0 B28R4.4770991 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3)c4ccccc4 34a_100015182855_100015291786 [1,0,0,0,0,0|0,0,2]=3 1 B28R4.4770991 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3)c4ccccc4 7a_100015182855_100000211182 [1,0,0,0,0,0|0,0,2]=3 2 B28R4.4770991 O=C1CC(Oc2c1ccc(c2)OCc3ccccn3)c4ccccc4 34a_100015182855_100000721315 [1,0,0,0,0,0|1,0,2]=4 3 B28R4.4770991 O=C1CC(Oc2c1ccc(c2)OCc3ccccn3)c4ccccc4 7a_100015182855_100000721315 [1,0,0,0,0,0|1,0,2]=4 4 B28R4.4770991 O=C1CC(Oc2c1ccc(c2)OCc3cccnc3)c4ccccc4 34a_100015182855_100000733263 [1,0,0,0,0,0|1,0,2]=4 5 B28R4.4770991 O=C1CC(Oc2c1ccc(c2)OCc3cccnc3)c4ccccc4 7a_100015182855_100000741622 [1,0,0,0,0,0|1,0,2]=4 6 B28R4.4770991 O=C1CC(Oc2c1ccc(c2)OCc3ccncc3)c4ccccc4 7a_100015182855_100015193705 [1,0,0,0,0,0|1,0,2]=4 7 B28R4.4770991 O=c1cc(oc2c1ccc(c2)OCc3ccccc3)c4ccccc4 7a_100000064283_100000211182 [1,0,0,0,0,0|0,0,0]=1 8 B28R4.4770991 O=c1cc(oc2c1ccc(c2)OCc3ccccn3)c4ccccc4 7a_100000064283_100000721315 [1,0,0,0,0,0|1,0,0]=2 9 B28R4.4770991 O=c1cc(oc2c1ccc(c2)OCc3cccnc3)c4ccccc4 7a_100000064283_100000741622 [1,0,0,0,0,0|1,0,0]=2 10 B28R4.4770991 O=c1cc(oc2c1ccc(c2)OCc3cccnn3)c4ccccc4 7a_100000064283_100016990269 [1,0,0,0,0,0|2,0,0]=3 11 B28R4.4770991 O=c1cc(oc2c1ccc(c2)OCc3ccncc3)c4ccccc4 7a_100000064283_100015193705 [1,0,0,0,0,0|1,0,0]=2 12 B28R4.4770991 O=c1cc(oc2c1ccc(c2)OCc3cnccn3)c4ccccc4 7a_100000064283_100016995436 [1,0,0,0,0,0|2,0,0]=3 13 B28R4.4770991 O=c1cc(oc2c1ccc(c2)OCc3cncnc3)c4ccccc4 7a_100000064283_100015196519 [1,0,0,0,0,0|2,0,0]=3 14 B28R4.4770991 O=c1cc(oc2c1ccc(c2)OCc3ncccn3)c4ccccc4 7a_100000064283_100000703007 [1,0,0,0,0,0|2,0,0]=3 15 B30R4.71954892 COc1cc(cc2c1c(=O)cc(o2)c3ccccc3)OCc4ccccc4 7a_100028334905_200000210301 [0,1,0,0,0,0|0,0,0]=1 16 B30R4.71954892 [13CH3]Oc1cc(cc2c1c(=O)cc(o2)c3ccccc3)OCc4ccccc4 7a_100028334905_200025704644 [0,1,0,0,0,0|0,0,0]=1 17 B28R3.3080607 CC(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3 1458a_100010003681_100000756946 [0,0,1,0,0,0|1,0,2]=4 18 B28R3.3080607 C[C@@H](NC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3 527a_100000751104_100010003681 [0,0,1,0,0,0|2,0,1]=4 19 B28R3.3080607 Cc1cc(ccc1C(=O)CC(=O)c2ccccc2)OCc3ccccc3 1458a_200012339692_100000211460 [0,0,1,0,0,0|1,0,2]=4 20 B28R3.3080607 Cc1cc(ccc1C(=O)CC(O)c2ccccc2)OCc3ccccc3 1458a_200012339692_100000185958 [0,0,1,0,0,0|1,0,2]=4 21 B28R3.3080607 Cc1cc(ccc1C(=O)C[C@@H](O)c2ccccc2)OCc3ccccc3 1458a_200012339692_100011933945 [0,0,1,0,0,0|1,0,2]=4 22 B28R3.3080607 O=C(CC(=O)c1ccc(cc1F)OCc2ccccc2)c3ccccc3 1458a_100011830236_100000211460 [0,0,1,0,0,0|1,0,2]=4 23 B28R3.3080607 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3 1458a_100010003681_100000211460 [0,0,1,0,0,0|0,0,2]=3 24 B28R3.3080607 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccn3 1458a_100010003681_100000027445 [0,0,1,0,0,0|1,0,2]=4 25 B28R3.3080607 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3cccnc3 1458a_100010003681_100015188593 [0,0,1,0,0,0|1,0,2]=4 26 B28R3.3080607 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccncc3 1458a_100010003681_100000027454 [0,0,1,0,0,0|1,0,2]=4 27 B28R3.3080607 O=C(CC(O)c1ccccc1)c2ccc(cc2F)OCc3ccccc3 1458a_100011830236_100000185958 [0,0,1,0,0,0|1,0,2]=4 28 B28R3.3080607 O=C(CC(O)c1ccccc1)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000185958 [0,0,1,0,0,0|0,0,2]=3 29 B28R3.3080607 O=C(C[C@@H](O)c1ccccc1)c2ccc(cc2F)OCc3ccccc3 1458a_100011830236_100011933945 [0,0,1,0,0,0|1,0,2]=4 30 B28R3.3080607 O=C(C[C@@H](O)c1ccccc1)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100011933945 [0,0,1,0,0,0|0,0,2]=3 31 B28R3.1360647168 C/C=C/CC(=O)COc1cc(c2c(=O)cc(oc2c1)c3ccccc3)O 1458a_200020592037_100102629194 [0,0,1,0,0,0|1,0,2]=4 32 B28R3.1360647168 C=CCCC(=O)COc1cc(c2c(=O)cc(oc2c1)c3ccccc3)O 1458a_200020592037_100000754431 [0,0,1,0,0,0|1,0,2]=4 33 B28R3.1360647168 C=CCNC(=O)COc1cc(c2c(=O)cc(oc2c1)c3ccccc3)O 240690a_100020586998_200020592037 [0,0,1,0,0,0|2,0,1]=4 34 B28R3.1360647168 CC=CCC(=O)COc1cc(c2c(=O)cc(oc2c1)c3ccccc3)O 1458a_200020592037_100000070051 [0,0,1,0,0,0|1,0,2]=4 35 B27R3.2823347 O=C(CCc1ccccc1)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000765856 [1,0,1,0,0,0|0,0,2]=4 36 B27R3.2823347 O=C(NCc1ccccc1)c2ccc(cc2O)OCc3ccccc3 527a_100015324214_100010003681 [1,0,1,0,0,0|1,0,1]=4 37 B27R3.2823347 O=C(NNc1ccccc1)c2ccc(cc2O)OCc3ccccc3 22a_100015195140_100010003681 [1,0,1,0,0,0|2,0,0]=4 38 B27R3.2830811 O=C(CC(=O)c1ccc(cc1)OCc2ccccc2)c3ccccc3 1458a_100000182985_100000211460 [1,0,1,0,0,0|0,0,2]=4 39 B27R3.2830811 O=C(CC(=O)c1ccc(cc1)OCc2ccccc2)c3ccccc3 1458a_100000185807_100000753179 [1,0,1,0,0,0|0,0,2]=4 40 B27R3.2830811 O=C(CC(O)c1ccccc1)c2ccc(cc2)OCc3ccccc3 1458a_100000182985_100000185958 [1,0,1,0,0,0|0,0,2]=4 41 B27R3.2830811 O=C(C[C@@H](O)c1ccccc1)c2ccc(cc2)OCc3ccccc3 1458a_100000182985_100011933945 [1,0,1,0,0,0|0,0,2]=4 42 B27R3.43664509 CC(=O)c1ccc(cc1OCc2ccccc2)OCc3ccccc3 34a_100000014571_100015291786 [1,0,1,0,0,0|0,0,2]=4 43 B27R3.43664509 CC(=O)c1ccc(cc1OCc2ccccc2)OCc3ccccc3 7a_100000014571_100000211182 [1,0,1,0,0,0|0,0,2]=4 44 B27R3.1177046224 C=CCC(=O)COc1cc(c2c(=O)cc(oc2c1)c3ccccc3)O 1458a_200020592037_100000210623 [1,0,1,0,0,0|1,0,1]=4 45 B29R3.3309674 CC(C(=O)c1ccccc1)C(=O)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000239700 [0,1,1,0,0,0|0,0,2]=4 46 B29R3.3425360 Cc1ccc(cc1)C(=O)CC(=O)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000211441 [0,1,1,0,0,0|0,0,2]=4 47 B29R3.3425360 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccc(cc3)Br 1458a_100010003681_100000188085 [0,1,1,0,0,0|0,0,2]=4 48 B29R3.3425360 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccc(cc3)Cl 1458a_100010003681_100000211071 [0,1,1,0,0,0|0,0,2]=4 49 B29R3.3425360 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccc(cc3)F 1458a_100010003681_100000211279 [0,1,1,0,0,0|0,0,2]=4 50 B29R3.3425360 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccc(cc3)I 1458a_100010003681_100011216261 [0,1,1,0,0,0|0,0,2]=4 51 B29R3.3425360 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccc(cc3)O 1458a_100010003681_100009814261 [0,1,1,0,0,0|0,0,2]=4 52 B29R3.3425360 O=C(CC(O)c1ccc(cc1)Cl)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_200011996143 [0,1,1,0,0,0|0,0,2]=4 53 B29R3.3425360 O=C(C[C@H](O)c1ccc(cc1)F)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000720402 [0,1,1,0,0,0|0,0,2]=4 54 B29R3.3548573 Cc1cccc(c1)C(=O)CC(=O)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000739480 [0,1,1,0,0,0|0,0,2]=4 55 B29R3.3548573 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3cccc(c3)Br 1458a_100010003681_100000212080 [0,1,1,0,0,0|0,0,2]=4 56 B29R3.3548573 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3cccc(c3)Cl 1458a_100010003681_100000211444 [0,1,1,0,0,0|0,0,2]=4 57 B29R3.3548573 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3cccc(c3)F 1458a_100010003681_100000215616 [0,1,1,0,0,0|0,0,2]=4 58 B29R3.3548573 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3cccc(c3)O 1458a_100010003681_100009813753 [0,1,1,0,0,0|0,0,2]=4 59 B29R3.5048200 Cc1ccccc1C(=O)CC(=O)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000741374 [0,1,1,0,0,0|0,0,2]=4 60 B29R3.5048200 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3O 1458a_100010003681_100000188908 [0,1,1,0,0,0|0,0,2]=4 61 B29R3.5048200 O=C(CC(=O)c1ccccc1Br)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000199116 [0,1,1,0,0,0|0,0,2]=4 62 B29R3.5048200 O=C(CC(=O)c1ccccc1Cl)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000211432 [0,1,1,0,0,0|0,0,2]=4 63 B29R3.5048200 O=C(CC(=O)c1ccccc1F)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000204681 [0,1,1,0,0,0|0,0,2]=4 64 B29R3.7328668 O=C(N[C@H](CO)c1ccccc1)c2ccc(cc2O)OCc3ccccc3 527a_100000751927_100010003681 [0,1,1,0,0,0|1,0,1]=4 65 B29R3.6805272 CC(=O)c1c(cc(cc1OCc2ccccc2)OCc3ccccc3)O[13CH3] 7a_100010194296_200025704644 [0,1,1,0,0,0|0,0,2]=4 66 B29R3.6805272 COc1cc(cc(c1C(=O)C)OCc2ccccc2)OCc3ccccc3 7a_100010194296_200000210301 [0,1,1,0,0,0|0,0,2]=4 67 B29R3.6805272 COc1cc(cc(c1C(=O)C)OCc2ccccc2)OCc3ccccc3 7a_200010219158_100000211182 [0,1,1,0,0,0|0,0,2]=4 68 B29R4.5790853 CC(Oc1ccc2c(=O)cc(oc2c1)c3ccccc3)c4ccccc4 7a_100000064283_100000230085 [1,1,0,0,0,0|0,0,0]=2 69 B29R4.5790853 CC(Oc1ccc2c(=O)cc(oc2c1)c3ccccc3)c4cnccn4 7a_100000064283_200000703233 [1,1,0,0,0,0|2,0,0]=4 70 B29R4.5790853 CC(Oc1ccc2c(c1)OC(CC2=O)c3ccccc3)c4ccccc4 34a_100015182855_100000211855 [1,1,0,0,0,0|0,0,2]=4 71 B29R4.5790853 CC(Oc1ccc2c(c1)OC(CC2=O)c3ccccc3)c4ccccc4 7a_100015182855_100000230085 [1,1,0,0,0,0|0,0,2]=4 72 B29R4.8351754 Cc1ccc(cc1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000210814 [1,1,0,0,0,0|0,0,0]=2 73 B29R4.8351754 Cc1ccc(cc1)COc2ccc3c(c2)OC(CC3=O)c4ccccc4 34a_100015182855_100000210814 [1,1,0,0,0,0|0,0,2]=4 74 B29R4.8351754 Cc1ccc(cc1)COc2ccc3c(c2)OC(CC3=O)c4ccccc4 7a_100015182855_100000210814 [1,1,0,0,0,0|0,0,2]=4 75 B29R4.8351754 Cc1ccc(cn1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100016987292 [1,1,0,0,0,0|1,0,0]=3 76 B29R4.8351754 Cc1ccc(nc1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000691093 [1,1,0,0,0,0|1,0,0]=3 77 B29R4.8351754 Cc1cnc(cn1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000752025 [1,1,0,0,0,0|2,0,0]=4 78 B29R4.8351754 Cc1cnc(nc1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000685645 [1,1,0,0,0,0|2,0,0]=4 79 B29R4.8351754 O=C1CC(Oc2c1ccc(c2)OCc3ccc(cc3)Br)c4ccccc4 34a_100015182855_100000189115 [1,1,0,0,0,0|0,0,2]=4 80 B29R4.8351754 O=C1CC(Oc2c1ccc(c2)OCc3ccc(cc3)Br)c4ccccc4 7a_100015182855_100011217064 [1,1,0,0,0,0|0,0,2]=4 81 B29R4.8351754 O=C1CC(Oc2c1ccc(c2)OCc3ccc(cc3)Cl)c4ccccc4 34a_100015182855_100000694040 [1,1,0,0,0,0|0,0,2]=4 82 B29R4.8351754 O=C1CC(Oc2c1ccc(c2)OCc3ccc(cc3)Cl)c4ccccc4 7a_100015182855_100000187161 [1,1,0,0,0,0|0,0,2]=4 83 B29R4.8351754 O=C1CC(Oc2c1ccc(c2)OCc3ccc(cc3)F)c4ccccc4 34a_100015182855_100000198546 [1,1,0,0,0,0|0,0,2]=4 84 B29R4.8351754 O=C1CC(Oc2c1ccc(c2)OCc3ccc(cc3)F)c4ccccc4 7a_100015182855_100000198546 [1,1,0,0,0,0|0,0,2]=4 85 B29R4.8351754 O=C1CC(Oc2c1ccc(c2)OCc3ccc(cc3)I)c4ccccc4 34a_100015182855_100000189116 [1,1,0,0,0,0|0,0,2]=4 86 B29R4.8351754 O=C1CC(Oc2c1ccc(c2)OCc3ccc(cc3)I)c4ccccc4 7a_100015182855_100000189116 [1,1,0,0,0,0|0,0,2]=4 87 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(cc3)Br)c4ccccc4 7a_100000064283_100011217064 [1,1,0,0,0,0|0,0,0]=2 88 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(cc3)Cl)c4ccccc4 7a_100000064283_100000187161 [1,1,0,0,0,0|0,0,0]=2 89 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(cc3)F)c4ccccc4 7a_100000064283_100000198546 [1,1,0,0,0,0|0,0,0]=2 90 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(cc3)I)c4ccccc4 7a_100000064283_100000189116 [1,1,0,0,0,0|0,0,0]=2 91 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(cn3)Br)c4ccccc4 7a_100000064283_100000702658 [1,1,0,0,0,0|1,0,0]=3 92 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(cn3)Cl)c4ccccc4 7a_100000064283_100012066911 [1,1,0,0,0,0|1,0,0]=3 93 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(cn3)F)c4ccccc4 7a_100000064283_100000703193 [1,1,0,0,0,0|1,0,0]=3 94 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(nc3)Br)c4ccccc4 7a_100000064283_100009831999 [1,1,0,0,0,0|1,0,0]=3 95 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(nc3)Cl)c4ccccc4 7a_100000064283_100000735431 [1,1,0,0,0,0|1,0,0]=3 96 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(nc3)F)c4ccccc4 7a_100000064283_100009820150 [1,1,0,0,0,0|1,0,0]=3 97 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ccc(nn3)Cl)c4ccccc4 7a_100000064283_100016992710 [1,1,0,0,0,0|2,0,0]=4 98 B29R4.8351754 O=c1cc(oc2c1ccc(c2)OCc3ncc(cn3)Br)c4ccccc4 7a_100000064283_100010064664 [1,1,0,0,0,0|2,0,0]=4 99 B29R4.36067631 Cc1ccccc1COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000211839 [1,1,0,0,0,0|0,0,0]=2 100 B29R4.36067631 Cc1ccccc1COc2ccc3c(c2)OC(CC3=O)c4ccccc4 34a_100015182855_100000211839 [1,1,0,0,0,0|0,0,2]=4 101 B29R4.36067631 Cc1ccccc1COc2ccc3c(c2)OC(CC3=O)c4ccccc4 7a_100015182855_100000211839 [1,1,0,0,0,0|0,0,2]=4 102 B29R4.36067631 Cc1cccnc1COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000696600 [1,1,0,0,0,0|1,0,0]=3 103 B29R4.36067631 Cc1ccncc1COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000690890 [1,1,0,0,0,0|1,0,0]=3 104 B29R4.36067631 Cc1cnccc1COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100020672808 [1,1,0,0,0,0|1,0,0]=3 105 B29R4.36067631 Cc1ncccc1COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000732876 [1,1,0,0,0,0|1,0,0]=3 106 B29R4.36067631 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3Br)c4ccccc4 34a_100015182855_100000184730 [1,1,0,0,0,0|0,0,2]=4 107 B29R4.36067631 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3Br)c4ccccc4 7a_100015182855_100000184730 [1,1,0,0,0,0|0,0,2]=4 108 B29R4.36067631 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3Cl)c4ccccc4 34a_100015182855_100000187162 [1,1,0,0,0,0|0,0,2]=4 109 B29R4.36067631 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3Cl)c4ccccc4 7a_100015182855_100000187162 [1,1,0,0,0,0|0,0,2]=4 110 B29R4.36067631 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3F)c4ccccc4 34a_100015182855_100000211605 [1,1,0,0,0,0|0,0,2]=4 111 B29R4.36067631 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3F)c4ccccc4 7a_100015182855_100000211605 [1,1,0,0,0,0|0,0,2]=4 112 B29R4.36067631 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3I)c4ccccc4 34a_100015182855_100011215278 [1,1,0,0,0,0|0,0,2]=4 113 B29R4.36067631 O=C1CC(Oc2c1ccc(c2)OCc3ccccc3I)c4ccccc4 7a_100015182855_100011215278 [1,1,0,0,0,0|0,0,2]=4 114 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ccccc3Br)c4ccccc4 7a_100000064283_100000184730 [1,1,0,0,0,0|0,0,0]=2 115 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ccccc3Cl)c4ccccc4 7a_100000064283_100000187162 [1,1,0,0,0,0|0,0,0]=2 116 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ccccc3F)c4ccccc4 7a_100000064283_100000211605 [1,1,0,0,0,0|0,0,0]=2 117 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ccccc3I)c4ccccc4 7a_100000064283_100011215278 [1,1,0,0,0,0|0,0,0]=2 118 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3cccnc3Br)c4ccccc4 7a_100000064283_100010140945 [1,1,0,0,0,0|1,0,0]=3 119 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3cccnc3Cl)c4ccccc4 7a_100000064283_100000045678 [1,1,0,0,0,0|1,0,0]=3 120 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3cccnc3F)c4ccccc4 7a_100000064283_100000099810 [1,1,0,0,0,0|1,0,0]=3 121 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ccncc3Cl)c4ccccc4 7a_100000064283_100000763264 [1,1,0,0,0,0|1,0,0]=3 122 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ncccc3Br)c4ccccc4 7a_100000064283_100025702911 [1,1,0,0,0,0|1,0,0]=3 123 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ncccc3Cl)c4ccccc4 7a_100000064283_100000099807 [1,1,0,0,0,0|1,0,0]=3 124 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ncccc3F)c4ccccc4 7a_100000064283_100000104219 [1,1,0,0,0,0|1,0,0]=3 125 B29R4.36067631 O=c1cc(oc2c1ccc(c2)OCc3ncccc3O)c4ccccc4 7a_100000064283_200020655725 [1,1,0,0,0,0|1,0,0]=3 126 B29R4.57517935 Cc1cc(ccn1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_200020672517 [1,1,0,0,0,0|1,0,0]=3 127 B29R4.57517935 Cc1cccc(c1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000211840 [1,1,0,0,0,0|0,0,0]=2 128 B29R4.57517935 Cc1cccc(c1)COc2ccc3c(c2)OC(CC3=O)c4ccccc4 34a_100015182855_100000211840 [1,1,0,0,0,0|0,0,2]=4 129 B29R4.57517935 Cc1cccc(c1)COc2ccc3c(c2)OC(CC3=O)c4ccccc4 7a_100015182855_100000211840 [1,1,0,0,0,0|0,0,2]=4 130 B29R4.57517935 Cc1cccc(n1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000757606 [1,1,0,0,0,0|1,0,0]=3 131 B29R4.57517935 Cc1ccnc(c1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000718516 [1,1,0,0,0,0|1,0,0]=3 132 B29R4.57517935 Cc1cncc(c1)COc2ccc3c(=O)cc(oc3c2)c4ccccc4 7a_100000064283_100000716715 [1,1,0,0,0,0|1,0,0]=3 133 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)Br)c4ccccc4 34a_100015182855_100000698116 [1,1,0,0,0,0|0,0,2]=4 134 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)Br)c4ccccc4 7a_100015182855_100000211773 [1,1,0,0,0,0|0,0,2]=4 135 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)Cl)c4ccccc4 34a_100015182855_100000187163 [1,1,0,0,0,0|0,0,2]=4 136 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)Cl)c4ccccc4 7a_100015182855_100000187163 [1,1,0,0,0,0|0,0,2]=4 137 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)F)c4ccccc4 34a_100015182855_100000187166 [1,1,0,0,0,0|0,0,2]=4 138 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)F)c4ccccc4 7a_100015182855_100000230114 [1,1,0,0,0,0|0,0,2]=4 139 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)I)c4ccccc4 34a_100015182855_100011218688 [1,1,0,0,0,0|0,0,2]=4 140 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)I)c4ccccc4 7a_100015182855_100011218688 [1,1,0,0,0,0|0,0,2]=4 141 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)O)c4ccccc4 34a_100015182855_100011660834 [1,1,0,0,0,0|0,0,2]=4 142 B29R4.57517935 O=C1CC(Oc2c1ccc(c2)OCc3cccc(c3)O)c4ccccc4 7a_100015182855_100000084143 [1,1,0,0,0,0|0,0,2]=4 143 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cc(ccn3)Br)c4ccccc4 7a_100000064283_100010173614 [1,1,0,0,0,0|1,0,0]=3 144 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cc(ccn3)Cl)c4ccccc4 7a_100000064283_100016988179 [1,1,0,0,0,0|1,0,0]=3 145 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cccc(c3)Br)c4ccccc4 7a_100000064283_100000211773 [1,1,0,0,0,0|0,0,0]=2 146 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cccc(c3)Cl)c4ccccc4 7a_100000064283_100000187163 [1,1,0,0,0,0|0,0,0]=2 147 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cccc(c3)F)c4ccccc4 7a_100000064283_100000230114 [1,1,0,0,0,0|0,0,0]=2 148 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cccc(c3)I)c4ccccc4 7a_100000064283_100011218688 [1,1,0,0,0,0|0,0,0]=2 149 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cccc(c3)O)c4ccccc4 7a_100000064283_100000084143 [1,1,0,0,0,0|0,0,0]=2 150 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cccc(n3)Br)c4ccccc4 7a_100000064283_100009889011 [1,1,0,0,0,0|1,0,0]=3 151 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cccc(n3)Cl)c4ccccc4 7a_100000064283_100000086093 [1,1,0,0,0,0|1,0,0]=3 152 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cccc(n3)F)c4ccccc4 7a_100000064283_100009819644 [1,1,0,0,0,0|1,0,0]=3 153 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3ccnc(c3)Br)c4ccccc4 7a_100000064283_100010254460 [1,1,0,0,0,0|1,0,0]=3 154 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3ccnc(c3)Cl)c4ccccc4 7a_100000064283_100000764220 [1,1,0,0,0,0|1,0,0]=3 155 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3ccnc(n3)Cl)c4ccccc4 7a_100000064283_100000099655 [1,1,0,0,0,0|2,0,0]=4 156 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cncc(c3)Br)c4ccccc4 7a_100000064283_100000738771 [1,1,0,0,0,0|1,0,0]=3 157 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cncc(c3)Cl)c4ccccc4 7a_100000064283_100016992070 [1,1,0,0,0,0|1,0,0]=3 158 B29R4.57517935 O=c1cc(oc2c1ccc(c2)OCc3cncc(c3)F)c4ccccc4 7a_100000064283_100000725299 [1,1,0,0,0,0|1,0,0]=3 159 B31R4.305882284 CCOc1cc(cc2c1c(=O)cc(o2)c3ccccc3)OCc4ccccc4 7a_100028334905_100000210202 [0,2,0,0,0,0|0,0,0]=2 160 B31R4.305882284 CNCc1cc(cc2c1c(=O)cc(o2)c3ccccc3)OCc4ccccc4 26a_100102657272_100028334905 [0,2,0,0,0,0|1,0,0]=3 161 B31R4.305882284 O=c1cc(oc2c1c(cc(c2)OCc3ccccc3)OCF)c4ccccc4 7a_100028334905_100015361967 [0,2,0,0,0,0|0,0,0]=2 162 B29R4.24154904 Oc1cc(cc2c1cccc2)c3ccc(cc3F)OCc4ccccc4 271570a_100011218370_100010089979 [0,0,1,1,0,0|2,0,0]=4 163 B27R3.40166310 CC(C(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3 1458a_100010003681_100000230085 [0,0,1,0,1,0|1,0,1]=4 164 B27R3.40166310 CN(C(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3 22a_100000210012_100010003681 [0,0,1,0,1,0|2,0,0]=4 165 B27R4.26999317 O=c1cc(oc2c1ccc(c2)OCc3ccn[nH]3)c4ccccc4 7a_100000064283_100000728653 [1,0,0,0,1,0|2,0,0]=4 166 B27R4.26999317 O=c1cc(oc2c1ccc(c2)OCc3ccon3)c4ccccc4 7a_100000064283_100000234950 [1,0,0,0,1,0|2,0,0]=4 167 B27R4.26999317 O=c1cc(oc2c1ccc(c2)OCc3ccsc3)c4ccccc4 7a_100000064283_100011261437 [1,0,0,0,1,0|1,0,0]=3 168 B27R4.26999317 O=c1cc(oc2c1ccc(c2)OCc3cncs3)c4ccccc4 7a_100000064283_100015185245 [1,0,0,0,1,0|2,0,0]=4 169 B27R4.26999317 O=c1cc(oc2c1ccc(c2)OCc3cscn3)c4ccccc4 7a_100000064283_100000205941 [1,0,0,0,1,0|2,0,0]=4 170 B27R4.26999317 O=c1cc(oc2c1ccc(c2)OCc3ncc[nH]3)c4ccccc4 7a_100000064283_100000753453 [1,0,0,0,1,0|2,0,0]=4 171 B27R4.26999317 O=c1cc(oc2c1ccc(c2)OCc3ncco3)c4ccccc4 7a_100000064283_103436540062 [1,0,0,0,1,0|2,0,0]=4 172 B27R4.26999317 O=c1cc(oc2c1ccc(c2)OCc3nccs3)c4ccccc4 7a_100000064283_100015184050 [1,0,0,0,1,0|2,0,0]=4 173 B29R3.3307354 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)Cc3ccccc3 1458a_100010003681_100000233483 [0,0,1,0,0,1|0,0,2]=4 174 B29R3.3307354 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)Nc3ccccc3 1458a_100010003681_100000182850 [0,0,1,0,0,1|0,0,2]=4 175 B29R3.3307354 O=C(CC(=O)c1ccc(cc1O)OCc2ccccc2)Oc3ccccc3 1458a_100010003681_100009813826 [0,0,1,0,0,1|0,0,2]=4 176 B29R3.3308747 O=C(CCC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3 1458a_100010003681_100000750707 [0,0,1,0,0,1|0,0,2]=4 177 B29R3.3308747 O=C(CC[C@@H](O)c1ccccc1)c2ccc(cc2O)OCc3ccccc3 1458a_100010003681_100000729684 [0,0,1,0,0,1|0,0,2]=4 178 B29R3.3308747 O=C(NCC(O)c1ccccc1)c2ccc(cc2O)OCc3ccccc3 527a_100000210709_100010003681 [0,0,1,0,0,1|0,0,2]=4 179 B29R3.3308747 O=C(NNC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3 22a_100000184135_100010003681 [0,0,1,0,0,1|1,0,1]=4 180 B29R3.3308747 O=C(OCC(=O)c1ccc(cc1O)OCc2ccccc2)c3ccccc3 1458a_100010003681_100000073877 [0,0,1,0,0,1|0,0,2]=4 181 B29R3.76258914 CC(=CC(=O)Nc1ccc(cc1C)OCc2ccccc2)c3ccccc3 11a_100011193937_100000743005 [0,0,1,0,0,1|2,0,0]=4 182 B29R3.76258914 CC(=CC(=O)Nc1ccc(cc1C)OCc2ccccc2)c3ccccc3 1626a_100011193937_100000743005 [0,0,1,0,0,1|2,0,0]=4 183 B29R3.76258914 CC(=CC(=O)Nc1ccc(cc1C)OCc2ccccc2)c3ccccc3 22a_100011193937_100000743005 [0,0,1,0,0,1|2,0,0]=4 184 B29R3.76258914 CC(=CC(=O)Nc1ccc(cc1C)OCc2ccccc2)c3ccccc3 527a_100011193937_100000743005 [0,0,1,0,0,1|2,0,0]=4 185 B29R4.5790854 O=C1CC(Oc2c1ccc(c2)OCCc3ccccc3)c4ccccc4 34a_100015182855_100000765856 [1,0,0,0,0,1|0,0,2]=4 186 B29R4.5790854 O=C1CC(Oc2c1ccc(c2)OCCc3ccccc3)c4ccccc4 7a_100015182855_100000765856 [1,0,0,0,0,1|0,0,2]=4 187 B29R4.5790854 O=c1cc(oc2c1ccc(c2)OCCc3ccccc3)c4ccccc4 7a_100000064283_100000765856 [1,0,0,0,0,1|0,0,0]=2 188 B29R4.5790854 O=c1cc(oc2c1ccc(c2)OCCc3ccccn3)c4ccccc4 7a_100000064283_100015183660 [1,0,0,0,0,1|1,0,0]=3 189 B29R4.5790854 O=c1cc(oc2c1ccc(c2)OCCc3cccnc3)c4ccccc4 7a_100000064283_200011713674 [1,0,0,0,0,1|1,0,0]=3 190 B29R4.5790854 O=c1cc(oc2c1ccc(c2)OCCc3ccncc3)c4ccccc4 7a_100000064283_100000723409 [1,0,0,0,0,1|1,0,0]=3