|2,0,0]=3 67 B26R3.249452940 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Cc3ccccc3 62a_100000233483_200009996780 [0,0,0,0,1,0|2,0,0]=3 68 B26R3.249452940 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccccc3 62a_100012148978_200009996780 [0,0,0,0,1,0|2,0,0]=3 69 B26R3.249452940 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccccn3 62a_100020662008_200009996780 [0,0,0,0,1,0|1,0,0]=2 70 B26R3.249452940 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ncccn3 62a_100000183248_200009996780 [0,0,0,0,1,0|2,0,0]=3 71 B26R3.249452940 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Oc3ccccc3 62a_100009813826_200009996780 [0,0,0,0,1,0|3,0,0]=4 72 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccccc3 1458a_100000721692_100000765856 [0,0,0,0,1,0|2,0,0]=3 73 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccccn3 1458a_100000721692_100015183660 [0,0,0,0,1,0|1,0,0]=2 74 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3cccnc3 1458a_100000721692_200011713674 [0,0,0,0,1,0|3,0,0]=4 75 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccncc3 1458a_100000721692_100000723409 [0,0,0,0,1,0|3,0,0]=4 76 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccccc3 240690a_100015324214_100000721692 [0,0,0,0,1,0|1,0,0]=2 77 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccccn3 240690a_100000210449_100000721692 [0,0,0,0,1,0|0,0,0]=1 78 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccnc3 240690a_100000210453_100000721692 [0,0,0,0,1,0|2,0,0]=3 79 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccnn3 240690a_100159270163_100000721692 [0,0,0,0,1,0|1,0,0]=2 80 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccncc3 240690a_100000210450_100000721692 [0,0,0,0,1,0|2,0,0]=3 81 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccncn3 240690a_100000736019_100000721692 [0,0,0,0,1,0|1,0,0]=2 82 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cnccn3 240690a_100000737960_100000721692 [0,0,0,0,1,0|1,0,0]=2 83 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cncnc3 240690a_100011243677_100000721692 [0,0,0,0,1,0|3,0,0]=4 84 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ncccn3 240690a_100015189908_100000721692 [0,0,0,0,1,0|1,0,0]=2 85 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccccc3 22a_100015195140_100000721692 [0,0,0,0,1,0|2,0,0]=3 86 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccccn3 22a_100000183288_100000721692 [0,0,0,0,1,0|1,0,0]=2 87 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccnc3 22a_100000728903_100000721692 [0,0,0,0,1,0|3,0,0]=4 88 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccnn3 22a_100000757824_100000721692 [0,0,0,0,1,0|2,0,0]=3 89 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccncc3 22a_100000698918_100000721692 [0,0,0,0,1,0|3,0,0]=4 90 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccncn3 22a_100011438088_100000721692 [0,0,0,0,1,0|2,0,0]=3 91 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cnccn3 22a_100000736894_100000721692 [0,0,0,0,1,0|2,0,0]=3 92 B26R3.249453002 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncccn3 22a_100000736892_100000721692 [0,0,0,0,1,0|2,0,0]=3 93 B26R3.681457977 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3ccco3 62a_100000183421_200009996780 [0,0,0,0,1,0|2,0,0]=3 94 B26R3.681457977 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3cccs3 62a_100000182718_200009996780 [0,0,0,0,1,0|2,0,0]=3 95 B28R3.386197792 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCCc3ccccc3 62a_100000183012_200009996780 [0,0,0,0,0,1|2,0,0]=3 96 B28R3.386197792 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NOCc3ccccc3 62a_100000230105_200009996780 [0,0,0,0,0,1|2,0,0]=3 97 B28R3.386197792 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)OCCc3ccccc3 62a_200000077782_200009996780 [0,0,0,0,0,1|3,0,0]=4 98 B28R3.386198508 Cc1c(c(=O)oc2c1ccc(c2)O)CCNC(=O)OCc3ccccc3 271570a_200010239705_200009996780 [0,0,0,0,0,1|2,0,0]=3 99 B28R3.386198508 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)OCc3ccccc3 62a_100009813219_200009996780 [0,0,0,0,0,1|2,0,0]=3 100 B25R3.64282 O=C(CCc1nc2ccccc2[nH]c1=O)NCc3ccccn3 240690a_100000210449_100000010020 [2,0,0,0,0,0|2,0,0]=4 101 B25R3.64282 O=C(COc1cc2ccccc2oc1=O)NCc3ccccc3 7a_100000061252_100000183539 [2,0,0,0,0,0|2,0,0]=4 102 B25R3.64282 O=C(COc1cc2ccccc2oc1=O)NCc3ccccn3 7a_100000061252_100000684169 [2,0,0,0,0,0|1,0,0]=3 103 B25R3.64282 O=C(CSc1cc2ccccc2oc1=O)NCc3ccccc3 62a_100000183539_200000187772 [2,0,0,0,0,0|2,0,0]=4 104 B25R3.64282 O=C(CSc1cc2ccccc2oc1=O)NCc3ccccn3 62a_100000684169_200000187772 [2,0,0,0,0,0|1,0,0]=3 105 B25R3.14250618 Cc1c(ccc2c1cccc2)OCC(=O)NCc3ccccn3 34a_100009830054_100000684169 [2,0,0,0,0,0|2,0,0]=4 106 B25R3.14250618 Cc1c(ccc2c1cccc2)OCC(=O)NCc3ccccn3 7a_100009830054_100000684169 [2,0,0,0,0,0|2,0,0]=4 107 B25R3.14250618 Cc1c(ccc2c1cccc2)SCC(=O)NCc3ccccn3 62a_100000684169_100010221197 [2,0,0,0,0,0|2,0,0]=4 108 B25R3.14250618 Cc1c(ccc2c1cccc2)SCC(=O)NCc3ccccn3 62a_100010221197_100000684169 [2,0,0,0,0,0|2,0,0]=4 109 B25R3.14250618 O=C(CSc1coc2ccccc2c1=O)NCc3ccccn3 62a_100000684169_100009813851 [2,0,0,0,0,0|2,0,0]=4 110 B25R3.18435655 O=C(CSc1ccc2cc(ccc2c1)O)NCc3ccccn3 62a_100000684169_100000185455 [2,0,0,0,0,0|2,0,0]=4 111 B25R3.18435655 O=C(CSc1cnc2cc(ccc2c1)O)NCc3ccccn3 62a_100000684169_200010153753 [2,0,0,0,0,0|2,0,0]=4 112 B25R3.18435655 O=C(NCc1ccc2cc(ccc2c1)O)NCc3ccccn3 2708a_100000210449_200000083168 [2,0,0,0,0,0|2,0,0]=4 113 B25R3.18435655 O=C(NCc1ccc2cc(ccc2c1)O)NCc3ccccn3 2708a_200000083168_100000210449 [2,0,0,0,0,0|2,0,0]=4 114 B25R3.18435655 O=C(NCc1ccc2cc(ccc2c1)O)NCc3ccccn3 273464a_100000210449_200000083168 [2,0,0,0,0,0|2,0,0]=4 115 B25R3.18435655 O=C(NCc1ccc2cc(ccc2c1)O)NCc3ccccn3 273464a_200000083168_100000210449 [2,0,0,0,0,0|2,0,0]=4 116 B25R3.18435655 O=C(NCc1ccc2cc(ccc2c1)O)NCc3ccccn3 512a_200000083168_100000210449 [2,0,0,0,0,0|2,0,0]=4 117 B27R3.170927588 Cc1c(c(=O)n(c2c1cccc2)C)SCC(=O)NCc3ccccn3 62a_100000684169_100010739255 [1,1,0,0,0,0|2,0,0]=4 118 B27R3.170927588 Cc1c(c(=O)n(c2c1cccc2)C)SCC(=O)NCc3ccccn3 62a_100010739255_100000684169 [1,1,0,0,0,0|2,0,0]=4 119 B27R3.260875578 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNCc3ccccn3 22a_100000736832_100000721692 [1,1,0,0,0,0|1,0,1]=4 120 B27R3.426238816 COc1ccc2c(=O)c(coc2c1)SCC(=O)NCc3ccccn3 62a_100000684169_100010272328 [1,1,0,0,0,0|2,0,0]=4 121 B27R3.165994458 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3cccc(c3)Br 62a_100000183509_200009996780 [0,1,0,0,1,0|2,0,0]=4 122 B27R3.165994458 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3cccc(c3)F 62a_100000183335_200009996780 [0,1,0,0,1,0|2,0,0]=4 123 B27R3.165994458 Cc1cccc(c1)NC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000243722_200009996780 [0,1,0,0,1,0|2,0,0]=4 124 B27R3.165994458 Cc1cccc(n1)NC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_103633700106_200009996780 [0,1,0,0,1,0|1,0,0]=3 125 B27R3.260874741 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)c3ccccc3 62a_100000183487_200009996780 [0,1,0,0,1,0|2,0,0]=4 126 B27R3.260874818 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Cc3ccccc3Br 62a_100000700504_200009996780 [0,1,0,0,1,0|2,0,0]=4 127 B27R3.260874818 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccccc3Br 62a_100000182372_200009996780 [0,1,0,0,1,0|2,0,0]=4 128 B27R3.260874818 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccccc3Cl 62a_200011202291_200009996780 [0,1,0,0,1,0|2,0,0]=4 129 B27R3.260874818 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccccc3F 62a_100000182988_200009996780 [0,1,0,0,1,0|2,0,0]=4 130 B27R3.260874818 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccccc3I 62a_100000180142_200009996780 [0,1,0,0,1,0|2,0,0]=4 131 B27R3.260874818 Cc1ccccc1CC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100011223134_200009996780 [0,1,0,0,1,0|2,0,0]=4 132 B27R3.260875469 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)Nc3ccccc3 62a_100000183986_200009996780 [0,1,0,0,1,0|2,0,0]=4 133 B27R3.260875469 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)Nc3ccccn3 62a_100015185774_200009996780 [0,1,0,0,1,0|1,0,0]=3 134 B27R3.260875469 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)Nc3ncccn3 62a_100000184444_200009996780 [0,1,0,0,1,0|2,0,0]=4 135 B27R3.370036931 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccc(cc3)Br 62a_100000183692_200009996780 [0,1,0,0,1,0|2,0,0]=4 136 B27R3.370036931 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccc(cc3)Cl 62a_200011202288_200009996780 [0,1,0,0,1,0|2,0,0]=4 137 B27R3.370036931 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccc(cc3)F 62a_200000243717_200009996780 [0,1,0,0,1,0|2,0,0]=4 138 B27R3.370036931 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccc(cc3)I 62a_100000183000_200009996780 [0,1,0,0,1,0|2,0,0]=4 139 B27R3.370036931 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccc(cn3)Br 62a_100000239667_200009996780 [0,1,0,0,1,0|1,0,0]=3 140 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Cc3ccccc3)C 1458a_100000734913_100015291786 [0,1,0,0,1,0|1,0,0]=3 141 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Cc3ccccn3)C 1458a_100000734913_100000721315 [0,1,0,0,1,0|0,0,0]=2 142 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Cc3cccnc3)C 1458a_100000734913_100000733263 [0,1,0,0,1,0|2,0,0]=4 143 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Cc3cccnn3)C 1458a_100000734913_100016990269 [0,1,0,0,1,0|1,0,0]=3 144 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Cc3ccncc3)C 1458a_100000734913_100000705612 [0,1,0,0,1,0|2,0,0]=4 145 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Cc3cnccn3)C 1458a_100000734913_100016995436 [0,1,0,0,1,0|1,0,0]=3 146 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Cc3ncccn3)C 1458a_100000734913_100000703007 [0,1,0,0,1,0|1,0,0]=3 147 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Nc3ccccc3)C 11a_100000106764_100000734913 [0,1,0,0,1,0|1,0,0]=3 148 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Nc3ccccc3)C 1626a_100000106764_100000734913 [0,1,0,0,1,0|1,0,0]=3 149 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Nc3ccccc3)C 22a_100000106764_100000734913 [0,1,0,0,1,0|1,0,0]=3 150 B27R3.426107570 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)Nc3ccccc3)C 527a_100000106764_100000734913 [0,1,0,0,1,0|1,0,0]=3 151 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccc(cc3)Br 1458a_100000721692_100011740612 [0,1,0,0,1,0|2,0,0]=4 152 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccc(cc3)Cl 1458a_100000721692_100011713675 [0,1,0,0,1,0|2,0,0]=4 153 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccc(cc3)F 1458a_100000721692_100011217392 [0,1,0,0,1,0|2,0,0]=4 154 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccc(cc3)O 1458a_100000721692_100009816426 [0,1,0,0,1,0|2,0,0]=4 155 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cc3)Br 240690a_100000174875_100000721692 [0,1,0,0,1,0|1,0,0]=3 156 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cc3)Cl 240690a_100000174871_100000721692 [0,1,0,0,1,0|1,0,0]=3 157 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cc3)F 240690a_100000174882_100000721692 [0,1,0,0,1,0|1,0,0]=3 158 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cc3)I 240690a_100016989417_100000721692 [0,1,0,0,1,0|1,0,0]=3 159 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cc3)O 240690a_100000185549_100000721692 [0,1,0,0,1,0|1,0,0]=3 160 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cn3)Br 240690a_100015188789_100000721692 [0,1,0,0,1,0|0,0,0]=2 161 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cn3)Cl 240690a_100000697193_100000721692 [0,1,0,0,1,0|0,0,0]=2 162 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cn3)F 240690a_100020620131_100000721692 [0,1,0,0,1,0|0,0,0]=2 163 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(cn3)O 240690a_100020605196_100000721692 [0,1,0,0,1,0|0,0,0]=2 164 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(nc3)Br 240690a_100009817727_100000721692 [0,1,0,0,1,0|2,0,0]=4 165 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(nc3)Cl 240690a_100000735879_100000721692 [0,1,0,0,1,0|2,0,0]=4 166 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(nc3)F 240690a_100000101913_100000721692 [0,1,0,0,1,0|2,0,0]=4 167 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc(nc3)O 240690a_100000757128_100000721692 [0,1,0,0,1,0|2,0,0]=4 168 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ncc(cn3)Br 240690a_200016993442_100000721692 [0,1,0,0,1,0|1,0,0]=3 169 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ncc(cn3)Cl 240690a_200015186297_100000721692 [0,1,0,0,1,0|1,0,0]=3 170 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(cc3)Br 22a_100000735608_100000721692 [0,1,0,0,1,0|2,0,0]=4 171 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(cc3)Cl 22a_100000683521_100000721692 [0,1,0,0,1,0|2,0,0]=4 172 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(cc3)F 22a_100000728448_100000721692 [0,1,0,0,1,0|2,0,0]=4 173 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(cc3)I 22a_100016988836_100000721692 [0,1,0,0,1,0|2,0,0]=4 174 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(cn3)Br 22a_100000750576_100000721692 [0,1,0,0,1,0|1,0,0]=3 175 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(cn3)Cl 22a_100011206499_100000721692 [0,1,0,0,1,0|1,0,0]=3 176 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(cn3)F 22a_100000753838_100000721692 [0,1,0,0,1,0|1,0,0]=3 177 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(cn3)I 22a_100010221006_100000721692 [0,1,0,0,1,0|1,0,0]=3 178 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(nn3)Br 22a_100102525236_100000721692 [0,1,0,0,1,0|2,0,0]=4 179 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccc(nn3)Cl 22a_100000182438_100000721692 [0,1,0,0,1,0|2,0,0]=4 180 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cnc(cn3)Cl 22a_100000121042_100000721692 [0,1,0,0,1,0|2,0,0]=4 181 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncc(cn3)Br 22a_100011203108_100000721692 [0,1,0,0,1,0|2,0,0]=4 182 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncc(cn3)Cl 22a_100012000172_100000721692 [0,1,0,0,1,0|2,0,0]=4 183 B27R3.59804917 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncc(cn3)I 22a_100012357424_100000721692 [0,1,0,0,1,0|2,0,0]=4 184 B27R3.59804917 Cc1ccc(cc1)CCC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 1458a_100000721692_100011713686 [0,1,0,0,1,0|2,0,0]=4 185 B27R3.59804917 Cc1ccc(cc1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100000174908_100000721692 [0,1,0,0,1,0|1,0,0]=3 186 B27R3.59804917 Cc1ccc(cc1)NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100000683527_100000721692 [0,1,0,0,1,0|2,0,0]=4 187 B27R3.59804917 Cc1ccc(cn1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100000740942_100000721692 [0,1,0,0,1,0|2,0,0]=4 188 B27R3.59804917 Cc1ccc(nc1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100015187455_100000721692 [0,1,0,0,1,0|0,0,0]=2 189 B27R3.59804917 Cc1ccc(nc1)NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100000746693_100000721692 [0,1,0,0,1,0|1,0,0]=3 190 B27R3.59804917 Cc1ccc(nn1)NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100000747182_100000721692 [0,1,0,0,1,0|2,0,0]=4 191 B27R3.59804917 Cc1cnc(cn1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100132314150_100000721692 [0,1,0,0,1,0|1,0,0]=3 192 B27R3.59804917 Cc1cnc(nc1)NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100011824989_100000721692 [0,1,0,0,1,0|2,0,0]=4 193 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3cccc(c3)Br 1458a_100000721692_100011740638 [0,1,0,0,1,0|2,0,0]=4 194 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3cccc(c3)Cl 1458a_100000721692_100011713710 [0,1,0,0,1,0|2,0,0]=4 195 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3cccc(c3)F 1458a_100000721692_100011217235 [0,1,0,0,1,0|2,0,0]=4 196 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cc(ccn3)Br 240690a_100009818019_100000721692 [0,1,0,0,1,0|0,0,0]=2 197 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cc(ccn3)Cl 240690a_100000085674_100000721692 [0,1,0,0,1,0|0,0,0]=2 198 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(=O)[nH]3 240690a_100000696482_100000721692 [0,1,0,0,1,0|0,0,1]=3 199 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(c3)Br 240690a_100000174977_100000721692 [0,1,0,0,1,0|1,0,0]=3 200 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(c3)Cl 240690a_100000174878_100000721692 [0,1,0,0,1,0|1,0,0]=3 201 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(c3)F 240690a_100000174948_100000721692 [0,1,0,0,1,0|1,0,0]=3 202 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(c3)I 240690a_100000106179_100000721692 [0,1,0,0,1,0|1,0,0]=3 203 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(c3)O 240690a_100000743036_100000721692 [0,1,0,0,1,0|1,0,0]=3 204 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(n3)Br 240690a_100016987751_100000721692 [0,1,0,0,1,0|0,0,0]=2 205 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(n3)Cl 240690a_100016990191_100000721692 [0,1,0,0,1,0|0,0,0]=2 206 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccc(n3)F 240690a_100015188798_100000721692 [0,1,0,0,1,0|0,0,0]=2 207 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccnc(c3)Br 240690a_100025757509_100000721692 [0,1,0,0,1,0|2,0,0]=4 208 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccnc(c3)Cl 240690a_100015205668_100000721692 [0,1,0,0,1,0|2,0,0]=4 209 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccnc(c3)F 240690a_100015188774_100000721692 [0,1,0,0,1,0|2,0,0]=4 210 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccnc(c3)O 240690a_100000748557_100000721692 [0,1,0,0,1,0|2,0,0]=4 211 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cncc(c3)Br 240690a_100011249555_100000721692 [0,1,0,0,1,0|2,0,0]=4 212 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cncc(c3)Cl 240690a_200020614424_100000721692 [0,1,0,0,1,0|2,0,0]=4 213 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cncc(c3)F 240690a_100011962886_100000721692 [0,1,0,0,1,0|2,0,0]=4 214 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cc(ccn3)Br 22a_100000764631_100000721692 [0,1,0,0,1,0|1,0,0]=3 215 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cc(ccn3)Cl 22a_100102524961_100000721692 [0,1,0,0,1,0|1,0,0]=3 216 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cc(ccn3)I 22a_100010221011_100000721692 [0,1,0,0,1,0|1,0,0]=3 217 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cc(ncn3)Cl 22a_100000242035_100000721692 [0,1,0,0,1,0|2,0,0]=4 218 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccc(c3)Br 22a_100000217339_100000721692 [0,1,0,0,1,0|2,0,0]=4 219 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccc(c3)Cl 22a_100000184277_100000721692 [0,1,0,0,1,0|2,0,0]=4 220 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccc(c3)F 22a_100000745080_100000721692 [0,1,0,0,1,0|2,0,0]=4 221 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccc(c3)I 22a_100020605690_100000721692 [0,1,0,0,1,0|2,0,0]=4 222 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccc(n3)Br 22a_100009817029_100000721692 [0,1,0,0,1,0|1,0,0]=3 223 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccc(n3)Cl 22a_100102524919_100000721692 [0,1,0,0,1,0|1,0,0]=3 224 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cccc(n3)F 22a_100000075452_100000721692 [0,1,0,0,1,0|1,0,0]=3 225 B27R3.165851749 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3cncc(n3)Cl 22a_100102525095_100000721692 [0,1,0,0,1,0|2,0,0]=4 226 B27R3.165851749 Cc1cc(ccn1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100011934566_100000721692 [0,1,0,0,1,0|2,0,0]=4 227 B27R3.165851749 Cc1cccc(c1)CCC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 1458a_100000721692_100011713685 [0,1,0,0,1,0|2,0,0]=4 228 B27R3.165851749 Cc1cccc(c1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100000185548_100000721692 [0,1,0,0,1,0|1,0,0]=3 229 B27R3.165851749 Cc1cccc(c1)NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100000681630_100000721692 [0,1,0,0,1,0|2,0,0]=4 230 B27R3.165851749 Cc1cccc(n1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100000701342_100000721692 [0,1,0,0,1,0|0,0,0]=2 231 B27R3.165851749 Cc1cccc(n1)NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100011363444_100000721692 [0,1,0,0,1,0|1,0,0]=3 232 B27R3.165851749 Cc1ccnc(c1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100011934573_100000721692 [0,1,0,0,1,0|0,0,0]=2 233 B27R3.165851749 Cc1ccnc(c1)NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100000746014_100000721692 [0,1,0,0,1,0|1,0,0]=3 234 B27R3.165851749 Cc1ccnc(n1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100015186494_100000721692 [0,1,0,0,1,0|1,0,0]=3 235 B27R3.165851749 Cc1ccnc(n1)NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100011780740_100000721692 [0,1,0,0,1,0|2,0,0]=4 236 B27R3.165851749 Cc1cncc(c1)CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100000692839_100000721692 [0,1,0,0,1,0|2,0,0]=4 237 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CC(=O)c3ccccn3 1458a_100000721692_100000027445 [0,1,0,0,1,0|1,0,1]=4 238 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CC(C)c3ccccc3 1458a_100000721692_100000756946 [0,1,0,0,1,0|2,0,0]=4 239 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CC(O)c3ccccc3 1458a_100000721692_100000185958 [0,1,0,0,1,0|2,0,0]=4 240 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)C[C@@H](O)c3ccccc3 1458a_100000721692_100011933945 [0,1,0,0,1,0|2,0,0]=4 241 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NC(C)c3ccccn3 240690a_100000181244_100000721692 [0,1,0,0,1,0|0,0,0]=2 242 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NC(C)c3cccnc3 240690a_100000195435_100000721692 [0,1,0,0,1,0|2,0,0]=4 243 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NC(C)c3ccncc3 240690a_100000181269_100000721692 [0,1,0,0,1,0|2,0,0]=4 244 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NC(C)c3ncccn3 240690a_100020641698_100000721692 [0,1,0,0,1,0|1,0,0]=3 245 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)N[C@H](C)c3ccccc3 240690a_100000751104_100000721692 [0,1,0,0,1,0|1,0,0]=3 246 B27R3.260875510 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)N[C@H](C)c3cnccn3 240690a_100020589798_100000721692 [0,1,0,0,1,0|1,0,0]=3 247 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccccc3Br 1458a_100000721692_100012161201 [0,1,0,0,1,0|2,0,0]=4 248 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccccc3Cl 1458a_100000721692_100011713703 [0,1,0,0,1,0|2,0,0]=4 249 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccccc3F 1458a_100000721692_100000720011 [0,1,0,0,1,0|2,0,0]=4 250 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3ccccc3O 1458a_100000721692_100000722297 [0,1,0,0,1,0|2,0,0]=4 251 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccccc3Br 240690a_100000689332_100000721692 [0,1,0,0,1,0|1,0,0]=3 252 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccccc3Cl 240690a_100000174879_100000721692 [0,1,0,0,1,0|1,0,0]=3 253 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccccc3F 240690a_100000174869_100000721692 [0,1,0,0,1,0|1,0,0]=3 254 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccccc3I 240690a_100015347259_100000721692 [0,1,0,0,1,0|1,0,0]=3 255 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccccc3O 240690a_100000185550_100000721692 [0,1,0,0,1,0|1,0,0]=3 256 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccnc3Br 240690a_100009818023_100000721692 [0,1,0,0,1,0|2,0,0]=4 257 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccnc3Cl 240690a_100015189234_100000721692 [0,1,0,0,1,0|2,0,0]=4 258 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccnc3F 240690a_100000724633_100000721692 [0,1,0,0,1,0|2,0,0]=4 259 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccncc3Br 240690a_100020640021_100000721692 [0,1,0,0,1,0|2,0,0]=4 260 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccncc3F 240690a_100011935246_100000721692 [0,1,0,0,1,0|2,0,0]=4 261 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ncccc3Br 240690a_100020591323_100000721692 [0,1,0,0,1,0|0,0,0]=2 262 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ncccc3Cl 240690a_100015189233_100000721692 [0,1,0,0,1,0|0,0,0]=2 263 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ncccc3F 240690a_100000690088_100000721692 [0,1,0,0,1,0|0,0,0]=2 264 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3nccnc3Cl 240690a_100000729963_100000721692 [0,1,0,0,1,0|1,0,0]=3 265 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccccc3Br 22a_100000241748_100000721692 [0,1,0,0,1,0|2,0,0]=4 266 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccccc3Cl 22a_100000683529_100000721692 [0,1,0,0,1,0|2,0,0]=4 267 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccccc3F 22a_100000239246_100000721692 [0,1,0,0,1,0|2,0,0]=4 268 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ccccc3I 22a_100011218156_100000721692 [0,1,0,0,1,0|2,0,0]=4 269 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncccc3Br 22a_100011464834_100000721692 [0,1,0,0,1,0|1,0,0]=3 270 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncccc3Cl 22a_100000741667_100000721692 [0,1,0,0,1,0|1,0,0]=3 271 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncccc3F 22a_100000717775_100000721692 [0,1,0,0,1,0|1,0,0]=3 272 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncccc3I 22a_100010221029_100000721692 [0,1,0,0,1,0|1,0,0]=3 273 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3nccnc3Cl 22a_100000755098_100000721692 [0,1,0,0,1,0|2,0,0]=4 274 B27R3.725904363 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3ncncc3Cl 22a_100000709255_100000721692 [0,1,0,0,1,0|2,0,0]=4 275 B27R3.725904363 Cc1ccccc1CCC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 1458a_100000721692_100011713688 [0,1,0,0,1,0|2,0,0]=4 276 B27R3.725904363 Cc1ccccc1CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100000174972_100000721692 [0,1,0,0,1,0|1,0,0]=3 277 B27R3.725904363 Cc1ccccc1NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100000184220_100000721692 [0,1,0,0,1,0|2,0,0]=4 278 B27R3.725904363 Cc1cccnc1CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100011223789_100000721692 [0,1,0,0,1,0|0,0,0]=2 279 B27R3.725904363 Cc1cccnc1NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100000708268_100000721692 [0,1,0,0,1,0|1,0,0]=3 280 B27R3.725904363 Cc1ccncc1CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100011997553_100000721692 [0,1,0,0,1,0|2,0,0]=4 281 B27R3.725904363 Cc1cnccc1CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100000708811_100000721692 [0,1,0,0,1,0|2,0,0]=4 282 B27R3.725904363 Cc1cncnc1NNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 22a_100000121387_100000721692 [0,1,0,0,1,0|2,0,0]=4 283 B27R3.725904363 Cc1nccnc1CNC(=O)Cc2c(c3ccc(cc3oc2=O)O)C 240690a_100020641712_100000721692 [0,1,0,0,1,0|1,0,0]=3 284 B27R3.725908407 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3cccs3 62a_100000185100_200009996780 [0,1,0,0,1,0|2,0,0]=4 285 B27R3.725908407 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3ccsc3 62a_100000230117_200009996780 [0,1,0,0,1,0|2,0,0]=4 286 B27R3.725908910 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NCc3ccco3 62a_100000183933_200009996780 [0,1,0,0,1,0|2,0,0]=4 287 B27R3.725908910 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NCc3cccs3 62a_200012362578_200009996780 [0,1,0,0,1,0|2,0,0]=4 288 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3c[nH]cn3)C 1458a_100000734913_100020628418 [0,1,0,0,1,0|2,0,0]=4 289 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3cccs3)C 1458a_100000734913_100000748579 [0,1,0,0,1,0|2,0,0]=4 290 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCn3cccc3)C 1458a_100000734913_200000035178 [0,1,0,0,1,0|2,0,0]=4 291 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCn3cccn3)C 1458a_100000734913_100000685285 [0,1,0,0,1,0|2,0,0]=4 292 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3c[nH]cn3)C 11a_100000758547_100000734913 [0,1,0,0,1,0|1,0,0]=3 293 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3c[nH]cn3)C 240690a_100000758547_100000734913 [0,1,0,0,1,0|1,0,0]=3 294 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3c[nH]cn3)C 527a_100000758547_100000734913 [0,1,0,0,1,0|1,0,0]=3 295 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3c[nH]nn3)C 11a_100020620823_100000734913 [0,1,0,0,1,0|2,0,0]=4 296 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3c[nH]nn3)C 240690a_100020620823_100000734913 [0,1,0,0,1,0|2,0,0]=4 297 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3c[nH]nn3)C 527a_100020620823_100000734913 [0,1,0,0,1,0|2,0,0]=4 298 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc[nH]n3)C 11a_100000739516_100000734913 [0,1,0,0,1,0|1,0,0]=3 299 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc[nH]n3)C 240690a_100000739516_100000734913 [0,1,0,0,1,0|1,0,0]=3 300 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc[nH]n3)C 527a_100000739516_100000734913 [0,1,0,0,1,0|1,0,0]=3 301 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc[nH]3)C 11a_100000764082_100000734913 [0,1,0,0,1,0|0,0,1]=3 302 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc[nH]3)C 240690a_100000764082_100000734913 [0,1,0,0,1,0|0,0,1]=3 303 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc[nH]3)C 527a_100000764082_100000734913 [0,1,0,0,1,0|0,0,1]=3 304 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccco3)C 11a_100000185738_100000734913 [0,1,0,0,1,0|1,0,0]=3 305 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccco3)C 1626a_100000185738_100000734913 [0,1,0,0,1,0|1,0,0]=3 306 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccco3)C 240690a_100000185738_100000734913 [0,1,0,0,1,0|1,0,0]=3 307 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccco3)C 527a_100000185738_100000734913 [0,1,0,0,1,0|1,0,0]=3 308 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccs3)C 11a_100000211653_100000734913 [0,1,0,0,1,0|1,0,0]=3 309 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccs3)C 1626a_100000211653_100000734913 [0,1,0,0,1,0|1,0,0]=3 310 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccs3)C 240690a_100000211653_100000734913 [0,1,0,0,1,0|1,0,0]=3 311 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccs3)C 527a_100000211653_100000734913 [0,1,0,0,1,0|1,0,0]=3 312 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccoc3)C 11a_100015206860_100000734913 [0,1,0,0,1,0|1,0,0]=3 313 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccoc3)C 1626a_100015206860_100000734913 [0,1,0,0,1,0|1,0,0]=3 314 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccoc3)C 240690a_100015206860_100000734913 [0,1,0,0,1,0|1,0,0]=3 315 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccoc3)C 527a_100015206860_100000734913 [0,1,0,0,1,0|1,0,0]=3 316 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccon3)C 11a_100000688301_100000734913 [0,1,0,0,1,0|1,0,0]=3 317 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccon3)C 240690a_100000688301_100000734913 [0,1,0,0,1,0|1,0,0]=3 318 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccon3)C 527a_100000688301_100000734913 [0,1,0,0,1,0|1,0,0]=3 319 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccsc3)C 11a_100000186416_100000734913 [0,1,0,0,1,0|1,0,0]=3 320 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccsc3)C 1626a_100000186416_100000734913 [0,1,0,0,1,0|1,0,0]=3 321 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccsc3)C 240690a_100000186416_100000734913 [0,1,0,0,1,0|1,0,0]=3 322 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccsc3)C 527a_100000186416_100000734913 [0,1,0,0,1,0|1,0,0]=3 323 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cn[nH]c3)C 11a_100000737208_100000734913 [0,1,0,0,1,0|2,0,0]=4 324 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cn[nH]c3)C 240690a_100000737208_100000734913 [0,1,0,0,1,0|2,0,0]=4 325 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnco3)C 11a_100020634212_100000734913 [0,1,0,0,1,0|2,0,0]=4 326 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnco3)C 240690a_100020634212_100000734913 [0,1,0,0,1,0|2,0,0]=4 327 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnco3)C 527a_100020634212_100000734913 [0,1,0,0,1,0|2,0,0]=4 328 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncs3)C 11a_100016987365_100000734913 [0,1,0,0,1,0|2,0,0]=4 329 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncs3)C 240690a_100016987365_100000734913 [0,1,0,0,1,0|2,0,0]=4 330 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncs3)C 527a_100016987365_100000734913 [0,1,0,0,1,0|2,0,0]=4 331 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnoc3)C 11a_100016995009_100000734913 [0,1,0,0,1,0|2,0,0]=4 332 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnoc3)C 240690a_100016995009_100000734913 [0,1,0,0,1,0|2,0,0]=4 333 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cocn3)C 11a_100015188801_100000734913 [0,1,0,0,1,0|1,0,0]=3 334 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cocn3)C 240690a_100015188801_100000734913 [0,1,0,0,1,0|1,0,0]=3 335 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cocn3)C 527a_100015188801_100000734913 [0,1,0,0,1,0|1,0,0]=3 336 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cscn3)C 11a_100015185402_100000734913 [0,1,0,0,1,0|1,0,0]=3 337 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cscn3)C 1626a_100015185402_100000734913 [0,1,0,0,1,0|1,0,0]=3 338 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cscn3)C 240690a_100015185402_100000734913 [0,1,0,0,1,0|1,0,0]=3 339 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cscn3)C 527a_100015185402_100000734913 [0,1,0,0,1,0|1,0,0]=3 340 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc[nH]3)C 11a_100000754540_100000734913 [0,1,0,0,1,0|1,0,0]=3 341 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc[nH]3)C 240690a_100000754540_100000734913 [0,1,0,0,1,0|1,0,0]=3 342 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc[nH]3)C 527a_100000754540_100000734913 [0,1,0,0,1,0|1,0,0]=3 343 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncco3)C 11a_100016994969_100000734913 [0,1,0,0,1,0|1,0,0]=3 344 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncco3)C 1626a_100016994969_100000734913 [0,1,0,0,1,0|1,0,0]=3 345 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncco3)C 240690a_100016994969_100000734913 [0,1,0,0,1,0|1,0,0]=3 346 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncco3)C 527a_100016994969_100000734913 [0,1,0,0,1,0|1,0,0]=3 347 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccs3)C 11a_100000740555_100000734913 [0,1,0,0,1,0|1,0,0]=3 348 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccs3)C 1626a_100000740555_100000734913 [0,1,0,0,1,0|1,0,0]=3 349 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccs3)C 240690a_100000740555_100000734913 [0,1,0,0,1,0|1,0,0]=3 350 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccs3)C 527a_100000740555_100000734913 [0,1,0,0,1,0|1,0,0]=3 351 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nnc[nH]3)C 11a_200015183720_100000734913 [0,1,0,0,1,0|2,0,0]=4 352 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nnc[nH]3)C 240690a_200015183720_100000734913 [0,1,0,0,1,0|2,0,0]=4 353 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nnc[nH]3)C 527a_200015183720_100000734913 [0,1,0,0,1,0|2,0,0]=4 354 B27R3.1094918403 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3nccs3)C 22a_100011198208_100000734913 [0,1,0,0,1,0|2,0,0]=4 355 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCCc3ccccc3)C 1458a_100000734913_100000211621 [0,1,0,0,0,1|2,0,0]=4 356 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCOc3ccccc3)C 1458a_100000734913_100000184471 [0,1,0,0,0,1|2,0,0]=4 357 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCSc3ccccc3)C 1458a_100000734913_100000246102 [0,1,0,0,0,1|2,0,0]=4 358 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CSCc3ccccc3)C 1458a_100000734913_200011217039 [0,1,0,0,0,1|2,0,0]=4 359 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccccc3)C 11a_100000106460_100000734913 [0,1,0,0,0,1|1,0,0]=3 360 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccccc3)C 1626a_100000106460_100000734913 [0,1,0,0,0,1|1,0,0]=3 361 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccccc3)C 240690a_100000106460_100000734913 [0,1,0,0,0,1|1,0,0]=3 362 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccccc3)C 527a_100000106460_100000734913 [0,1,0,0,0,1|1,0,0]=3 363 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccccn3)C 11a_100000211156_100000734913 [0,1,0,0,0,1|0,0,0]=2 364 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccccn3)C 1626a_100000211156_100000734913 [0,1,0,0,0,1|0,0,0]=2 365 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccccn3)C 240690a_100000211156_100000734913 [0,1,0,0,0,1|0,0,0]=2 366 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccccn3)C 527a_100000211156_100000734913 [0,1,0,0,0,1|0,0,0]=2 367 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3cccnc3)C 11a_100000736294_100000734913 [0,1,0,0,0,1|2,0,0]=4 368 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3cccnc3)C 1626a_100000736294_100000734913 [0,1,0,0,0,1|2,0,0]=4 369 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3cccnc3)C 240690a_100000736294_100000734913 [0,1,0,0,0,1|2,0,0]=4 370 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3cccnc3)C 527a_100000736294_100000734913 [0,1,0,0,0,1|2,0,0]=4 371 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccncc3)C 11a_100000742849_100000734913 [0,1,0,0,0,1|2,0,0]=4 372 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccncc3)C 1626a_100000742849_100000734913 [0,1,0,0,0,1|2,0,0]=4 373 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccncc3)C 240690a_100000742849_100000734913 [0,1,0,0,0,1|2,0,0]=4 374 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3ccncc3)C 527a_100000742849_100000734913 [0,1,0,0,0,1|2,0,0]=4 375 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3cnccn3)C 11a_100000723456_100000734913 [0,1,0,0,0,1|1,0,0]=3 376 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3cnccn3)C 1626a_100000723456_100000734913 [0,1,0,0,0,1|1,0,0]=3 377 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3cnccn3)C 240690a_100000723456_100000734913 [0,1,0,0,0,1|1,0,0]=3 378 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCCc3cnccn3)C 527a_100000723456_100000734913 [0,1,0,0,0,1|1,0,0]=3 379 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNCc3ccccc3)C 22a_100000007032_100000734913 [0,1,0,0,0,1|1,0,0]=3 380 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNCc3ccccn3)C 22a_100000736832_100000734913 [0,1,0,0,0,1|0,0,0]=2 381 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNCc3cccnc3)C 22a_100000738295_100000734913 [0,1,0,0,0,1|2,0,0]=4 382 B29R3.1013898822 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNCc3ccncc3)C 22a_100000736929_100000734913 [0,1,0,0,0,1|2,0,0]=4 383 B29R3.1464770116 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCCc3ccc(cc3)Cl 62a_200000183373_200009996780 [0,1,0,0,0,1|2,0,0]=4 384 B29R3.1482734956 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCCc3cccc(c3)Cl 62a_100000230230_200009996780 [0,1,0,0,0,1|2,0,0]=4 385 B29R3.4075011726 Cc1ccccc1CCNC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000230229_200009996780 [0,1,0,0,0,1|2,0,0]=4 386 B29R3.4075025167 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NCCc3ccccc3 62a_100000230280_200009996780 [0,1,0,0,0,1|2,0,0]=4 387 B29R3.438681538 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)N(C)Cc3ccccc3 62a_200011208496_200009996780 [0,1,0,0,0,1|1,0,0]=3 388 B29R3.438682333 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)NC(C)c3ccccc3 62a_100000242056_200009996780 [0,1,0,0,0,1|1,0,0]=3 389 B29R3.821578545 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)NCc3ccc(cc3)Cl 62a_200011235835_200009996780 [0,1,0,0,0,1|1,0,0]=3 390 B29R3.821578545 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)NCc3ccc(cc3)F 62a_200011194857_200009996780 [0,1,0,0,0,1|1,0,0]=3 391 B29R3.821578545 Cc1ccc(cc1)CNC(=O)CCSc2c(c3ccc(cc3oc2=O)O)C 62a_100011194906_200009996780 [0,1,0,0,0,1|1,0,0]=3 392 B29R3.4075011709 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CC(=O)CCc3ccccc3 1458a_100000721692_100012361361 [0,1,0,0,0,1|2,0,0]=4 393 B29R3.4075011709 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CC(=O)NCc3ccccc3 1458a_100000721692_100000183539 [0,1,0,0,0,1|1,0,0]=3 394 B29R3.4075011709 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CC(=O)NCc3ccccn3 1458a_100000721692_100000684169 [0,1,0,0,0,1|0,0,0]=2 395 B29R3.4075011709 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CC(=O)NCc3ccncc3 1458a_100000721692_100011243468 [0,1,0,0,0,1|2,0,0]=4 396 B29R3.4075011709 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CC(=O)OCc3ccccc3 1458a_100000721692_100000753625 [0,1,0,0,0,1|2,0,0]=4 397 B29R3.4075011756 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)NCc3ccccc3Cl 62a_100000242069_200009996780 [0,1,0,0,0,1|1,0,0]=3 398 B29R3.4075011756 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)NCc3ccccc3F 62a_200011194869_200009996780 [0,1,0,0,0,1|1,0,0]=3 399 B29R3.4115412130 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)NCc3cccc(c3)Cl 62a_200011272484_200009996780 [0,1,0,0,0,1|1,0,0]=3 400 B29R3.1363757769 COc1cccc(c1)CNC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000185302_200009996780 [0,2,0,0,0,0|2,0,0]=4 401 B29R3.1482132773 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3cccc(c3)Cl 62a_100000217385_200009996780 [0,2,0,0,0,0|2,0,0]=4 402 B29R3.1482132773 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3cccc(c3)F 62a_100000204657_200009996780 [0,2,0,0,0,0|2,0,0]=4 403 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3cccc(c3)Br)C 1458a_100000734913_100011740638 [0,2,0,0,0,0|2,0,0]=4 404 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3cccc(c3)C)C 1458a_100000734913_100011713685 [0,2,0,0,0,0|2,0,0]=4 405 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3cccc(c3)Cl)C 1458a_100000734913_100011713710 [0,2,0,0,0,0|2,0,0]=4 406 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3cccc(c3)F)C 1458a_100000734913_100011217235 [0,2,0,0,0,0|2,0,0]=4 407 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)Br)C 11a_100009818019_100000734913 [0,2,0,0,0,0|0,0,0]=2 408 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)Br)C 1626a_100009818019_100000734913 [0,2,0,0,0,0|0,0,0]=2 409 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)Br)C 240690a_100009818019_100000734913 [0,2,0,0,0,0|0,0,0]=2 410 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)Br)C 527a_100009818019_100000734913 [0,2,0,0,0,0|0,0,0]=2 411 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)C)C 11a_100011934573_100000734913 [0,2,0,0,0,0|0,0,0]=2 412 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)C)C 1626a_100011934573_100000734913 [0,2,0,0,0,0|0,0,0]=2 413 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)C)C 240690a_100011934573_100000734913 [0,2,0,0,0,0|0,0,0]=2 414 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)C)C 527a_100011934573_100000734913 [0,2,0,0,0,0|0,0,0]=2 415 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)Cl)C 11a_100000085674_100000734913 [0,2,0,0,0,0|0,0,0]=2 416 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)Cl)C 1626a_100000085674_100000734913 [0,2,0,0,0,0|0,0,0]=2 417 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)Cl)C 240690a_100000085674_100000734913 [0,2,0,0,0,0|0,0,0]=2 418 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cc(ccn3)Cl)C 527a_100000085674_100000734913 [0,2,0,0,0,0|0,0,0]=2 419 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(=O)[nH]3)C 11a_100000696482_100000734913 [0,2,0,0,0,0|0,0,1]=3 420 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(=O)[nH]3)C 1626a_100000696482_100000734913 [0,2,0,0,0,0|0,0,1]=3 421 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(=O)[nH]3)C 240690a_100000696482_100000734913 [0,2,0,0,0,0|0,0,1]=3 422 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(=O)[nH]3)C 527a_100000696482_100000734913 [0,2,0,0,0,0|0,0,1]=3 423 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)Br)C 11a_100000174977_100000734913 [0,2,0,0,0,0|1,0,0]=3 424 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)Br)C 1626a_100000174977_100000734913 [0,2,0,0,0,0|1,0,0]=3 425 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)Br)C 240690a_100000174977_100000734913 [0,2,0,0,0,0|1,0,0]=3 426 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)Br)C 527a_100000174977_100000734913 [0,2,0,0,0,0|1,0,0]=3 427 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)C)C 11a_100000185548_100000734913 [0,2,0,0,0,0|1,0,0]=3 428 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)C)C 1626a_100000185548_100000734913 [0,2,0,0,0,0|1,0,0]=3 429 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)C)C 240690a_100000185548_100000734913 [0,2,0,0,0,0|1,0,0]=3 430 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)C)C 527a_100000185548_100000734913 [0,2,0,0,0,0|1,0,0]=3 431 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)Cl)C 11a_100000174878_100000734913 [0,2,0,0,0,0|1,0,0]=3 432 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)Cl)C 1626a_100000174878_100000734913 [0,2,0,0,0,0|1,0,0]=3 433 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)Cl)C 240690a_100000174878_100000734913 [0,2,0,0,0,0|1,0,0]=3 434 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)Cl)C 527a_100000174878_100000734913 [0,2,0,0,0,0|1,0,0]=3 435 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)F)C 11a_100000174948_100000734913 [0,2,0,0,0,0|1,0,0]=3 436 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)F)C 1626a_100000174948_100000734913 [0,2,0,0,0,0|1,0,0]=3 437 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)F)C 240690a_100000174948_100000734913 [0,2,0,0,0,0|1,0,0]=3 438 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)F)C 527a_100000174948_100000734913 [0,2,0,0,0,0|1,0,0]=3 439 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)I)C 11a_100000106179_100000734913 [0,2,0,0,0,0|1,0,0]=3 440 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)I)C 1626a_100000106179_100000734913 [0,2,0,0,0,0|1,0,0]=3 441 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)I)C 240690a_100000106179_100000734913 [0,2,0,0,0,0|1,0,0]=3 442 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)I)C 527a_100000106179_100000734913 [0,2,0,0,0,0|1,0,0]=3 443 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)O)C 240690a_100000743036_100000734913 [0,2,0,0,0,0|1,0,0]=3 444 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(c3)O)C 527a_100000743036_100000734913 [0,2,0,0,0,0|1,0,0]=3 445 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)Br)C 11a_100016987751_100000734913 [0,2,0,0,0,0|0,0,0]=2 446 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)Br)C 1626a_100016987751_100000734913 [0,2,0,0,0,0|0,0,0]=2 447 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)Br)C 240690a_100016987751_100000734913 [0,2,0,0,0,0|0,0,0]=2 448 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)Br)C 527a_100016987751_100000734913 [0,2,0,0,0,0|0,0,0]=2 449 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)C)C 11a_100000701342_100000734913 [0,2,0,0,0,0|0,0,0]=2 450 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)C)C 1626a_100000701342_100000734913 [0,2,0,0,0,0|0,0,0]=2 451 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)C)C 240690a_100000701342_100000734913 [0,2,0,0,0,0|0,0,0]=2 452 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)C)C 527a_100000701342_100000734913 [0,2,0,0,0,0|0,0,0]=2 453 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)Cl)C 11a_100016990191_100000734913 [0,2,0,0,0,0|0,0,0]=2 454 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)Cl)C 1626a_100016990191_100000734913 [0,2,0,0,0,0|0,0,0]=2 455 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)Cl)C 240690a_100016990191_100000734913 [0,2,0,0,0,0|0,0,0]=2 456 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)Cl)C 527a_100016990191_100000734913 [0,2,0,0,0,0|0,0,0]=2 457 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)F)C 11a_100015188798_100000734913 [0,2,0,0,0,0|0,0,0]=2 458 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)F)C 1626a_100015188798_100000734913 [0,2,0,0,0,0|0,0,0]=2 459 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)F)C 240690a_100015188798_100000734913 [0,2,0,0,0,0|0,0,0]=2 460 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccc(n3)F)C 527a_100015188798_100000734913 [0,2,0,0,0,0|0,0,0]=2 461 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)Br)C 11a_100025757509_100000734913 [0,2,0,0,0,0|2,0,0]=4 462 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)Br)C 240690a_100025757509_100000734913 [0,2,0,0,0,0|2,0,0]=4 463 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)Br)C 527a_100025757509_100000734913 [0,2,0,0,0,0|2,0,0]=4 464 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)C)C 11a_100011934566_100000734913 [0,2,0,0,0,0|2,0,0]=4 465 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)C)C 1626a_100011934566_100000734913 [0,2,0,0,0,0|2,0,0]=4 466 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)C)C 240690a_100011934566_100000734913 [0,2,0,0,0,0|2,0,0]=4 467 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)C)C 527a_100011934566_100000734913 [0,2,0,0,0,0|2,0,0]=4 468 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)Cl)C 11a_100015205668_100000734913 [0,2,0,0,0,0|2,0,0]=4 469 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)Cl)C 1626a_100015205668_100000734913 [0,2,0,0,0,0|2,0,0]=4 470 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)Cl)C 240690a_100015205668_100000734913 [0,2,0,0,0,0|2,0,0]=4 471 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)Cl)C 527a_100015205668_100000734913 [0,2,0,0,0,0|2,0,0]=4 472 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)F)C 11a_100015188774_100000734913 [0,2,0,0,0,0|2,0,0]=4 473 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)F)C 1626a_100015188774_100000734913 [0,2,0,0,0,0|2,0,0]=4 474 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)F)C 240690a_100015188774_100000734913 [0,2,0,0,0,0|2,0,0]=4 475 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)F)C 527a_100015188774_100000734913 [0,2,0,0,0,0|2,0,0]=4 476 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)O)C 11a_100000748557_100000734913 [0,2,0,0,0,0|2,0,0]=4 477 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)O)C 240690a_100000748557_100000734913 [0,2,0,0,0,0|2,0,0]=4 478 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccnc(c3)O)C 527a_100000748557_100000734913 [0,2,0,0,0,0|2,0,0]=4 479 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)Br)C 11a_100011249555_100000734913 [0,2,0,0,0,0|2,0,0]=4 480 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)Br)C 240690a_100011249555_100000734913 [0,2,0,0,0,0|2,0,0]=4 481 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)Br)C 527a_100011249555_100000734913 [0,2,0,0,0,0|2,0,0]=4 482 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)C)C 11a_100000692839_100000734913 [0,2,0,0,0,0|2,0,0]=4 483 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)C)C 1626a_100000692839_100000734913 [0,2,0,0,0,0|2,0,0]=4 484 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)C)C 240690a_100000692839_100000734913 [0,2,0,0,0,0|2,0,0]=4 485 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)C)C 527a_100000692839_100000734913 [0,2,0,0,0,0|2,0,0]=4 486 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)Cl)C 11a_200020614424_100000734913 [0,2,0,0,0,0|2,0,0]=4 487 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)Cl)C 1626a_200020614424_100000734913 [0,2,0,0,0,0|2,0,0]=4 488 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)Cl)C 240690a_200020614424_100000734913 [0,2,0,0,0,0|2,0,0]=4 489 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)Cl)C 527a_200020614424_100000734913 [0,2,0,0,0,0|2,0,0]=4 490 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)F)C 11a_100011962886_100000734913 [0,2,0,0,0,0|2,0,0]=4 491 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)F)C 1626a_100011962886_100000734913 [0,2,0,0,0,0|2,0,0]=4 492 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)F)C 240690a_100011962886_100000734913 [0,2,0,0,0,0|2,0,0]=4 493 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cncc(c3)F)C 527a_100011962886_100000734913 [0,2,0,0,0,0|2,0,0]=4 494 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccc(n3)C)C 11a_100015186494_100000734913 [0,2,0,0,0,0|1,0,0]=3 495 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccc(n3)C)C 1626a_100015186494_100000734913 [0,2,0,0,0,0|1,0,0]=3 496 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccc(n3)C)C 240690a_100015186494_100000734913 [0,2,0,0,0,0|1,0,0]=3 497 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccc(n3)C)C 527a_100015186494_100000734913 [0,2,0,0,0,0|1,0,0]=3 498 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cc(ccn3)Br)C 22a_100000764631_100000734913 [0,2,0,0,0,0|1,0,0]=3 499 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cc(ccn3)C)C 22a_100000746014_100000734913 [0,2,0,0,0,0|1,0,0]=3 500 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cc(ccn3)Cl)C 22a_100102524961_100000734913 [0,2,0,0,0,0|1,0,0]=3 501 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cc(ccn3)I)C 22a_100010221011_100000734913 [0,2,0,0,0,0|1,0,0]=3 502 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cc(ncn3)Cl)C 22a_100000242035_100000734913 [0,2,0,0,0,0|2,0,0]=4 503 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(c3)Br)C 22a_100000217339_100000734913 [0,2,0,0,0,0|2,0,0]=4 504 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(c3)C)C 22a_100000681630_100000734913 [0,2,0,0,0,0|2,0,0]=4 505 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(c3)Cl)C 22a_100000184277_100000734913 [0,2,0,0,0,0|2,0,0]=4 506 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(c3)F)C 22a_100000745080_100000734913 [0,2,0,0,0,0|2,0,0]=4 507 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(c3)I)C 22a_100020605690_100000734913 [0,2,0,0,0,0|2,0,0]=4 508 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(n3)Br)C 22a_100009817029_100000734913 [0,2,0,0,0,0|1,0,0]=3 509 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(n3)C)C 22a_100011363444_100000734913 [0,2,0,0,0,0|1,0,0]=3 510 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(n3)Cl)C 22a_100102524919_100000734913 [0,2,0,0,0,0|1,0,0]=3 511 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cccc(n3)F)C 22a_100000075452_100000734913 [0,2,0,0,0,0|1,0,0]=3 512 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cncc(n3)Cl)C 22a_100102525095_100000734913 [0,2,0,0,0,0|2,0,0]=4 513 B29R3.5979112424 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3nccc(n3)C)C 22a_100011780740_100000734913 [0,2,0,0,0,0|2,0,0]=4 514 B29R3.93149227 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N[C@H](CO)c3ccccc3 62a_200013032810_200009996780 [0,2,0,0,0,0|2,0,0]=4 515 B29R3.438681539 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)C(C)c3ccccc3 62a_100000195693_200009996780 [0,2,0,0,0,0|2,0,0]=4 516 B29R3.438682403 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NC(C)c3ccccc3 62a_100000184655_200009996780 [0,2,0,0,0,0|2,0,0]=4 517 B29R3.821328547 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NC(C)c3ccc(cc3)Br 62a_100000181351_200009996780 [0,2,0,0,0,0|2,0,0]=4 518 B29R3.821328547 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NC(C)c3ccc(cc3)F 62a_100000199058_200009996780 [0,2,0,0,0,0|2,0,0]=4 519 B29R3.821328547 Cc1ccc(cc1)C(C)NC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_200011263253_200009996780 [0,2,0,0,0,0|2,0,0]=4 520 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CC(=O)c3ccccn3)C 1458a_100000734913_100000027445 [0,2,0,0,0,0|1,0,1]=4 521 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CC(C)c3ccccc3)C 1458a_100000734913_100000756946 [0,2,0,0,0,0|2,0,0]=4 522 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CC(O)c3ccccc3)C 1458a_100000734913_100000185958 [0,2,0,0,0,0|2,0,0]=4 523 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)C[C@@H](O)c3ccccc3)C 1458a_100000734913_100011933945 [0,2,0,0,0,0|2,0,0]=4 524 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ccccn3)C 11a_100000181244_100000734913 [0,2,0,0,0,0|0,0,0]=2 525 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ccccn3)C 1626a_100000181244_100000734913 [0,2,0,0,0,0|0,0,0]=2 526 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ccccn3)C 240690a_100000181244_100000734913 [0,2,0,0,0,0|0,0,0]=2 527 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ccccn3)C 527a_100000181244_100000734913 [0,2,0,0,0,0|0,0,0]=2 528 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3cccnc3)C 11a_100000195435_100000734913 [0,2,0,0,0,0|2,0,0]=4 529 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3cccnc3)C 240690a_100000195435_100000734913 [0,2,0,0,0,0|2,0,0]=4 530 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3cccnc3)C 527a_100000195435_100000734913 [0,2,0,0,0,0|2,0,0]=4 531 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ccncc3)C 240690a_100000181269_100000734913 [0,2,0,0,0,0|2,0,0]=4 532 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ccncc3)C 527a_100000181269_100000734913 [0,2,0,0,0,0|2,0,0]=4 533 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ncccn3)C 11a_100020641698_100000734913 [0,2,0,0,0,0|1,0,0]=3 534 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ncccn3)C 1626a_100020641698_100000734913 [0,2,0,0,0,0|1,0,0]=3 535 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ncccn3)C 240690a_100020641698_100000734913 [0,2,0,0,0,0|1,0,0]=3 536 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NC(C)c3ncccn3)C 527a_100020641698_100000734913 [0,2,0,0,0,0|1,0,0]=3 537 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N[C@H](C)c3ccccc3)C 11a_100000751104_100000734913 [0,2,0,0,0,0|1,0,0]=3 538 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N[C@H](C)c3ccccc3)C 1626a_100000751104_100000734913 [0,2,0,0,0,0|1,0,0]=3 539 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N[C@H](C)c3ccccc3)C 240690a_100000751104_100000734913 [0,2,0,0,0,0|1,0,0]=3 540 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N[C@H](C)c3ccccc3)C 527a_100000751104_100000734913 [0,2,0,0,0,0|1,0,0]=3 541 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N[C@H](C)c3cnccn3)C 11a_100020589798_100000734913 [0,2,0,0,0,0|1,0,0]=3 542 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N[C@H](C)c3cnccn3)C 240690a_100020589798_100000734913 [0,2,0,0,0,0|1,0,0]=3 543 B29R3.1013898634 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N[C@H](C)c3cnccn3)C 527a_100020589798_100000734913 [0,2,0,0,0,0|1,0,0]=3 544 B29R3.4075011686 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NC(C)c3ccccc3Cl 62a_100000181291_200009996780 [0,2,0,0,0,0|2,0,0]=4 545 B29R3.642023102 CCN(Cc1ccccc1)C(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000183411_200009996780 [0,2,0,0,0,0|2,0,0]=4 546 B29R3.825684851 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3ccc(cc3)Br 62a_100000230007_200009996780 [0,2,0,0,0,0|2,0,0]=4 547 B29R3.825684851 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3ccc(cc3)Cl 62a_100000195473_200009996780 [0,2,0,0,0,0|2,0,0]=4 548 B29R3.825684851 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3ccc(cc3)F 62a_100000185203_200009996780 [0,2,0,0,0,0|2,0,0]=4 549 B29R3.825684851 Cc1ccc(cc1)CN(C)C(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000185269_200009996780 [0,2,0,0,0,0|2,0,0]=4 550 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)C(C)Cc3ccccc3)C 1458a_100000734913_200011218536 [0,2,0,0,0,0|2,0,0]=4 551 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccccc3)C 11a_100000186898_100000734913 [0,2,0,0,0,0|1,0,0]=3 552 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccccc3)C 1626a_100000186898_100000734913 [0,2,0,0,0,0|1,0,0]=3 553 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccccc3)C 240690a_100000186898_100000734913 [0,2,0,0,0,0|1,0,0]=3 554 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccccc3)C 527a_100000186898_100000734913 [0,2,0,0,0,0|1,0,0]=3 555 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccccn3)C 11a_100000207498_100000734913 [0,2,0,0,0,0|0,0,0]=2 556 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccccn3)C 240690a_100000207498_100000734913 [0,2,0,0,0,0|0,0,0]=2 557 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccccn3)C 527a_100000207498_100000734913 [0,2,0,0,0,0|0,0,0]=2 558 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3cccnc3)C 11a_100000184577_100000734913 [0,2,0,0,0,0|2,0,0]=4 559 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3cccnc3)C 240690a_100000184577_100000734913 [0,2,0,0,0,0|2,0,0]=4 560 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3cccnc3)C 527a_100000184577_100000734913 [0,2,0,0,0,0|2,0,0]=4 561 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccncc3)C 11a_100000187231_100000734913 [0,2,0,0,0,0|2,0,0]=4 562 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccncc3)C 240690a_100000187231_100000734913 [0,2,0,0,0,0|2,0,0]=4 563 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ccncc3)C 527a_100000187231_100000734913 [0,2,0,0,0,0|2,0,0]=4 564 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3cnccn3)C 11a_100011269079_100000734913 [0,2,0,0,0,0|1,0,0]=3 565 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3cnccn3)C 240690a_100011269079_100000734913 [0,2,0,0,0,0|1,0,0]=3 566 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3cnccn3)C 527a_100011269079_100000734913 [0,2,0,0,0,0|1,0,0]=3 567 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ncccn3)C 11a_100025716638_100000734913 [0,2,0,0,0,0|1,0,0]=3 568 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ncccn3)C 240690a_100025716638_100000734913 [0,2,0,0,0,0|1,0,0]=3 569 B29R3.1013900269 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)N(C)Cc3ncccn3)C 527a_100025716638_100000734913 [0,2,0,0,0,0|1,0,0]=3 570 B29R3.4075011771 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N(C)Cc3ccccc3Br 62a_100000198607_200009996780 [0,2,0,0,0,0|2,0,0]=4 571 B29R3.824485855 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NCc3ccc(cc3)Cl 62a_100000230272_200009996780 [0,2,0,0,0,0|2,0,0]=4 572 B29R3.824485855 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NCc3ccc(cc3)F 62a_100000230310_200009996780 [0,2,0,0,0,0|2,0,0]=4 573 B29R3.824485855 Cc1ccc(cc1)CNC(=O)C(C)Sc2c(c3ccc(cc3oc2=O)O)C 62a_100000230317_200009996780 [0,2,0,0,0,0|2,0,0]=4 574 B29R3.1245520316 CCC(Sc1c(c2ccc(cc2oc1=O)O)C)C(=O)NCc3ccccc3 62a_100000021908_200009996780 [0,2,0,0,0,0|2,0,0]=4 575 B29R3.4075021786 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NCc3ccccc3Cl 62a_100000230298_200009996780 [0,2,0,0,0,0|2,0,0]=4 576 B29R3.4075021786 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)C(=O)NCc3ccccc3F 62a_100000735943_200009996780 [0,2,0,0,0,0|2,0,0]=4 577 B29R3.4075021786 Cc1ccccc1CNC(=O)C(C)Sc2c(c3ccc(cc3oc2=O)O)C 62a_100000735952_200009996780 [0,2,0,0,0,0|2,0,0]=4 578 B29R3.4075021858 Cc1c(c(=O)oc2c1ccc(c2)O)SC(C)(C)C(=O)NCc3ccccc3 62a_200012340349_200009996780 [0,2,0,0,0,0|2,0,0]=4 579 B29R3.51345574 COc1ccc(cc1)CNC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000183506_200009996780 [0,2,0,0,0,0|2,0,0]=4 580 B29R3.3198634656 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCc3ccc(cc3Cl)Cl 62a_100000010247_200009996780 [0,2,0,0,0,0|2,0,0]=4 581 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccc(cc3)Br)C 1458a_100000734913_100011740612 [0,2,0,0,0,0|2,0,0]=4 582 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccc(cc3)C)C 1458a_100000734913_100011713686 [0,2,0,0,0,0|2,0,0]=4 583 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccc(cc3)Cl)C 1458a_100000734913_100011713675 [0,2,0,0,0,0|2,0,0]=4 584 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccc(cc3)F)C 1458a_100000734913_100011217392 [0,2,0,0,0,0|2,0,0]=4 585 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccc(cc3)O)C 1458a_100000734913_100009816426 [0,2,0,0,0,0|2,0,0]=4 586 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)Br)C 11a_100000174875_100000734913 [0,2,0,0,0,0|1,0,0]=3 587 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)Br)C 1626a_100000174875_100000734913 [0,2,0,0,0,0|1,0,0]=3 588 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)Br)C 240690a_100000174875_100000734913 [0,2,0,0,0,0|1,0,0]=3 589 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)Br)C 527a_100000174875_100000734913 [0,2,0,0,0,0|1,0,0]=3 590 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)C)C 11a_100000174908_100000734913 [0,2,0,0,0,0|1,0,0]=3 591 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)C)C 1626a_100000174908_100000734913 [0,2,0,0,0,0|1,0,0]=3 592 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)C)C 240690a_100000174908_100000734913 [0,2,0,0,0,0|1,0,0]=3 593 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)C)C 527a_100000174908_100000734913 [0,2,0,0,0,0|1,0,0]=3 594 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)Cl)C 11a_100000174871_100000734913 [0,2,0,0,0,0|1,0,0]=3 595 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)Cl)C 1626a_100000174871_100000734913 [0,2,0,0,0,0|1,0,0]=3 596 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)Cl)C 240690a_100000174871_100000734913 [0,2,0,0,0,0|1,0,0]=3 597 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)Cl)C 527a_100000174871_100000734913 [0,2,0,0,0,0|1,0,0]=3 598 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)F)C 11a_100000174882_100000734913 [0,2,0,0,0,0|1,0,0]=3 599 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)F)C 1626a_100000174882_100000734913 [0,2,0,0,0,0|1,0,0]=3 600 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)F)C 240690a_100000174882_100000734913 [0,2,0,0,0,0|1,0,0]=3 601 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)F)C 527a_100000174882_100000734913 [0,2,0,0,0,0|1,0,0]=3 602 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)I)C 11a_100016989417_100000734913 [0,2,0,0,0,0|1,0,0]=3 603 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)I)C 1626a_100016989417_100000734913 [0,2,0,0,0,0|1,0,0]=3 604 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)I)C 240690a_100016989417_100000734913 [0,2,0,0,0,0|1,0,0]=3 605 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)I)C 527a_100016989417_100000734913 [0,2,0,0,0,0|1,0,0]=3 606 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)O)C 240690a_100000185549_100000734913 [0,2,0,0,0,0|1,0,0]=3 607 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cc3)O)C 527a_100000185549_100000734913 [0,2,0,0,0,0|1,0,0]=3 608 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)Br)C 11a_100015188789_100000734913 [0,2,0,0,0,0|0,0,0]=2 609 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)Br)C 1626a_100015188789_100000734913 [0,2,0,0,0,0|0,0,0]=2 610 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)Br)C 240690a_100015188789_100000734913 [0,2,0,0,0,0|0,0,0]=2 611 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)Br)C 527a_100015188789_100000734913 [0,2,0,0,0,0|0,0,0]=2 612 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)C)C 11a_100015187455_100000734913 [0,2,0,0,0,0|0,0,0]=2 613 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)C)C 1626a_100015187455_100000734913 [0,2,0,0,0,0|0,0,0]=2 614 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)C)C 240690a_100015187455_100000734913 [0,2,0,0,0,0|0,0,0]=2 615 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)C)C 527a_100015187455_100000734913 [0,2,0,0,0,0|0,0,0]=2 616 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)Cl)C 11a_100000697193_100000734913 [0,2,0,0,0,0|0,0,0]=2 617 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)Cl)C 1626a_100000697193_100000734913 [0,2,0,0,0,0|0,0,0]=2 618 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)Cl)C 240690a_100000697193_100000734913 [0,2,0,0,0,0|0,0,0]=2 619 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)Cl)C 527a_100000697193_100000734913 [0,2,0,0,0,0|0,0,0]=2 620 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)F)C 11a_100020620131_100000734913 [0,2,0,0,0,0|0,0,0]=2 621 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)F)C 1626a_100020620131_100000734913 [0,2,0,0,0,0|0,0,0]=2 622 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)F)C 240690a_100020620131_100000734913 [0,2,0,0,0,0|0,0,0]=2 623 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)F)C 527a_100020620131_100000734913 [0,2,0,0,0,0|0,0,0]=2 624 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(cn3)O)C 240690a_100020605196_100000734913 [0,2,0,0,0,0|0,0,0]=2 625 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)Br)C 11a_100009817727_100000734913 [0,2,0,0,0,0|2,0,0]=4 626 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)Br)C 240690a_100009817727_100000734913 [0,2,0,0,0,0|2,0,0]=4 627 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)Br)C 527a_100009817727_100000734913 [0,2,0,0,0,0|2,0,0]=4 628 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)C)C 11a_100000740942_100000734913 [0,2,0,0,0,0|2,0,0]=4 629 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)C)C 1626a_100000740942_100000734913 [0,2,0,0,0,0|2,0,0]=4 630 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)C)C 240690a_100000740942_100000734913 [0,2,0,0,0,0|2,0,0]=4 631 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)C)C 527a_100000740942_100000734913 [0,2,0,0,0,0|2,0,0]=4 632 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)Cl)C 11a_100000735879_100000734913 [0,2,0,0,0,0|2,0,0]=4 633 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)Cl)C 1626a_100000735879_100000734913 [0,2,0,0,0,0|2,0,0]=4 634 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)Cl)C 240690a_100000735879_100000734913 [0,2,0,0,0,0|2,0,0]=4 635 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)Cl)C 527a_100000735879_100000734913 [0,2,0,0,0,0|2,0,0]=4 636 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)F)C 11a_100000101913_100000734913 [0,2,0,0,0,0|2,0,0]=4 637 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)F)C 1626a_100000101913_100000734913 [0,2,0,0,0,0|2,0,0]=4 638 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)F)C 240690a_100000101913_100000734913 [0,2,0,0,0,0|2,0,0]=4 639 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)F)C 527a_100000101913_100000734913 [0,2,0,0,0,0|2,0,0]=4 640 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)O)C 11a_100000757128_100000734913 [0,2,0,0,0,0|2,0,0]=4 641 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccc(nc3)O)C 240690a_100000757128_100000734913 [0,2,0,0,0,0|2,0,0]=4 642 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnc(cn3)C)C 11a_100132314150_100000734913 [0,2,0,0,0,0|1,0,0]=3 643 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnc(cn3)C)C 240690a_100132314150_100000734913 [0,2,0,0,0,0|1,0,0]=3 644 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnc(cn3)C)C 527a_100132314150_100000734913 [0,2,0,0,0,0|1,0,0]=3 645 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc(cn3)Br)C 11a_200016993442_100000734913 [0,2,0,0,0,0|1,0,0]=3 646 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc(cn3)Br)C 240690a_200016993442_100000734913 [0,2,0,0,0,0|1,0,0]=3 647 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc(cn3)Br)C 527a_200016993442_100000734913 [0,2,0,0,0,0|1,0,0]=3 648 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc(cn3)Cl)C 11a_200015186297_100000734913 [0,2,0,0,0,0|1,0,0]=3 649 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc(cn3)Cl)C 1626a_200015186297_100000734913 [0,2,0,0,0,0|1,0,0]=3 650 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc(cn3)Cl)C 240690a_200015186297_100000734913 [0,2,0,0,0,0|1,0,0]=3 651 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncc(cn3)Cl)C 527a_200015186297_100000734913 [0,2,0,0,0,0|1,0,0]=3 652 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cc3)Br)C 22a_100000735608_100000734913 [0,2,0,0,0,0|2,0,0]=4 653 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cc3)C)C 22a_100000683527_100000734913 [0,2,0,0,0,0|2,0,0]=4 654 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cc3)Cl)C 22a_100000683521_100000734913 [0,2,0,0,0,0|2,0,0]=4 655 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cc3)F)C 22a_100000728448_100000734913 [0,2,0,0,0,0|2,0,0]=4 656 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cc3)I)C 22a_100016988836_100000734913 [0,2,0,0,0,0|2,0,0]=4 657 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cn3)Br)C 22a_100000750576_100000734913 [0,2,0,0,0,0|1,0,0]=3 658 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cn3)C)C 22a_100000746693_100000734913 [0,2,0,0,0,0|1,0,0]=3 659 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cn3)Cl)C 22a_100011206499_100000734913 [0,2,0,0,0,0|1,0,0]=3 660 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cn3)F)C 22a_100000753838_100000734913 [0,2,0,0,0,0|1,0,0]=3 661 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(cn3)I)C 22a_100010221006_100000734913 [0,2,0,0,0,0|1,0,0]=3 662 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(nn3)Br)C 22a_100102525236_100000734913 [0,2,0,0,0,0|2,0,0]=4 663 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(nn3)C)C 22a_100000747182_100000734913 [0,2,0,0,0,0|2,0,0]=4 664 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccc(nn3)Cl)C 22a_100000182438_100000734913 [0,2,0,0,0,0|2,0,0]=4 665 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3cnc(cn3)Cl)C 22a_100000121042_100000734913 [0,2,0,0,0,0|2,0,0]=4 666 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncc(cn3)Br)C 22a_100011203108_100000734913 [0,2,0,0,0,0|2,0,0]=4 667 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncc(cn3)C)C 22a_100011824989_100000734913 [0,2,0,0,0,0|2,0,0]=4 668 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncc(cn3)Cl)C 22a_100012000172_100000734913 [0,2,0,0,0,0|2,0,0]=4 669 B29R3.5979112423 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncc(cn3)I)C 22a_100012357424_100000734913 [0,2,0,0,0,0|2,0,0]=4 670 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccccc3Br)C 1458a_100000734913_100012161201 [0,2,0,0,0,0|2,0,0]=4 671 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccccc3C)C 1458a_100000734913_100011713688 [0,2,0,0,0,0|2,0,0]=4 672 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccccc3Cl)C 1458a_100000734913_100011713703 [0,2,0,0,0,0|2,0,0]=4 673 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccccc3F)C 1458a_100000734913_100000720011 [0,2,0,0,0,0|2,0,0]=4 674 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)CCc3ccccc3O)C 1458a_100000734913_100000722297 [0,2,0,0,0,0|2,0,0]=4 675 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3Br)C 11a_100000689332_100000734913 [0,2,0,0,0,0|1,0,0]=3 676 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3Br)C 1626a_100000689332_100000734913 [0,2,0,0,0,0|1,0,0]=3 677 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3Br)C 240690a_100000689332_100000734913 [0,2,0,0,0,0|1,0,0]=3 678 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3Br)C 527a_100000689332_100000734913 [0,2,0,0,0,0|1,0,0]=3 679 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3C)C 11a_100000174972_100000734913 [0,2,0,0,0,0|1,0,0]=3 680 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3C)C 1626a_100000174972_100000734913 [0,2,0,0,0,0|1,0,0]=3 681 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3C)C 240690a_100000174972_100000734913 [0,2,0,0,0,0|1,0,0]=3 682 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3C)C 527a_100000174972_100000734913 [0,2,0,0,0,0|1,0,0]=3 683 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3Cl)C 11a_100000174879_100000734913 [0,2,0,0,0,0|1,0,0]=3 684 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3Cl)C 1626a_100000174879_100000734913 [0,2,0,0,0,0|1,0,0]=3 685 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3Cl)C 240690a_100000174879_100000734913 [0,2,0,0,0,0|1,0,0]=3 686 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3Cl)C 527a_100000174879_100000734913 [0,2,0,0,0,0|1,0,0]=3 687 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3F)C 11a_100000174869_100000734913 [0,2,0,0,0,0|1,0,0]=3 688 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3F)C 1626a_100000174869_100000734913 [0,2,0,0,0,0|1,0,0]=3 689 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3F)C 240690a_100000174869_100000734913 [0,2,0,0,0,0|1,0,0]=3 690 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3F)C 527a_100000174869_100000734913 [0,2,0,0,0,0|1,0,0]=3 691 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3I)C 11a_100015347259_100000734913 [0,2,0,0,0,0|1,0,0]=3 692 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3I)C 1626a_100015347259_100000734913 [0,2,0,0,0,0|1,0,0]=3 693 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3I)C 240690a_100015347259_100000734913 [0,2,0,0,0,0|1,0,0]=3 694 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3I)C 527a_100015347259_100000734913 [0,2,0,0,0,0|1,0,0]=3 695 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3O)C 240690a_100000185550_100000734913 [0,2,0,0,0,0|1,0,0]=3 696 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccccc3O)C 527a_100000185550_100000734913 [0,2,0,0,0,0|1,0,0]=3 697 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3Br)C 11a_100009818023_100000734913 [0,2,0,0,0,0|2,0,0]=4 698 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3Br)C 240690a_100009818023_100000734913 [0,2,0,0,0,0|2,0,0]=4 699 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3Br)C 527a_100009818023_100000734913 [0,2,0,0,0,0|2,0,0]=4 700 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3Cl)C 11a_100015189234_100000734913 [0,2,0,0,0,0|2,0,0]=4 701 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3Cl)C 1626a_100015189234_100000734913 [0,2,0,0,0,0|2,0,0]=4 702 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3Cl)C 240690a_100015189234_100000734913 [0,2,0,0,0,0|2,0,0]=4 703 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3Cl)C 527a_100015189234_100000734913 [0,2,0,0,0,0|2,0,0]=4 704 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3F)C 11a_100000724633_100000734913 [0,2,0,0,0,0|2,0,0]=4 705 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3F)C 1626a_100000724633_100000734913 [0,2,0,0,0,0|2,0,0]=4 706 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3F)C 240690a_100000724633_100000734913 [0,2,0,0,0,0|2,0,0]=4 707 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cccnc3F)C 527a_100000724633_100000734913 [0,2,0,0,0,0|2,0,0]=4 708 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3Br)C 11a_100020640021_100000734913 [0,2,0,0,0,0|2,0,0]=4 709 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3Br)C 240690a_100020640021_100000734913 [0,2,0,0,0,0|2,0,0]=4 710 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3Br)C 527a_100020640021_100000734913 [0,2,0,0,0,0|2,0,0]=4 711 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3C)C 11a_100000708811_100000734913 [0,2,0,0,0,0|2,0,0]=4 712 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3C)C 1626a_100000708811_100000734913 [0,2,0,0,0,0|2,0,0]=4 713 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3C)C 240690a_100000708811_100000734913 [0,2,0,0,0,0|2,0,0]=4 714 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3C)C 527a_100000708811_100000734913 [0,2,0,0,0,0|2,0,0]=4 715 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3F)C 11a_100011935246_100000734913 [0,2,0,0,0,0|2,0,0]=4 716 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3F)C 1626a_100011935246_100000734913 [0,2,0,0,0,0|2,0,0]=4 717 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3F)C 240690a_100011935246_100000734913 [0,2,0,0,0,0|2,0,0]=4 718 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ccncc3F)C 527a_100011935246_100000734913 [0,2,0,0,0,0|2,0,0]=4 719 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnccc3C)C 11a_100011997553_100000734913 [0,2,0,0,0,0|2,0,0]=4 720 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnccc3C)C 240690a_100011997553_100000734913 [0,2,0,0,0,0|2,0,0]=4 721 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3cnccc3C)C 527a_100011997553_100000734913 [0,2,0,0,0,0|2,0,0]=4 722 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3Br)C 11a_100020591323_100000734913 [0,2,0,0,0,0|0,0,0]=2 723 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3Br)C 240690a_100020591323_100000734913 [0,2,0,0,0,0|0,0,0]=2 724 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3Br)C 527a_100020591323_100000734913 [0,2,0,0,0,0|0,0,0]=2 725 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3C)C 11a_100011223789_100000734913 [0,2,0,0,0,0|0,0,0]=2 726 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3C)C 1626a_100011223789_100000734913 [0,2,0,0,0,0|0,0,0]=2 727 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3C)C 240690a_100011223789_100000734913 [0,2,0,0,0,0|0,0,0]=2 728 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3C)C 527a_100011223789_100000734913 [0,2,0,0,0,0|0,0,0]=2 729 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3Cl)C 11a_100015189233_100000734913 [0,2,0,0,0,0|0,0,0]=2 730 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3Cl)C 1626a_100015189233_100000734913 [0,2,0,0,0,0|0,0,0]=2 731 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3Cl)C 240690a_100015189233_100000734913 [0,2,0,0,0,0|0,0,0]=2 732 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3Cl)C 527a_100015189233_100000734913 [0,2,0,0,0,0|0,0,0]=2 733 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3F)C 11a_100000690088_100000734913 [0,2,0,0,0,0|0,0,0]=2 734 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3F)C 1626a_100000690088_100000734913 [0,2,0,0,0,0|0,0,0]=2 735 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3F)C 240690a_100000690088_100000734913 [0,2,0,0,0,0|0,0,0]=2 736 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3ncccc3F)C 527a_100000690088_100000734913 [0,2,0,0,0,0|0,0,0]=2 737 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccnc3C)C 11a_100020641712_100000734913 [0,2,0,0,0,0|1,0,0]=3 738 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccnc3C)C 240690a_100020641712_100000734913 [0,2,0,0,0,0|1,0,0]=3 739 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccnc3C)C 527a_100020641712_100000734913 [0,2,0,0,0,0|1,0,0]=3 740 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccnc3Cl)C 11a_100000729963_100000734913 [0,2,0,0,0,0|1,0,0]=3 741 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccnc3Cl)C 240690a_100000729963_100000734913 [0,2,0,0,0,0|1,0,0]=3 742 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NCc3nccnc3Cl)C 527a_100000729963_100000734913 [0,2,0,0,0,0|1,0,0]=3 743 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccccc3Br)C 22a_100000241748_100000734913 [0,2,0,0,0,0|2,0,0]=4 744 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccccc3C)C 22a_100000184220_100000734913 [0,2,0,0,0,0|2,0,0]=4 745 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccccc3Cl)C 22a_100000683529_100000734913 [0,2,0,0,0,0|2,0,0]=4 746 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccccc3F)C 22a_100000239246_100000734913 [0,2,0,0,0,0|2,0,0]=4 747 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ccccc3I)C 22a_100011218156_100000734913 [0,2,0,0,0,0|2,0,0]=4 748 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncccc3Br)C 22a_100011464834_100000734913 [0,2,0,0,0,0|1,0,0]=3 749 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncccc3C)C 22a_100000708268_100000734913 [0,2,0,0,0,0|1,0,0]=3 750 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncccc3Cl)C 22a_100000741667_100000734913 [0,2,0,0,0,0|1,0,0]=3 751 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncccc3F)C 22a_100000717775_100000734913 [0,2,0,0,0,0|1,0,0]=3 752 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncccc3I)C 22a_100010221029_100000734913 [0,2,0,0,0,0|1,0,0]=3 753 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3nccnc3Cl)C 22a_100000755098_100000734913 [0,2,0,0,0,0|2,0,0]=4 754 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncncc3C)C 22a_100000121387_100000734913 [0,2,0,0,0,0|2,0,0]=4 755 B29R3.5979123699 COc1ccc2c(c(c(=O)oc2c1)CCC(=O)NNc3ncncc3Cl)C 22a_100000709255_100000734913 [0,2,0,0,0,0|2,0,0]=4 756 B29R3.1382936435 COc1ccccc1CNC(=O)CSc2c(c3ccc(cc3oc2=O)O)C 62a_100000183343_200009996780 [0,2,0,0,0,0|2,0,0]=4 757 B27R4.423276437 Cc1c(c(=O)oc2c1ccc(c2)O)SCc3nc4cccnc4[nH]3 62a_100011549802_200009996780 [0,0,0,1,1,0|2,0,0]=4 758 B29R4.368039342 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)N3CCc4c3cccc4 62a_100000183021_200009996780 [0,0,0,1,0,1|2,0,0]=4 759 B25R3.3014079 C=C1c2ccccc2C(=O)N1CCC(=O)NCc3ccccn3 11a_100000210449_100000241004 [1,0,0,0,1,0|1,0,1]=4 760 B25R3.3014079 C=C1c2ccccc2C(=O)N1CCC(=O)NCc3ccccn3 1626a_100000210449_100000241004 [1,0,0,0,1,0|1,0,1]=4 761 B25R3.3014079 C=C1c2ccccc2C(=O)N1CCC(=O)NCc3ccccn3 240690a_100000210449_100000241004 [1,0,0,0,1,0|1,0,1]=4 762 B25R3.3014079 O=C(CCN1C(=O)c2ccccc2C1=O)NCc3ccccn3 11a_100000210449_100000180851 [1,0,0,0,1,0|2,0,0]=4 763 B25R3.3014079 O=C(CCN1C(=O)c2ccccc2C1=O)NCc3ccccn3 1626a_100000210449_100000180851 [1,0,0,0,1,0|2,0,0]=4 764 B25R3.3014079 O=C(CCN1C(=O)c2ccccc2C1=O)NCc3ccccn3 240690a_100000210449_100000180851 [1,0,0,0,1,0|2,0,0]=4 765 B25R3.3014079 O=C(CCN1C(=O)c2ccccc2C1=O)NCc3ccccn3 527a_100000210449_100000180851 [1,0,0,0,1,0|2,0,0]=4 766 B25R3.3579235 Cc1nc2ccccc2c(c1CC(=O)NCc3ccccn3)C 11a_100000210449_100000683000 [1,0,0,0,1,0|2,0,0]=4 767 B25R3.3579235 Cc1nc2ccccc2c(c1CC(=O)NCc3ccccn3)C 1626a_100000210449_100000683000 [1,0,0,0,1,0|2,0,0]=4 768 B25R3.3579235 Cc1nc2ccccc2c(c1CC(=O)NCc3ccccn3)C 240690a_100000210449_100000683000 [1,0,0,0,1,0|2,0,0]=4 769 B25R3.3579235 Cc1nc2ccccc2c(c1CC(=O)NCc3ccccn3)C 527a_100000210449_100000683000 [1,0,0,0,1,0|2,0,0]=4 770 B25R3.3604704 O=C(CSc1c(c2ccccc2oc1=O)O)Nc3ccccn3 62a_100020662008_100009994742 [1,0,0,0,1,0|2,0,0]=4 771 B25R3.2629180 O=C(CCn1c(=O)oc2c1ccc(c2)Cl)NCc3ccccn3 11a_100000210449_100000018480 [1,0,0,0,1,0|2,0,0]=4 772 B25R3.2629180 O=C(CCn1c(=O)oc2c1ccc(c2)Cl)NCc3ccccn3 1626a_100000210449_100000018480 [1,0,0,0,1,0|2,0,0]=4 773 B25R3.2629180 O=C(CCn1c(=O)oc2c1ccc(c2)Cl)NCc3ccccn3 240690a_100000210449_100000018480 [1,0,0,0,1,0|2,0,0]=4 774 B25R3.2629180 O=C(CCn1c(=O)oc2c1ccc(c2)Cl)NCc3ccccn3 527a_100000210449_100000018480 [1,0,0,0,1,0|2,0,0]=4 775 B25R3.28653695 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)c3ccccc3 62a_100000211460_200009996780 [0,0,0,0,2,0|2,0,0]=4 776 B25R3.28653695 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)c3ccccn3 62a_100000027445_200009996780 [0,0,0,0,2,0|1,0,0]=3 777 B25R3.28653695 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)c3ncccn3 62a_100020636365_200009996780 [0,0,0,0,2,0|2,0,0]=4 778 B25R3.212530555 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)Cc3ccccc3 1458a_100000721692_100015291786 [0,0,0,0,2,0|1,0,0]=3 779 B25R3.212530555 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)Cc3ccccn3 1458a_100000721692_100000721315 [0,0,0,0,2,0|0,0,0]=2 780 B25R3.212530555 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)Cc3cccnc3 1458a_100000721692_100000733263 [0,0,0,0,2,0|2,0,0]=4 781 B25R3.212530555 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)Cc3cccnn3 1458a_100000721692_100016990269 [0,0,0,0,2,0|1,0,0]=3 782 B25R3.212530555 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)Cc3ccncc3 1458a_100000721692_100000705612 [0,0,0,0,2,0|2,0,0]=4 783 B25R3.212530555 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)Cc3cnccn3 1458a_100000721692_100016995436 [0,0,0,0,2,0|1,0,0]=3 784 B25R3.212530555 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)Cc3ncccn3 1458a_100000721692_100000703007 [0,0,0,0,2,0|1,0,0]=3 785 B25R3.212530555 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)Nc3ccccc3 22a_100000106764_100000721692 [0,0,0,0,2,0|1,0,0]=3 786 B25R3.680070244 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3ccon3 62a_100000239699_200009996780 [0,0,0,0,2,0|2,0,0]=4 787 B25R3.680070244 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)Nc3nccs3 62a_100000183294_200009996780 [0,0,0,0,2,0|2,0,0]=4 788 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3c[nH]cn3 1458a_100000721692_100020628418 [0,0,0,0,2,0|2,0,0]=4 789 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCc3cccs3 1458a_100000721692_100000748579 [0,0,0,0,2,0|2,0,0]=4 790 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCn3cccc3 1458a_100000721692_200000035178 [0,0,0,0,2,0|2,0,0]=4 791 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)CCn3cccn3 1458a_100000721692_100000685285 [0,0,0,0,2,0|2,0,0]=4 792 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3c[nH]cn3 240690a_100000758547_100000721692 [0,0,0,0,2,0|1,0,0]=3 793 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3c[nH]nn3 240690a_100020620823_100000721692 [0,0,0,0,2,0|2,0,0]=4 794 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cc[nH]n3 240690a_100000739516_100000721692 [0,0,0,0,2,0|1,0,0]=3 795 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccc[nH]3 240690a_100000764082_100000721692 [0,0,0,0,2,0|0,0,1]=3 796 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccco3 240690a_100000185738_100000721692 [0,0,0,0,2,0|1,0,0]=3 797 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cccs3 240690a_100000211653_100000721692 [0,0,0,0,2,0|1,0,0]=3 798 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccoc3 240690a_100015206860_100000721692 [0,0,0,0,2,0|1,0,0]=3 799 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccon3 240690a_100000688301_100000721692 [0,0,0,0,2,0|1,0,0]=3 800 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ccsc3 240690a_100000186416_100000721692 [0,0,0,0,2,0|1,0,0]=3 801 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cn[nH]c3 240690a_100000737208_100000721692 [0,0,0,0,2,0|2,0,0]=4 802 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cnco3 240690a_100020634212_100000721692 [0,0,0,0,2,0|2,0,0]=4 803 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cncs3 240690a_100016987365_100000721692 [0,0,0,0,2,0|2,0,0]=4 804 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cnoc3 240690a_100016995009_100000721692 [0,0,0,0,2,0|2,0,0]=4 805 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cocn3 240690a_100015188801_100000721692 [0,0,0,0,2,0|1,0,0]=3 806 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3cscn3 240690a_100015185402_100000721692 [0,0,0,0,2,0|1,0,0]=3 807 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ncc[nH]3 240690a_100000754540_100000721692 [0,0,0,0,2,0|1,0,0]=3 808 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3ncco3 240690a_100016994969_100000721692 [0,0,0,0,2,0|1,0,0]=3 809 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3nccs3 240690a_100000740555_100000721692 [0,0,0,0,2,0|1,0,0]=3 810 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NCc3nnc[nH]3 240690a_200015183720_100000721692 [0,0,0,0,2,0|2,0,0]=4 811 B25R3.680073900 Cc1c(c(=O)oc2c1ccc(c2)O)CC(=O)NNc3nccs3 22a_100011198208_100000721692 [0,0,0,0,2,0|2,0,0]=4 812 B27R3.725907648 Cc1c(c(=O)oc2c1ccc(c2)O)SCCC(=O)NCc3ccco3 62a_200011194439_200009996780 [0,0,0,0,1,1|1,0,0]=3 813 B29R3.438681347 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NC/C=C/c3ccccc3 62a_100102863107_200009996780 [0,0,0,0,0,2|2,0,0]=4 814 B29R3.438681347 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCCCc3ccccc3 62a_100000182878_200009996780 [0,0,0,0,0,2|2,0,0]=4 815 B29R3.438681347 Cc1c(c(=O)oc2c1ccc(c2)O)SCC(=O)NCCOc3ccccc3 62a_100000181728_200009996780 [0,0,0,0,0,2|2,0,0]=4 816 B29R3.438682357 Cc1c(c(=O)oc2c1ccc(c2)O)SCCCC(=O)OCc3ccccc3 62a_100009813218_200009996780 [0,0,0,0,0,2|2,0,0]=4 817 B29R3.438682357 Cc1c(c(=O)oc2c1ccc(c2)O)SCCNC(=O)OCc3ccccc3 62a_100012357035_200009996780 [0,0,0,0,0,2|2,0,0]=4