0 B31R3.2915166843 CCCCC(NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O)C(=O)OC AIFCHEM-95384254866 [0,1,0,0,0,0|1,0,2]=4 1 B31R3.2915166843 CCCC[C@@H](NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O)C(=O)OC AIFCHEM-96766633996 [0,1,0,0,0,0|1,0,2]=4 2 B31R3.2915166843 CCCC[C@H](NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O)C(=O)OC AIFCHEM-98369716018 [0,1,0,0,0,0|1,0,2]=4 3 B31R3.2915166843 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O AIFCHEM-99450421585 [0,1,0,0,0,0|0,0,2]=3 4 B31R3.2915166843 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccnc3O AIFCHEM-53166010748 [0,1,0,0,0,0|1,0,2]=4 5 B31R3.2915166843 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccncc3O AIFCHEM-53165909930 [0,1,0,0,0,0|1,0,2]=4 6 B31R3.2915166843 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ncccc3O AIFCHEM-53165915214 [0,1,0,0,0,0|1,0,2]=4 7 B31R3.2915166843 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O AIFCHEM-94625464435 [0,1,0,0,0,0|0,0,2]=3 8 B31R3.2915166843 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccnc3O AIFCHEM-58611254455 [0,1,0,0,0,0|1,0,2]=4 9 B31R3.2915166843 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccncc3O AIFCHEM-58611153637 [0,1,0,0,0,0|1,0,2]=4 10 B31R3.2915166843 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ncccc3O AIFCHEM-58611158921 [0,1,0,0,0,0|1,0,2]=4 11 B31R3.2915166843 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O AIFCHEM-99647138694 [0,1,0,0,0,0|0,0,2]=3 12 B31R3.2915166843 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccnc3O AIFCHEM-57084043131 [0,1,0,0,0,0|1,0,2]=4 13 B31R3.2915166843 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccncc3O AIFCHEM-57083942313 [0,1,0,0,0,0|1,0,2]=4 14 B31R3.2915166843 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ncccc3O AIFCHEM-57083947597 [0,1,0,0,0,0|1,0,2]=4 15 B29R3.1458931310 CCCCC(NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3)C(=O)OC AIFCHEM-95384163888 [0,0,0,0,1,0|3,0,0]=4 16 B29R3.1458931310 CCCC[C@@H](NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3)C(=O)OC AIFCHEM-96766579938 [0,0,0,0,1,0|3,0,0]=4 17 B29R3.1458931310 CCCC[C@H](NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3)C(=O)OC AIFCHEM-98369670120 [0,0,0,0,1,0|3,0,0]=4 18 B29R3.1458931310 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3 AIFCHEM-99450323527 [0,0,0,0,1,0|2,0,0]=3 19 B29R3.1458931310 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccnc3 AIFCHEM-99450389287 [0,0,0,0,1,0|3,0,0]=4 20 B29R3.1458931310 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccncc3 AIFCHEM-99450392725 [0,0,0,0,1,0|3,0,0]=4 21 B29R3.1458931310 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3 AIFCHEM-94625418537 [0,0,0,0,1,0|2,0,0]=3 22 B29R3.1458931310 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccnc3 AIFCHEM-94625449557 [0,0,0,0,1,0|3,0,0]=4 23 B29R3.1458931310 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccncc3 AIFCHEM-94625451175 [0,0,0,0,1,0|3,0,0]=4 24 B29R3.1458931310 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3 AIFCHEM-99646916996 [0,0,0,0,1,0|2,0,0]=3 25 B29R3.1458931310 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccnc3 AIFCHEM-99647066796 [0,0,0,0,1,0|3,0,0]=4 26 B29R3.1458931310 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccncc3 AIFCHEM-99647074554 [0,0,0,0,1,0|3,0,0]=4 27 B29R3.3050035913 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccco3 AIFCHEM-99450351095 [0,0,0,0,1,0|1,0,2]=4 28 B29R3.3050035913 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccco3 AIFCHEM-94625431525 [0,0,0,0,1,0|1,0,2]=4 29 B29R3.3050035913 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccco3 AIFCHEM-99646980024 [0,0,0,0,1,0|1,0,2]=4 30 B31R3.44638324 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccn3 AIFCHEM-99450435194 [0,0,0,0,0,1|1,0,2]=4 31 B31R3.44638324 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3cccnc3 AIFCHEM-53165892554 [0,0,0,0,0,1|1,0,2]=4 32 B31R3.44638324 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccncc3 AIFCHEM-53165979544 [0,0,0,0,0,1|1,0,2]=4 33 B31R3.44638324 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccn3 AIFCHEM-94625471704 [0,0,0,0,0,1|1,0,2]=4 34 B31R3.44638324 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3cccnc3 AIFCHEM-58611136261 [0,0,0,0,0,1|1,0,2]=4 35 B31R3.44638324 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccncc3 AIFCHEM-58611223251 [0,0,0,0,0,1|1,0,2]=4 36 B31R3.44638324 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccn3 AIFCHEM-99647174763 [0,0,0,0,0,1|1,0,2]=4 37 B31R3.44638324 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3cccnc3 AIFCHEM-57083924937 [0,0,0,0,0,1|1,0,2]=4 38 B31R3.44638324 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccncc3 AIFCHEM-57084011927 [0,0,0,0,0,1|1,0,2]=4 39 B31R3.2915167508 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)C=Cc3ccccc3 AIFCHEM-99450306487 [0,0,0,0,0,1|2,0,1]=4 40 B31R3.2915167508 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)C=Cc3ccccc3 AIFCHEM-94625410477 [0,0,0,0,0,1|2,0,1]=4 41 B31R3.2915167508 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)C=Cc3ccccc3 AIFCHEM-99646882996 [0,0,0,0,0,1|2,0,1]=4 42 B28R2.13540613 COC(=O)C(CCSC)NC(=O)c1cccc(c1)N(C)Cc2ccccn2 AIFCHEM-99450343413 [1,0,1,0,0,0|1,0,1]=4 43 B28R2.13540613 COC(=O)[C@@H](CCSC)NC(=O)c1cccc(c1)N(C)Cc2ccccn2 AIFCHEM-94625427963 [1,0,1,0,0,0|1,0,1]=4 44 B28R2.13540613 COC(=O)[C@H](CCSC)NC(=O)c1cccc(c1)N(C)Cc2ccccn2 AIFCHEM-99646962522 [1,0,1,0,0,0|1,0,1]=4 45 B30R2.13429806 COC(=O)C(CCSC)NC(=O)c1ccc(cc1)NC(=O)OCc2ccccc2 AIFCHEM-5957547874 [0,1,1,0,0,0|2,0,0]=4 46 B30R2.13429806 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(cc1)NC(=O)OCc2ccccc2 AIFCHEM-6264732568 [0,1,1,0,0,0|2,0,0]=4 47 B30R2.13429806 COC(=O)[C@H](CCSC)NC(=O)c1ccc(cc1)NC(=O)OCc2ccccc2 AIFCHEM-6201891470 [0,1,1,0,0,0|2,0,0]=4 48 B30R2.277390068 CC=Cc1ccc(cc1OCc2ccccc2)C(=O)NC(CCCC)C(=O)OC AIFCHEM-59254888061 [0,1,1,0,0,0|2,0,0]=4 49 B30R2.277390068 CC=Cc1ccc(cc1OCc2ccccc2)C(=O)NC(CCSC)C(=O)OC AIFCHEM-53165886124 [0,1,1,0,0,0|1,0,0]=3 50 B30R2.277390068 CC=Cc1ccc(cc1OCc2ccccc2)C(=O)N[C@@H](CCCC)C(=O)OC AIFCHEM-55882822968 [0,1,1,0,0,0|2,0,0]=4 51 B30R2.277390068 CC=Cc1ccc(cc1OCc2ccccc2)C(=O)N[C@@H](CCSC)C(=O)OC AIFCHEM-57083918507 [0,1,1,0,0,0|1,0,0]=3 52 B30R2.277390068 CC=Cc1ccc(cc1OCc2ccccc2)C(=O)N[C@H](CCCC)C(=O)OC AIFCHEM-57891102180 [0,1,1,0,0,0|2,0,0]=4 53 B30R2.277390068 CC=Cc1ccc(cc1OCc2ccccc2)C(=O)N[C@H](CCSC)C(=O)OC AIFCHEM-58611129831 [0,1,1,0,0,0|1,0,0]=3 54 B30R3.2749902682 CCCC(NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O)C(=O)OC AIFCHEM-96285897602 [1,1,0,0,0,0|0,0,2]=4 55 B30R3.2749902682 CCC[C@H](NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O)C(=O)OC AIFCHEM-96777918056 [1,1,0,0,0,0|0,0,2]=4 56 B30R3.2749902682 COC(=O)[C@H](CSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccccc3O AIFCHEM-96114498536 [1,1,0,0,0,0|0,0,2]=4 57 B30R3.1598622624 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)C AIFCHEM-99450414836 [0,1,0,0,1,0|2,0,0]=4 58 B30R3.1598622624 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)F AIFCHEM-99450395525 [0,1,0,0,1,0|2,0,0]=4 59 B30R3.1598622624 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)O AIFCHEM-99450342578 [0,1,0,0,1,0|2,0,0]=4 60 B30R3.1598622624 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)C AIFCHEM-94625461526 [0,1,0,0,1,0|2,0,0]=4 61 B30R3.1598622624 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)F AIFCHEM-94625452495 [0,1,0,0,1,0|2,0,0]=4 62 B30R3.1598622624 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)O AIFCHEM-94625427528 [0,1,0,0,1,0|2,0,0]=4 63 B30R3.1598622624 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)C AIFCHEM-99647124525 [0,1,0,0,1,0|2,0,0]=4 64 B30R3.1598622624 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)F AIFCHEM-99647080834 [0,1,0,0,1,0|2,0,0]=4 65 B30R3.1598622624 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccc(cc3)O AIFCHEM-99646960147 [0,1,0,0,1,0|2,0,0]=4 66 B30R3.1598622632 CCOC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3 AIFCHEM-94804592664 [0,1,0,0,1,0|2,0,0]=4 67 B30R3.1598622632 CCOC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3 AIFCHEM-97794413338 [0,1,0,0,1,0|2,0,0]=4 68 B30R3.3641153569 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)C AIFCHEM-99450363970 [0,1,0,0,1,0|2,0,0]=4 69 B30R3.3641153569 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)F AIFCHEM-99450423282 [0,1,0,0,1,0|2,0,0]=4 70 B30R3.3641153569 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)O AIFCHEM-99450404983 [0,1,0,0,1,0|2,0,0]=4 71 B30R3.3641153569 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)C AIFCHEM-94625437860 [0,1,0,0,1,0|2,0,0]=4 72 B30R3.3641153569 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)F AIFCHEM-94625465312 [0,1,0,0,1,0|2,0,0]=4 73 B30R3.3641153569 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)O AIFCHEM-94625456933 [0,1,0,0,1,0|2,0,0]=4 74 B30R3.3641153569 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)C AIFCHEM-99647010399 [0,1,0,0,1,0|2,0,0]=4 75 B30R3.3641153569 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)F AIFCHEM-99647143071 [0,1,0,0,1,0|2,0,0]=4 76 B30R3.3641153569 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3cccc(c3)O AIFCHEM-99647102132 [0,1,0,0,1,0|2,0,0]=4 77 B30R3.3641153735 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3C AIFCHEM-99450375337 [0,1,0,0,1,0|2,0,0]=4 78 B30R3.3641153735 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3F AIFCHEM-99450388949 [0,1,0,0,1,0|2,0,0]=4 79 B30R3.3641153735 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3O AIFCHEM-99450323399 [0,1,0,0,1,0|2,0,0]=4 80 B30R3.3641153735 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3C AIFCHEM-94625443247 [0,1,0,0,1,0|2,0,0]=4 81 B30R3.3641153735 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3F AIFCHEM-94625449379 [0,1,0,0,1,0|2,0,0]=4 82 B30R3.3641153735 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3O AIFCHEM-94625418469 [0,1,0,0,1,0|2,0,0]=4 83 B30R3.3641153735 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3C AIFCHEM-99647035686 [0,1,0,0,1,0|2,0,0]=4 84 B30R3.3641153735 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3F AIFCHEM-99647065978 [0,1,0,0,1,0|2,0,0]=4 85 B30R3.3641153735 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3O AIFCHEM-99646916748 [0,1,0,0,1,0|2,0,0]=4 86 B32R3.332545527 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccc3C AIFCHEM-68056857155 [0,1,0,0,0,1|0,0,2]=4 87 B32R3.332545527 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccc3O AIFCHEM-99450358964 [0,1,0,0,0,1|0,0,2]=4 88 B32R3.332545527 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccc3C AIFCHEM-75950862870 [0,1,0,0,0,1|0,0,2]=4 89 B32R3.332545527 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccc3O AIFCHEM-94625435374 [0,1,0,0,0,1|0,0,2]=4 90 B32R3.332545527 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccc3C AIFCHEM-70879732373 [0,1,0,0,0,1|0,0,2]=4 91 B32R3.332545527 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccccc3O AIFCHEM-99646998753 [0,1,0,0,0,1|0,0,2]=4 92 B32R3.332546221 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)C AIFCHEM-68056859739 [0,1,0,0,0,1|0,0,2]=4 93 B32R3.332546221 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)Cl AIFCHEM-80862038869 [0,1,0,0,0,1|0,0,2]=4 94 B32R3.332546221 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)F AIFCHEM-99450410194 [0,1,0,0,0,1|0,0,2]=4 95 B32R3.332546221 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)C AIFCHEM-75950865454 [0,1,0,0,0,1|0,0,2]=4 96 B32R3.332546221 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)Cl AIFCHEM-88342684151 [0,1,0,0,0,1|0,0,2]=4 97 B32R3.332546221 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)F AIFCHEM-94625459424 [0,1,0,0,0,1|0,0,2]=4 98 B32R3.332546221 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)C AIFCHEM-70879734957 [0,1,0,0,0,1|0,0,2]=4 99 B32R3.332546221 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)Cl AIFCHEM-83143702599 [0,1,0,0,0,1|0,0,2]=4 100 B32R3.332546221 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)F AIFCHEM-99647114423 [0,1,0,0,0,1|0,0,2]=4 101 B32R3.332546221 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3ccc(cc3)O AIFCHEM-70879733339 [0,1,0,0,0,1|0,0,2]=4 102 B32R3.1445650594 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3cccc(c3)C AIFCHEM-68056861899 [0,1,0,0,0,1|0,0,2]=4 103 B32R3.1445650594 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3cccc(c3)C AIFCHEM-75950867614 [0,1,0,0,0,1|0,0,2]=4 104 B32R3.1445650594 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)CN(CC2)Cc3cccc(c3)C AIFCHEM-70879737117 [0,1,0,0,0,1|0,0,2]=4 105 B32R3.5555388401 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)C AIFCHEM-68056858246 [0,2,0,0,0,0|0,0,2]=4 106 B32R3.5555388401 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)Cl AIFCHEM-80862015968 [0,2,0,0,0,0|0,0,2]=4 107 B32R3.5555388401 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)F AIFCHEM-80862064806 [0,2,0,0,0,0|0,0,2]=4 108 B32R3.5555388401 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)O AIFCHEM-80861787503 [0,2,0,0,0,0|0,0,2]=4 109 B32R3.5555388401 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)C AIFCHEM-75950863961 [0,2,0,0,0,0|0,0,2]=4 110 B32R3.5555388401 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)Cl AIFCHEM-88342657110 [0,2,0,0,0,0|0,0,2]=4 111 B32R3.5555388401 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)F AIFCHEM-88342726988 [0,2,0,0,0,0|0,0,2]=4 112 B32R3.5555388401 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)O AIFCHEM-88342485865 [0,2,0,0,0,0|0,0,2]=4 113 B32R3.5555388401 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)C AIFCHEM-70879733464 [0,2,0,0,0,0|0,0,2]=4 114 B32R3.5555388401 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)Cl AIFCHEM-83143687998 [0,2,0,0,0,0|0,0,2]=4 115 B32R3.5555388401 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)F AIFCHEM-83143734116 [0,2,0,0,0,0|0,0,2]=4 116 B32R3.5555388401 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3ccc(cc3O)O AIFCHEM-83143588713 [0,2,0,0,0,0|0,0,2]=4 117 B32R3.5555388418 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)C AIFCHEM-68056852634 [0,2,0,0,0,0|0,0,2]=4 118 B32R3.5555388418 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)Cl AIFCHEM-80861919477 [0,2,0,0,0,0|0,0,2]=4 119 B32R3.5555388418 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)F AIFCHEM-80861960618 [0,2,0,0,0,0|0,0,2]=4 120 B32R3.5555388418 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)C AIFCHEM-75950858349 [0,2,0,0,0,0|0,0,2]=4 121 B32R3.5555388418 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)Cl AIFCHEM-88342573159 [0,2,0,0,0,0|0,0,2]=4 122 B32R3.5555388418 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)F AIFCHEM-88342603800 [0,2,0,0,0,0|0,0,2]=4 123 B32R3.5555388418 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)C AIFCHEM-70879727852 [0,2,0,0,0,0|0,0,2]=4 124 B32R3.5555388418 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)Cl AIFCHEM-83143640987 [0,2,0,0,0,0|0,0,2]=4 125 B32R3.5555388418 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3O)F AIFCHEM-83143658888 [0,2,0,0,0,0|0,0,2]=4 126 B32R3.5555388423 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3)OC AIFCHEM-99450412431 [0,2,0,0,0,0|0,0,2]=4 127 B32R3.5555388423 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3)OC AIFCHEM-94625460321 [0,2,0,0,0,0|0,0,2]=4 128 B32R3.5555388423 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)Cc3cccc(c3)OC AIFCHEM-99647118880 [0,2,0,0,0,0|0,0,2]=4 129 B30R3.47543208 COC(=O)C(CCSC)NC(=O)c1ccc(cc1)c2cccc3c2cccc3 AIFCHEM-99450315170 [0,0,1,1,0,0|1,0,1]=4 130 B30R3.47543208 COC(=O)C(CCSC)NC(=O)c1ccc(cc1)c2ccnc3c2cccc3 AIFCHEM-37533990999 [0,0,1,1,0,0|2,0,0]=4 131 B30R3.47543208 COC(=O)C(CCSC)NC(=O)c1ccc(cc1)c2cncc3c2cccc3 AIFCHEM-37533999925 [0,0,1,1,0,0|0,0,2]=4 132 B30R3.47543208 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(cc1)c2cccc3c2cccc3 AIFCHEM-94625414620 [0,0,1,1,0,0|1,0,1]=4 133 B30R3.47543208 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(cc1)c2ccnc3c2cccc3 AIFCHEM-38120733293 [0,0,1,1,0,0|2,0,0]=4 134 B30R3.47543208 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(cc1)c2cncc3c2cccc3 AIFCHEM-38120750199 [0,0,1,1,0,0|0,0,2]=4 135 B30R3.47543208 COC(=O)[C@H](CCSC)NC(=O)c1ccc(cc1)c2cccc3c2cccc3 AIFCHEM-99646898279 [0,0,1,1,0,0|1,0,1]=4 136 B30R3.47543208 COC(=O)[C@H](CCSC)NC(=O)c1ccc(cc1)c2ccnc3c2cccc3 AIFCHEM-38507203063 [0,0,1,1,0,0|2,0,0]=4 137 B30R3.47543208 COC(=O)[C@H](CCSC)NC(=O)c1ccc(cc1)c2cncc3c2cccc3 AIFCHEM-38507211989 [0,0,1,1,0,0|0,0,2]=4 138 B30R3.47554281 COC(=O)C(CCSC)NC(=O)c1cccc(c1)c2ccc3ccccc3c2 AIFCHEM-99450329380 [0,0,1,1,0,0|1,0,1]=4 139 B30R3.47554281 COC(=O)[C@@H](CCSC)NC(=O)c1cccc(c1)c2ccc3ccccc3c2 AIFCHEM-94625421290 [0,0,1,1,0,0|1,0,1]=4 140 B30R3.47554281 COC(=O)[C@H](CCSC)NC(=O)c1cccc(c1)c2ccc3ccccc3c2 AIFCHEM-99646930269 [0,0,1,1,0,0|1,0,1]=4 141 B30R3.47571143 COC(=O)C(CCSC)NC(=O)c1ccc(c(c1)C2=Cc3ccccc3C2)C AIFCHEM-80861856403 [0,0,1,1,0,0|1,0,1]=4 142 B30R3.47571143 COC(=O)C(CCSC)NC(=O)c1ccc(c(c1)C2=Cc3ccccc3C2)O AIFCHEM-53165892773 [0,0,1,1,0,0|2,0,0]=4 143 B30R3.47571143 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(c(c1)C2=Cc3ccccc3C2)C AIFCHEM-88342530665 [0,0,1,1,0,0|1,0,1]=4 144 B30R3.47571143 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(c(c1)C2=Cc3ccccc3C2)O AIFCHEM-58611136480 [0,0,1,1,0,0|2,0,0]=4 145 B30R3.47571143 COC(=O)[C@H](CCSC)NC(=O)c1ccc(c(c1)C2=Cc3ccccc3C2)C AIFCHEM-83143615493 [0,0,1,1,0,0|1,0,1]=4 146 B30R3.47571143 COC(=O)[C@H](CCSC)NC(=O)c1ccc(c(c1)C2=Cc3ccccc3C2)O AIFCHEM-57083925156 [0,0,1,1,0,0|2,0,0]=4 147 B28R2.13529349 CCCCC(NC(=O)c1ccc(cc1)C=CCc2ccccc2)C(=O)OC AIFCHEM-87134562930 [0,0,1,0,1,0|1,0,0]=3 148 B28R2.13529349 CCCCC(NC(=O)c1ccc(nc1)C=CCc2ccccc2)C(=O)OC AIFCHEM-37414934963 [0,0,1,0,1,0|2,0,0]=4 149 B28R2.13529349 CCCC[C@@H](NC(=O)c1ccc(cc1)C=CCc2ccccc2)C(=O)OC AIFCHEM-84053172140 [0,0,1,0,1,0|1,0,0]=3 150 B28R2.13529349 CCCC[C@@H](NC(=O)c1ccc(nc1)C=CCc2ccccc2)C(=O)OC AIFCHEM-38158467515 [0,0,1,0,1,0|2,0,0]=4 151 B28R2.13529349 CCCC[C@H](NC(=O)c1ccc(cc1)C=CCc2ccccc2)C(=O)OC AIFCHEM-82011427400 [0,0,1,0,1,0|1,0,0]=3 152 B28R2.13529349 CCCC[C@H](NC(=O)c1ccc(nc1)C=CCc2ccccc2)C(=O)OC AIFCHEM-37842377046 [0,0,1,0,1,0|2,0,0]=4 153 B28R2.13529349 COC(=O)C(CCSC)NC(=O)c1ccc(cc1)C=CCc2ccccc2 AIFCHEM-80861828893 [0,0,1,0,1,0|0,0,0]=2 154 B28R2.13529349 COC(=O)C(CCSC)NC(=O)c1ccc(nc1)C=CCc2ccccc2 AIFCHEM-37533968867 [0,0,1,0,1,0|1,0,0]=3 155 B28R2.13529349 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(cc1)C=CCc2ccccc2 AIFCHEM-88342511975 [0,0,1,0,1,0|0,0,0]=2 156 B28R2.13529349 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(nc1)C=CCc2ccccc2 AIFCHEM-38120690481 [0,0,1,0,1,0|1,0,0]=3 157 B28R2.13529349 COC(=O)[C@H](CCSC)NC(=O)c1ccc(cc1)C=CCc2ccccc2 AIFCHEM-83143604243 [0,0,1,0,1,0|0,0,0]=2 158 B28R2.13529349 COC(=O)[C@H](CCSC)NC(=O)c1ccc(nc1)C=CCc2ccccc2 AIFCHEM-38507180931 [0,0,1,0,1,0|1,0,0]=3 159 B28R3.131058444 CCCC(NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3)C(=O)OC AIFCHEM-96285846704 [1,0,0,0,1,0|2,0,0]=4 160 B28R3.131058444 CCC[C@H](NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3)C(=O)OC AIFCHEM-96777872158 [1,0,0,0,1,0|2,0,0]=4 161 B28R3.131058444 COC(=O)[C@H](CSC)NC(=O)c1ccc2[nH]cc(c2c1)c3ccccc3 AIFCHEM-96114407558 [1,0,0,0,1,0|2,0,0]=4 162 B30R2.13464957 COC(=O)C(CCSC)NC(=O)c1ccc(c(c1)CN(C)Cc2ccccc2)C AIFCHEM-99450336273 [0,0,1,0,0,1|0,0,2]=4 163 B30R2.13464957 COC(=O)C(CCSC)NC(=O)c1ccc(c(c1)CN(C)Cc2ccccc2)F AIFCHEM-99450419203 [0,0,1,0,0,1|1,0,1]=4 164 B30R2.13464957 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(c(c1)CN(C)Cc2ccccc2)C AIFCHEM-94625424543 [0,0,1,0,0,1|0,0,2]=4 165 B30R2.13464957 COC(=O)[C@@H](CCSC)NC(=O)c1ccc(c(c1)CN(C)Cc2ccccc2)F AIFCHEM-94625463433 [0,0,1,0,0,1|1,0,1]=4 166 B30R2.13464957 COC(=O)[C@H](CCSC)NC(=O)c1ccc(c(c1)CN(C)Cc2ccccc2)C AIFCHEM-99646945882 [0,0,1,0,0,1|0,0,2]=4 167 B30R2.13464957 COC(=O)[C@H](CCSC)NC(=O)c1ccc(c(c1)CN(C)Cc2ccccc2)F AIFCHEM-99647133852 [0,0,1,0,0,1|1,0,1]=4 168 B32R3.2792675472 COC(=O)C(CCSC)NC(=O)c1ccc2[nH]cc(c2c1)C=CCc3ccccc3 AIFCHEM-99450329440 [0,0,0,0,0,2|2,0,0]=4 169 B32R3.2792675472 COC(=O)C(CCSC)NC(=O)c1ccc2c(c1)N(CC2)CCCc3ccccc3 AIFCHEM-68056876758 [0,0,0,0,0,2|0,0,2]=4 170 B32R3.2792675472 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)C=CCc3ccccc3 AIFCHEM-94625421330 [0,0,0,0,0,2|2,0,0]=4 171 B32R3.2792675472 COC(=O)[C@@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)CCCc3ccccc3 AIFCHEM-75950882473 [0,0,0,0,0,2|0,0,2]=4 172 B32R3.2792675472 COC(=O)[C@H](CCSC)NC(=O)c1ccc2[nH]cc(c2c1)C=CCc3ccccc3 AIFCHEM-99646930429 [0,0,0,0,0,2|2,0,0]=4 173 B32R3.2792675472 COC(=O)[C@H](CCSC)NC(=O)c1ccc2c(c1)N(CC2)CCCc3ccccc3 AIFCHEM-70879751976 [0,0,0,0,0,2|0,0,2]=4