0 B15R1.499 C=C(C)CNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000748629 [0,0,0,0,0,0|4,0,0]=4 1 B15R1.499 C=C(C)CNc1ccc(cc1)CC(=O)N 34a_100000738315_100000748629 [0,0,0,0,0,0|4,0,0]=4 2 B15R1.499 C=C(C)CNc1ccc(cc1)NC(=O)C 34a_100000184111_100000748629 [0,0,0,0,0,0|3,0,0]=3 3 B15R1.499 C=C(C)CNc1ccc(cc1)OC(C)C 2230a_100011194259_100000748629 [0,0,0,0,0,0|3,0,1]=4 4 B15R1.499 C=C(C)CNc1ccc(cc1)OC(C)C 34a_100011194259_100000748629 [0,0,0,0,0,0|3,0,1]=4 5 B15R1.499 C=C(C)COc1ccc(cc1)CC(=O)C 34a_100011218180_100000748629 [0,0,0,0,0,0|3,0,0]=3 6 B15R1.499 C=C(C)COc1ccc(cc1)CC(=O)C 7a_100011218180_100000748629 [0,0,0,0,0,0|3,0,0]=3 7 B15R1.499 C=C(C)COc1ccc(cc1)CC(=O)N 34a_100000020825_100000748629 [0,0,0,0,0,0|4,0,0]=4 8 B15R1.499 C=C(C)COc1ccc(cc1)NC(=O)C 11a_200015186533_100015343762 [0,0,0,0,0,0|3,0,0]=3 9 B15R1.499 C=C(C)COc1ccc(cc1)NC(=O)C 1626a_200015186533_100015343762 [0,0,0,0,0,0|3,0,0]=3 10 B15R1.499 C=C(C)COc1ccc(cc1)NC(=O)C 22a_200015186533_100000070787 [0,0,0,0,0,0|3,0,0]=3 11 B15R1.499 C=C(C)COc1ccc(cc1)NC(=O)C 34a_100000184395_100000748629 [0,0,0,0,0,0|3,0,0]=3 12 B15R1.499 C=C(C)COc1ccc(cc1)NC(=O)C 527a_200015186533_100103153847 [0,0,0,0,0,0|3,0,0]=3 13 B15R1.499 C=C(C)COc1ccc(cc1)NC(=O)C 7a_100000184395_100000748629 [0,0,0,0,0,0|3,0,0]=3 14 B15R1.499 C=C(C)COc1ccc(cc1)OC(C)C 34a_100000757185_100000748629 [0,0,0,0,0,0|3,0,1]=4 15 B15R1.499 C=C(C)COc1ccc(cc1)OC(C)C 7a_100000757185_100000748629 [0,0,0,0,0,0|3,0,1]=4 16 B15R1.499 C=C(C)COc1ccc(nc1)NC(=O)C 34a_200000094647_100000748629 [0,0,0,0,0,0|4,0,0]=4 17 B15R1.499 C=C(C)COc1ccc(nc1)NC(=O)C 7a_200000094647_100000748629 [0,0,0,0,0,0|4,0,0]=4 18 B15R1.499 C=C(C)CSc1ccc(cc1)CC(=O)C 62a_100000691760_100000211660 [0,0,0,0,0,0|3,0,0]=3 19 B15R1.499 C=C(C)CSc1ccc(cc1)CC(=O)C 62a_100000748629_100000691760 [0,0,0,0,0,0|3,0,0]=3 20 B15R1.499 C=C(C)CSc1ccc(cc1)CC(=O)N 62a_100000162331_100000211660 [0,0,0,0,0,0|4,0,0]=4 21 B15R1.499 C=C(C)CSc1ccc(cc1)CC(=O)N 62a_100000748629_100000162331 [0,0,0,0,0,0|4,0,0]=4 22 B15R1.499 C=C(C)CSc1ccc(cc1)NC(=O)C 62a_100000748629_100000155215 [0,0,0,0,0,0|3,0,0]=3 23 B15R1.499 C=C(C)CSc1ccc(cc1)NC(=O)N 62a_100000748629_100000198584 [0,0,0,0,0,0|4,0,0]=4 24 B15R1.499 C=C(C)CSc1ccc(cc1)OC(=O)C 62a_100000748629_100000002173 [0,0,0,0,0,0|2,0,0]=2 25 B15R1.499 C=C(C)CSc1ccc(cc1)OC(=S)C 62a_100000748629_200009816735 [0,0,0,0,0,0|2,1,0]=3 26 B15R1.499 C=C(C)CSc1ccc(cc1)OC(C)C 62a_100000169947_100000211660 [0,0,0,0,0,0|3,0,1]=4 27 B15R1.499 C=C(C)CSc1ccc(cc1)OC(C)C 62a_100000748629_100000169947 [0,0,0,0,0,0|3,0,1]=4 28 B15R1.499 C=C(C)CSc1ccc(cc1)SC(=O)C 62a_200009995050_100000211660 [0,0,0,0,0,0|2,1,0]=3 29 B15R1.499 C=C(C)CSc1ccc(cn1)NC(=O)C 62a_100000748629_100011934715 [0,0,0,0,0,0|4,0,0]=4 30 B15R1.499 C=C(C)CSc1ccc(nc1)NC(=O)C 62a_100000748629_100000193312 [0,0,0,0,0,0|4,0,0]=4 31 B15R1.499 C=C(F)CNc1ccc(cc1)NC(=O)C 34a_100000184111_100009893438 [0,0,0,0,0,0|3,0,1]=4 32 B15R1.499 C=C(F)COc1ccc(cc1)CC(=O)C 34a_100011218180_100009893438 [0,0,0,0,0,0|3,0,1]=4 33 B15R1.499 C=C(F)COc1ccc(cc1)CC(=O)C 7a_100011218180_100000042424 [0,0,0,0,0,0|3,0,1]=4 34 B15R1.499 C=C(F)COc1ccc(cc1)NC(=O)C 34a_100000184395_100009893438 [0,0,0,0,0,0|3,0,1]=4 35 B15R1.499 C=C(F)COc1ccc(cc1)NC(=O)C 7a_100000184395_100000042424 [0,0,0,0,0,0|3,0,1]=4 36 B15R1.499 C=C(F)CSc1ccc(cc1)CC(=O)C 62a_100000042424_100000691760 [0,0,0,0,0,0|3,0,1]=4 37 B15R1.499 C=C(F)CSc1ccc(cc1)CC(=O)C 62a_100000691760_100000042424 [0,0,0,0,0,0|3,0,1]=4 38 B15R1.499 C=C(F)CSc1ccc(cc1)NC(=O)C 62a_100000042424_100000155215 [0,0,0,0,0,0|3,0,1]=4 39 B15R1.499 C=C(F)CSc1ccc(cc1)OC(=O)C 62a_100000042424_100000002173 [0,0,0,0,0,0|2,0,1]=3 40 B15R1.499 C=C(F)CSc1ccc(cc1)OC(=S)C 62a_100000042424_200009816735 [0,0,0,0,0,0|2,1,1]=4 41 B15R1.499 C=C(F)CSc1ccc(cc1)SC(=O)C 62a_200009995050_100000042424 [0,0,0,0,0,0|2,1,1]=4 42 B15R1.499 CC(=Cc1ccc(cc1)CCC(=O)N)C 271570a_100102525489_200010110666 [0,0,0,0,0,0|3,0,0]=3 43 B15R1.499 CC(=Cc1ccc(cc1)SCC(=O)N)C 271570a_100102525489_100000149456 [0,0,0,0,0,0|4,0,0]=4 44 B15R1.499 CC(=O)/C=C/c1ccc(cc1)C=C(C)C 271570a_100102525489_200016259395 [0,0,0,0,0,0|2,0,2]=4 45 B15R1.499 CC(=O)/C=C/c1ccc(cc1)OC(C)C 34a_100000189429_100000210206 [0,0,0,0,0,0|1,0,3]=4 46 B15R1.499 CC(=O)C=Cc1ccc(cc1)NC(=O)C 1458a_100000735606_200000210301 [0,0,0,0,0,0|1,0,2]=3 47 B15R1.499 CC(=O)C=Cc1ccc(cc1)OC(C)C 1458a_100000741544_200000210301 [0,0,0,0,0,0|1,0,3]=4 48 B15R1.499 CC(=O)CCc1ccc(cc1)C=C(C)C 271570a_100102525489_100000723691 [0,0,0,0,0,0|2,0,0]=2 49 B15R1.499 CC(=O)CCc1ccc(cc1)CC(C)C 1458a_100000691995_200000210301 [0,0,0,0,0,0|2,0,1]=3 50 B15R1.499 CC(=O)CCc1ccc(cc1)OC(C)C 1458a_100000743653_200000210301 [0,0,0,0,0,0|1,0,1]=2 51 B15R1.499 CC(=O)CCc1ccc(cc1)OC(C)C 34a_100000198047_100000210206 [0,0,0,0,0,0|1,0,1]=2 52 B15R1.499 CC(=O)CCc1ccc(cc1)OC(C)C 7a_100000198047_100000210206 [0,0,0,0,0,0|1,0,1]=2 53 B15R1.499 CC(=O)CCc1ccc(cc1)OC(F)F 1458a_100000736697_200000210301 [0,0,0,0,0,0|2,0,1]=3 54 B15R1.499 CC(=O)CCc1ccc(cc1)SC(C)C 62a_100000210206_100000723691 [0,0,0,0,0,0|1,1,1]=3 55 B15R1.499 CC(=O)CCc1ccc(cc1)SC(C)C 62a_100000723691_100000210206 [0,0,0,0,0,0|1,1,1]=3 56 B15R1.499 CC(=O)COc1ccc(cc1)NC(=O)C 1458a_100011194236_200000210301 [0,0,0,0,0,0|2,0,0]=2 57 B15R1.499 CC(=O)Cc1ccc(cc1)OCC(=O)N 34a_100011218180_100000187820 [0,0,0,0,0,0|3,0,0]=3 58 B15R1.499 CC(=O)Cc1ccc(cc1)OCC(=O)N 7a_100011218180_100000187820 [0,0,0,0,0,0|3,0,0]=3 59 B15R1.499 CC(=O)Cc1ccc(cc1)OCC(=O)[O-] 34a_100011218180_100020667443 [0,0,0,0,0,0|3,0,0]=3 60 B15R1.499 CC(=O)Cc1ccc(cc1)OCC(C)C 1458a_100000230830_200000210301 [0,0,0,0,0,0|3,0,1]=4 61 B15R1.499 CC(=O)Cc1ccc(cc1)OCC(C)C 34a_100011218180_100000210624 [0,0,0,0,0,0|3,0,1]=4 62 B15R1.499 CC(=O)Cc1ccc(cc1)OCC(C)C 7a_100011218180_100000210760 [0,0,0,0,0,0|3,0,1]=4 63 B15R1.499 CC(=O)Cc1ccc(cc1)OCC(C)O 34a_100011218180_100011218427 [0,0,0,0,0,0|2,0,2]=4 64 B15R1.499 CC(=O)Cc1ccc(cc1)OCC(C)O 7a_100011218180_100011218427 [0,0,0,0,0,0|2,0,2]=4 65 B15R1.499 CC(=O)Cc1ccc(cc1)OC[C@@H](C)O 34a_100011218180_100009817552 [0,0,0,0,0,0|2,0,2]=4 66 B15R1.499 CC(=O)Cc1ccc(cc1)OC[C@@H](C)O 7a_100011218180_100009817552 [0,0,0,0,0,0|2,0,2]=4 67 B15R1.499 CC(=O)Cc1ccc(cc1)OC[N+](=O)[O-] 34a_100011218180_100000761209 [0,0,0,0,0,0|4,0,0]=4 68 B15R1.499 CC(=O)Cc1ccc(cc1)SCC(=O)N 62a_100000691760_100000747473 [0,0,0,0,0,0|3,0,0]=3 69 B15R1.499 CC(=O)Cc1ccc(cc1)SCC(=O)N 62a_100000747473_100000691760 [0,0,0,0,0,0|3,0,0]=3 70 B15R1.499 CC(=O)Cc1ccc(cc1)SCC(=O)[O-] 62a_100000691760_100020667443 [0,0,0,0,0,0|3,0,0]=3 71 B15R1.499 CC(=O)Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000691760 [0,0,0,0,0,0|3,0,0]=3 72 B15R1.499 CC(=O)Cc1ccc(cc1)SCC(C)C 62a_100000210624_100000691760 [0,0,0,0,0,0|3,0,1]=4 73 B15R1.499 CC(=O)Cc1ccc(cc1)SCC(C)C 62a_100000691760_100000210760 [0,0,0,0,0,0|3,0,1]=4 74 B15R1.499 CC(=O)Cc1ccc(cc1)SCC(C)O 62a_100000691760_100011218427 [0,0,0,0,0,0|2,0,2]=4 75 B15R1.499 CC(=O)Cc1ccc(cc1)SCC(C)O 62a_100011218427_100000691760 [0,0,0,0,0,0|2,0,2]=4 76 B15R1.499 CC(=O)Cc1ccc(cc1)SC[C@@H](C)O 62a_100000691760_100009817552 [0,0,0,0,0,0|2,0,2]=4 77 B15R1.499 CC(=O)Cc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000691760 [0,0,0,0,0,0|2,0,2]=4 78 B15R1.499 CC(=O)Cc1ccc(cc1)SC[N+](=O)[O-] 62a_100000691760_100000761209 [0,0,0,0,0,0|4,0,0]=4 79 B15R1.499 CC(=O)NCc1ccc(cc1)C=C(C)C 271570a_100102525489_200000685173 [0,0,0,0,0,0|3,0,0]=3 80 B15R1.499 CC(=O)NCc1ccc(cc1)CN(C)C 240690a_100000203713_100015343762 [0,0,0,0,0,0|4,0,0]=4 81 B15R1.499 CC(=O)NCc1ccc(cc1)CN(C)C 527a_100000203713_100103153847 [0,0,0,0,0,0|4,0,0]=4 82 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C 11a_100000735448_100015343762 [0,0,0,0,0,0|2,0,0]=2 83 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C 11a_100000755463_100015343762 [0,0,0,0,0,0|2,0,0]=2 84 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100015343762 [0,0,0,0,0,0|2,0,0]=2 85 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000755463_100015343762 [0,0,0,0,0,0|2,0,0]=2 86 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C 22a_100000755463_100000070787 [0,0,0,0,0,0|2,0,0]=2 87 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C 240690a_100000735448_100015343762 [0,0,0,0,0,0|2,0,0]=2 88 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C 527a_100000735448_100103153847 [0,0,0,0,0,0|2,0,0]=2 89 B15R1.499 CC(=O)NCc1ccc(cc1)NC(=O)C 527a_100000755463_100103153847 [0,0,0,0,0,0|2,0,0]=2 90 B15R1.499 CC(=O)NCc1ccc(cc1)NC(C)C 34a_100000755463_100000210206 [0,0,0,0,0,0|3,0,1]=4 91 B15R1.499 CC(=O)NCc1ccc(cc1)OC(C)C 11a_100020586559_100015343762 [0,0,0,0,0,0|2,0,1]=3 92 B15R1.499 CC(=O)NCc1ccc(cc1)OC(C)C 1626a_100020586559_100015343762 [0,0,0,0,0,0|2,0,1]=3 93 B15R1.499 CC(=O)NCc1ccc(cc1)OC(C)C 240690a_100020586559_100015343762 [0,0,0,0,0,0|2,0,1]=3 94 B15R1.499 CC(=O)NCc1ccc(cc1)OC(C)C 527a_100020586559_100103153847 [0,0,0,0,0,0|2,0,1]=3 95 B15R1.499 CC(=O)NCc1ccc(cc1)OC(F)F 11a_100000181771_100015343762 [0,0,0,0,0,0|3,0,1]=4 96 B15R1.499 CC(=O)NCc1ccc(cc1)OC(F)F 1626a_100000181771_100015343762 [0,0,0,0,0,0|3,0,1]=4 97 B15R1.499 CC(=O)NCc1ccc(cc1)OC(F)F 240690a_100000181771_100015343762 [0,0,0,0,0,0|3,0,1]=4 98 B15R1.499 CC(=O)NCc1ccc(cc1)OC(F)F 527a_100000181771_100103153847 [0,0,0,0,0,0|3,0,1]=4 99 B15R1.499 CC(=O)NCc1ccc(cc1)SC(C)C 62a_100000210206_200000685173 [0,0,0,0,0,0|2,1,1]=4 100 B15R1.499 CC(=O)NCc1ccc(cc1)SC(C)C 62a_200000685173_100000210206 [0,0,0,0,0,0|2,1,1]=4 101 B15R1.499 CC(=O)NCc1ccc(nc1)OC(C)C 11a_100000740622_100015343762 [0,0,0,0,0,0|3,0,1]=4 102 B15R1.499 CC(=O)NCc1ccc(nc1)OC(C)C 1626a_100000740622_100015343762 [0,0,0,0,0,0|3,0,1]=4 103 B15R1.499 CC(=O)NCc1ccc(nc1)OC(C)C 240690a_100000740622_100015343762 [0,0,0,0,0,0|3,0,1]=4 104 B15R1.499 CC(=O)NCc1ccc(nc1)OC(C)C 527a_100000740622_100103153847 [0,0,0,0,0,0|3,0,1]=4 105 B15R1.499 CC(=O)NNc1ccc(cc1)C=C(C)C 271570a_100102525489_200009815283 [0,0,0,0,0,0|4,0,0]=4 106 B15R1.499 CC(=O)NNc1ccc(cc1)OC(C)C 22a_100016991999_100000070787 [0,0,0,0,0,0|3,0,1]=4 107 B15R1.499 CC(=O)Nc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000735606_200025704644 [0,0,0,0,0,0|1,0,2]=3 108 B15R1.499 CC(=O)Nc1ccc(cc1)CCN(C)C 11a_100000751241_100015343762 [0,0,0,0,0,0|3,0,0]=3 109 B15R1.499 CC(=O)Nc1ccc(cc1)CCN(C)C 22a_100000751241_100000070787 [0,0,0,0,0,0|3,0,0]=3 110 B15R1.499 CC(=O)Nc1ccc(cc1)CCN(C)C 527a_100000751241_100103153847 [0,0,0,0,0,0|3,0,0]=3 111 B15R1.499 CC(=O)Nc1ccc(cc1)CNC(=O)N 11a_100000747042_100015343762 [0,0,0,0,0,0|3,0,0]=3 112 B15R1.499 CC(=O)Nc1ccc(cc1)CNC(=O)N 1626a_100000747042_100015343762 [0,0,0,0,0,0|3,0,0]=3 113 B15R1.499 CC(=O)Nc1ccc(cc1)CNC(=O)N 22a_100000747042_100000070787 [0,0,0,0,0,0|3,0,0]=3 114 B15R1.499 CC(=O)Nc1ccc(cc1)CNC(C)C 207a_100138425928_100000210072 [0,0,0,0,0,0|3,0,1]=4 115 B15R1.499 CC(=O)Nc1ccc(cc1)CNC(C)C 2230a_100138425928_100000731167 [0,0,0,0,0,0|3,0,1]=4 116 B15R1.499 CC(=O)Nc1ccc(cc1)CNC(C)C 34a_100000735448_100000210206 [0,0,0,0,0,0|3,0,1]=4 117 B15R1.499 CC(=O)Nc1ccc(cc1)CNC(C)C 34a_100138425928_100000731167 [0,0,0,0,0,0|3,0,1]=4 118 B15R1.499 CC(=O)Nc1ccc(cc1)COC(C)C 34a_100000212225_100000731167 [0,0,0,0,0,0|3,0,1]=4 119 B15R1.499 CC(=O)Nc1ccc(cc1)COC(C)C 34a_100000246270_100000210206 [0,0,0,0,0,0|3,0,1]=4 120 B15R1.499 CC(=O)Nc1ccc(cc1)COC(C)C 7a_100000246270_100000210206 [0,0,0,0,0,0|3,0,1]=4 121 B15R1.499 CC(=O)Nc1ccc(cc1)CSC(C)C 62a_100000210206_100000731167 [0,0,0,0,0,0|3,0,1]=4 122 B15R1.499 CC(=O)Nc1ccc(cc1)NCC(=O)N 34a_100000184111_100000187820 [0,0,0,0,0,0|3,0,0]=3 123 B15R1.499 CC(=O)Nc1ccc(cc1)NCC(=O)[O-] 34a_100000184111_100020667443 [0,0,0,0,0,0|3,0,0]=3 124 B15R1.499 CC(=O)Nc1ccc(cc1)NCC(C)C 34a_100000184111_100000210624 [0,0,0,0,0,0|3,0,1]=4 125 B15R1.499 CC(=O)Nc1ccc(cc1)NCC(C)O 34a_100000184111_100011218427 [0,0,0,0,0,0|2,0,2]=4 126 B15R1.499 CC(=O)Nc1ccc(cc1)NC[C@@H](C)O 34a_100000184111_100009817552 [0,0,0,0,0,0|2,0,2]=4 127 B15R1.499 CC(=O)Nc1ccc(cc1)NC[N+](=O)[O-] 34a_100000184111_100000761209 [0,0,0,0,0,0|4,0,0]=4 128 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)N 11a_100000238760_100015343762 [0,0,0,0,0,0|3,0,0]=3 129 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)N 1626a_100000238760_100015343762 [0,0,0,0,0,0|3,0,0]=3 130 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)N 22a_100000238760_100000070787 [0,0,0,0,0,0|3,0,0]=3 131 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)N 34a_100000184395_100000187820 [0,0,0,0,0,0|3,0,0]=3 132 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)N 527a_100000238760_100103153847 [0,0,0,0,0,0|3,0,0]=3 133 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)N 7a_100000184395_100000187820 [0,0,0,0,0,0|3,0,0]=3 134 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)[13CH3] 1458a_100011194236_200025704644 [0,0,0,0,0,0|2,0,0]=2 135 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(=O)[O-] 34a_100000184395_100020667443 [0,0,0,0,0,0|3,0,0]=3 136 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(C)C 11a_200000243789_100015343762 [0,0,0,0,0,0|3,0,1]=4 137 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(C)C 1626a_200000243789_100015343762 [0,0,0,0,0,0|3,0,1]=4 138 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(C)C 22a_200000243789_100000070787 [0,0,0,0,0,0|3,0,1]=4 139 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(C)C 34a_100000184395_100000210624 [0,0,0,0,0,0|3,0,1]=4 140 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(C)C 527a_200000243789_100103153847 [0,0,0,0,0,0|3,0,1]=4 141 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(C)C 7a_100000184395_100000210760 [0,0,0,0,0,0|3,0,1]=4 142 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(C)O 34a_100000184395_100011218427 [0,0,0,0,0,0|2,0,2]=4 143 B15R1.499 CC(=O)Nc1ccc(cc1)OCC(C)O 7a_100000184395_100011218427 [0,0,0,0,0,0|2,0,2]=4 144 B15R1.499 CC(=O)Nc1ccc(cc1)OC[C@@H](C)O 34a_100000184395_100009817552 [0,0,0,0,0,0|2,0,2]=4 145 B15R1.499 CC(=O)Nc1ccc(cc1)OC[C@@H](C)O 7a_100000184395_100009817552 [0,0,0,0,0,0|2,0,2]=4 146 B15R1.499 CC(=O)Nc1ccc(cc1)OC[N+](=O)[O-] 34a_100000184395_100000761209 [0,0,0,0,0,0|4,0,0]=4 147 B15R1.499 CC(=O)Nc1ccc(cc1)SCC(=O)N 62a_100000747473_100000155215 [0,0,0,0,0,0|3,0,0]=3 148 B15R1.499 CC(=O)Nc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000155215 [0,0,0,0,0,0|3,0,0]=3 149 B15R1.499 CC(=O)Nc1ccc(cc1)SCC(C)C 62a_100000210624_100000155215 [0,0,0,0,0,0|3,0,1]=4 150 B15R1.499 CC(=O)Nc1ccc(cc1)SCC(C)O 62a_100011218427_100000155215 [0,0,0,0,0,0|2,0,2]=4 151 B15R1.499 CC(=O)Nc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000155215 [0,0,0,0,0,0|2,0,2]=4 152 B15R1.499 CC(=O)Nc1ccc(cn1)OCC(=O)N 34a_200000094647_100000187820 [0,0,0,0,0,0|4,0,0]=4 153 B15R1.499 CC(=O)Nc1ccc(cn1)OCC(=O)N 7a_200000094647_100000187820 [0,0,0,0,0,0|4,0,0]=4 154 B15R1.499 CC(=O)Nc1ccc(cn1)OCC(=O)[O-] 34a_200000094647_100020667443 [0,0,0,0,0,0|4,0,0]=4 155 B15R1.499 CC(=O)Nc1ccc(cn1)SCC(=O)N 62a_100000747473_100000193312 [0,0,0,0,0,0|4,0,0]=4 156 B15R1.499 CC(=O)Nc1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100000193312 [0,0,0,0,0,0|4,0,0]=4 157 B15R1.499 CC(=O)Nc1ccc(nc1)SCC(=O)N 62a_100000747473_100011934715 [0,0,0,0,0,0|4,0,0]=4 158 B15R1.499 CC(=O)Nc1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100011934715 [0,0,0,0,0,0|4,0,0]=4 159 B15R1.499 CC(=O)Oc1ccc(cc1)C=CC(C)C 271570a_100016257149_100000002173 [0,0,0,0,0,0|1,0,3]=4 160 B15R1.499 CC(=O)Oc1ccc(cc1)C=CC(C)O 271570a_200011019289_100000002173 [0,0,0,0,0,0|0,0,4]=4 161 B15R1.499 CC(=O)Oc1ccc(cc1)CNC(C)C 207a_100138425928_100000014718 [0,0,0,0,0,0|2,0,1]=3 162 B15R1.499 CC(=O)Oc1ccc(cc1)CNC(C)C 2230a_100138425928_100000033664 [0,0,0,0,0,0|2,0,1]=3 163 B15R1.499 CC(=O)Oc1ccc(cc1)CSC(C)C 62a_100000210206_100000033664 [0,0,0,0,0,0|2,0,1]=3 164 B15R1.499 CC(=O)Oc1ccc(cc1)SCC(=O)N 62a_100000747473_100000002173 [0,0,0,0,0,0|2,0,0]=2 165 B15R1.499 CC(=O)Oc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000002173 [0,0,0,0,0,0|2,0,0]=2 166 B15R1.499 CC(=O)Oc1ccc(cc1)SCC(C)C 62a_100000210624_100000002173 [0,0,0,0,0,0|2,0,1]=3 167 B15R1.499 CC(=O)Oc1ccc(cc1)SCC(C)O 62a_100011218427_100000002173 [0,0,0,0,0,0|1,0,2]=3 168 B15R1.499 CC(=O)Oc1ccc(cc1)SCC(F)F 62a_100011934356_100000002173 [0,0,0,0,0,0|3,0,1]=4 169 B15R1.499 CC(=O)Oc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000002173 [0,0,0,0,0,0|1,0,2]=3 170 B15R1.499 CC(=O)Sc1ccc(cc1)SCC(=O)N 62a_200009995050_100000747473 [0,0,0,0,0,0|2,1,0]=3 171 B15R1.499 CC(=O)Sc1ccc(cc1)SCC(=O)[O-] 62a_200009995050_100020667443 [0,0,0,0,0,0|2,1,0]=3 172 B15R1.499 CC(=O)Sc1ccc(cc1)SCC(C)C 62a_200009995050_100000210760 [0,0,0,0,0,0|2,1,1]=4 173 B15R1.499 CC(=O)Sc1ccc(cc1)SCC(C)O 62a_200009995050_100011218427 [0,0,0,0,0,0|1,1,2]=4 174 B15R1.499 CC(=O)Sc1ccc(cc1)SC[C@@H](C)O 62a_200009995050_100009817552 [0,0,0,0,0,0|1,1,2]=4 175 B15R1.499 CC(=O)Sc1ccc(cc1)SC[N+](=O)[O-] 62a_200009995050_100000761209 [0,0,0,0,0,0|3,1,0]=4 176 B15R1.499 CC(=S)Oc1ccc(cc1)SCC(=O)N 62a_100000747473_200009816735 [0,0,0,0,0,0|2,1,0]=3 177 B15R1.499 CC(=S)Oc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200009816735 [0,0,0,0,0,0|2,1,0]=3 178 B15R1.499 CC(=S)Oc1ccc(cc1)SCC(C)C 62a_100000210624_200009816735 [0,0,0,0,0,0|2,1,1]=4 179 B15R1.499 CC(=S)Oc1ccc(cc1)SCC(C)O 62a_100011218427_200009816735 [0,0,0,0,0,0|1,1,2]=4 180 B15R1.499 CC(=S)Oc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_200009816735 [0,0,0,0,0,0|1,1,2]=4 181 B15R1.499 CC(C)COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000230830_200025704644 [0,0,0,0,0,0|3,0,1]=4 182 B15R1.499 CC(C)Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000691995_200025704644 [0,0,0,0,0,0|2,0,1]=3 183 B15R1.499 CC(C)Oc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000741544_200025704644 [0,0,0,0,0,0|1,0,3]=4 184 B15R1.499 CC(C)Oc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000743653_200025704644 [0,0,0,0,0,0|1,0,1]=2 185 B15R1.499 CC(C)Oc1ccc(cc1)NCC(=O)N 2230a_100011194259_100000747473 [0,0,0,0,0,0|3,0,1]=4 186 B15R1.499 CC(C)Oc1ccc(cc1)NCC(=O)N 34a_100011194259_100000187820 [0,0,0,0,0,0|3,0,1]=4 187 B15R1.499 CC(C)Oc1ccc(cc1)NCC(=O)[O-] 34a_100011194259_100020667443 [0,0,0,0,0,0|3,0,1]=4 188 B15R1.499 CC(C)Oc1ccc(cc1)OCC(=O)N 34a_100000757185_100000187820 [0,0,0,0,0,0|3,0,1]=4 189 B15R1.499 CC(C)Oc1ccc(cc1)OCC(=O)N 7a_100000757185_100000187820 [0,0,0,0,0,0|3,0,1]=4 190 B15R1.499 CC(C)Oc1ccc(cc1)OCC(=O)[O-] 34a_100000757185_100020667443 [0,0,0,0,0,0|3,0,1]=4 191 B15R1.499 CC(C)Oc1ccc(cc1)SCC(=O)N 62a_100000169947_100000747473 [0,0,0,0,0,0|3,0,1]=4 192 B15R1.499 CC(C)Oc1ccc(cc1)SCC(=O)N 62a_100000747473_100000169947 [0,0,0,0,0,0|3,0,1]=4 193 B15R1.499 CC(C)Oc1ccc(cc1)SCC(=O)[O-] 62a_100000169947_100020667443 [0,0,0,0,0,0|3,0,1]=4 194 B15R1.499 CC(C)Oc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000169947 [0,0,0,0,0,0|3,0,1]=4 195 B15R1.499 CC(C)Sc1ccc(cc1)CCC(=O)N 62a_100000210206_200010110666 [0,0,0,0,0,0|2,1,1]=4 196 B15R1.499 CC(C)Sc1ccc(cc1)CCC(=O)N 62a_200010110666_100000210206 [0,0,0,0,0,0|2,1,1]=4 197 B15R1.499 CC(O)CCc1ccc(cc1)OC(C)C 34a_100000189425_100000210206 [0,0,0,0,0,0|1,0,3]=4 198 B15R1.499 CC(O)CCc1ccc(cc1)OC(C)C 7a_100000189425_100000210206 [0,0,0,0,0,0|1,0,3]=4 199 B15R1.499 NC(=O)CNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000747473 [0,0,0,0,0,0|4,0,0]=4 200 B15R1.499 NC(=O)CNc1ccc(cc1)CC(=O)N 34a_100000738315_100000187820 [0,0,0,0,0,0|4,0,0]=4 201 B15R1.499 NC(=O)COc1ccc(cc1)CC(=O)N 34a_100000020825_100000187820 [0,0,0,0,0,0|4,0,0]=4 202 B15R1.499 NC(=O)CSc1ccc(cc1)CC(=O)N 62a_100000162331_100000747473 [0,0,0,0,0,0|4,0,0]=4 203 B15R1.499 NC(=O)CSc1ccc(cc1)CC(=O)N 62a_100000747473_100000162331 [0,0,0,0,0,0|4,0,0]=4 204 B15R1.499 NC(=O)CSc1ccc(cc1)NC(=O)N 62a_100000747473_100000198584 [0,0,0,0,0,0|4,0,0]=4 205 B15R1.499 NC(=O)Cc1ccc(cc1)NCC(=O)[O-] 34a_100000738315_100020667443 [0,0,0,0,0,0|4,0,0]=4 206 B15R1.499 NC(=O)Cc1ccc(cc1)OCC(=O)[O-] 34a_100000020825_100020667443 [0,0,0,0,0,0|4,0,0]=4 207 B15R1.499 NC(=O)Cc1ccc(cc1)SCC(=O)[O-] 62a_100000162331_100020667443 [0,0,0,0,0,0|4,0,0]=4 208 B15R1.499 NC(=O)Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000162331 [0,0,0,0,0,0|4,0,0]=4 209 B15R1.499 NC(=O)Nc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000198584 [0,0,0,0,0,0|4,0,0]=4 210 B15R1.499 [13CH3]C(=O)CCc1ccc(cc1)OC(F)F 1458a_100000736697_200025704644 [0,0,0,0,0,0|2,0,1]=3 211 B14R1.68 C#CCSc1ccc(cc1)OC(=O)C 62a_100000038162_100000002173 [1,0,0,0,0,0|1,0,2]=4 212 B14R1.68 C=CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100015514636 [1,0,0,0,0,0|2,0,1]=4 213 B14R1.68 C=CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100015514636 [1,0,0,0,0,0|2,0,1]=4 214 B14R1.68 C=CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100015514636 [1,0,0,0,0,0|2,0,1]=4 215 B14R1.68 C=CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100015514636 [1,0,0,0,0,0|2,0,1]=4 216 B14R1.68 C=CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100015514636 [1,0,0,0,0,0|2,0,1]=4 217 B14R1.68 C=CCSc1ccc(cc1)CC(=O)C 62a_100000210623_100000691760 [1,0,0,0,0,0|2,0,1]=4 218 B14R1.68 C=CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000210623 [1,0,0,0,0,0|2,0,1]=4 219 B14R1.68 C=CCSc1ccc(cc1)NC(=O)C 62a_100000210623_100000155215 [1,0,0,0,0,0|2,0,1]=4 220 B14R1.68 C=CCSc1ccc(cc1)OC(=O)C 62a_100000210623_100000002173 [1,0,0,0,0,0|1,0,1]=3 221 B14R1.68 C=CCSc1ccc(cc1)OC(=S)C 62a_100000210623_200009816735 [1,0,0,0,0,0|1,1,1]=4 222 B14R1.68 C=CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000210623 [1,0,0,0,0,0|1,1,1]=4 223 B14R1.68 CC(=Cc1ccc(cc1)CCC=O)C 271570a_100102525489_100011361538 [1,0,0,0,0,0|2,0,0]=3 224 B14R1.68 CC(=O)Cc1ccc(cc1)OCC=O 34a_100011218180_200009817547 [1,0,0,0,0,0|2,0,0]=3 225 B14R1.68 CC(=O)Cc1ccc(cc1)OCC=O 7a_100011218180_200015260668 [1,0,0,0,0,0|2,0,0]=3 226 B14R1.68 CC(=O)Cc1ccc(cc1)SCC=O 62a_100000691760_200015260668 [1,0,0,0,0,0|2,0,0]=3 227 B14R1.68 CC(=O)Cc1ccc(cc1)SCC=O 62a_200015260668_100000691760 [1,0,0,0,0,0|2,0,0]=3 228 B14R1.68 CC(=O)Nc1ccc(cc1)CCO[13CH3] 34a_100000752260_200025704644 [1,0,0,0,0,0|2,0,0]=3 229 B14R1.68 CC(=O)Nc1ccc(cc1)CCO[13CH3] 7a_100000752260_200025704644 [1,0,0,0,0,0|2,0,0]=3 230 B14R1.68 CC(=O)Nc1ccc(cc1)NCC=O 34a_100000184111_200009817547 [1,0,0,0,0,0|2,0,0]=3 231 B14R1.68 CC(=O)Nc1ccc(cc1)OCC=O 34a_100000184395_200009817547 [1,0,0,0,0,0|2,0,0]=3 232 B14R1.68 CC(=O)Nc1ccc(cc1)OCC=O 7a_100000184395_200015260668 [1,0,0,0,0,0|2,0,0]=3 233 B14R1.68 CC(=O)Nc1ccc(cc1)SCC=O 62a_200015260668_100000155215 [1,0,0,0,0,0|2,0,0]=3 234 B14R1.68 CC(=O)Nc1ccc(cn1)OCC=O 34a_200000094647_200009817547 [1,0,0,0,0,0|3,0,0]=4 235 B14R1.68 CC(=O)Nc1ccc(cn1)OCC=O 7a_200000094647_200015260668 [1,0,0,0,0,0|3,0,0]=4 236 B14R1.68 CC(=O)Nc1ccc(cn1)SCC=O 62a_200015260668_100000193312 [1,0,0,0,0,0|3,0,0]=4 237 B14R1.68 CC(=O)Nc1ccc(nc1)SCC=O 62a_200015260668_100011934715 [1,0,0,0,0,0|3,0,0]=4 238 B14R1.68 CC(=O)Oc1ccc(cc1)CSCF 62a_100015361967_100000033664 [1,0,0,0,0,0|2,0,1]=4 239 B14R1.68 CC(=O)Oc1ccc(cc1)SCC#N 62a_100011215382_100000002173 [1,0,0,0,0,0|2,0,1]=4 240 B14R1.68 CC(=O)Oc1ccc(cc1)SCC=O 62a_200015260668_100000002173 [1,0,0,0,0,0|1,0,0]=2 241 B14R1.68 CC(=O)Oc1ccc(cc1)SCCF 62a_100011217306_100000002173 [1,0,0,0,0,0|2,0,1]=4 242 B14R1.68 CC(=O)Oc1ccc(cc1)SCCO 62a_100000211926_100000002173 [1,0,0,0,0,0|1,0,2]=4 243 B14R1.68 CC(=O)Sc1ccc(cc1)SCC=O 62a_200009995050_200015260668 [1,0,0,0,0,0|1,1,0]=3 244 B14R1.68 CC(=S)Oc1ccc(cc1)SCC=O 62a_200015260668_200009816735 [1,0,0,0,0,0|1,1,0]=3 245 B14R1.68 CC(C)Oc1ccc(cc1)CCN[13CH3] 2230a_100015183000_200025704644 [1,0,0,0,0,0|2,0,1]=4 246 B14R1.68 CC(C)Oc1ccc(cc1)CCN[13CH3] 34a_100015183000_200025704644 [1,0,0,0,0,0|2,0,1]=4 247 B14R1.68 CC(C)Oc1ccc(cc1)NCC=O 2230a_100011194259_200015260668 [1,0,0,0,0,0|2,0,1]=4 248 B14R1.68 CC(C)Oc1ccc(cc1)NCC=O 34a_100011194259_200009817547 [1,0,0,0,0,0|2,0,1]=4 249 B14R1.68 CC(C)Oc1ccc(cc1)OCC=O 34a_100000757185_200009817547 [1,0,0,0,0,0|2,0,1]=4 250 B14R1.68 CC(C)Oc1ccc(cc1)OCC=O 7a_100000757185_200015260668 [1,0,0,0,0,0|2,0,1]=4 251 B14R1.68 CC(C)Oc1ccc(cc1)SCC=O 62a_100000169947_200015260668 [1,0,0,0,0,0|2,0,1]=4 252 B14R1.68 CC(C)Oc1ccc(cc1)SCC=O 62a_200015260668_100000169947 [1,0,0,0,0,0|2,0,1]=4 253 B14R1.68 CC(C)Sc1ccc(cc1)CCC=O 62a_100000210206_100011361538 [1,0,0,0,0,0|1,1,1]=4 254 B14R1.68 CC(C)Sc1ccc(cc1)CCC=O 62a_100011361538_100000210206 [1,0,0,0,0,0|1,1,1]=4 255 B14R1.68 CCCCc1ccc(cc1)C=C(C)C 271570a_100102525489_100011215597 [1,0,0,0,0,0|2,0,1]=4 256 B14R1.68 CCCCc1ccc(cc1)CC(=O)C 1458a_100000070787_100011934885 [1,0,0,0,0,0|1,0,1]=3 257 B14R1.68 CCCCc1ccc(cc1)CC(=O)C 1458a_100000185461_200000210301 [1,0,0,0,0,0|1,0,1]=3 258 B14R1.68 CCCCc1ccc(cc1)CC(=O)C 271570a_100020621405_100000691760 [1,0,0,0,0,0|1,0,1]=3 259 B14R1.68 CCCCc1ccc(cc1)CC(=O)N 271570a_100020621405_100000162331 [1,0,0,0,0,0|2,0,1]=4 260 B14R1.68 CCCCc1ccc(cc1)CC(=O)[13CH3] 1458a_100000185461_200025704644 [1,0,0,0,0,0|1,0,1]=3 261 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 11a_100000210628_100015343762 [1,0,0,0,0,0|1,0,1]=3 262 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 1626a_100000210628_100015343762 [1,0,0,0,0,0|1,0,1]=3 263 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 22a_100000210628_100000070787 [1,0,0,0,0,0|1,0,1]=3 264 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 271570a_100020621405_100000155215 [1,0,0,0,0,0|1,0,1]=3 265 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 527a_100000210628_100103153847 [1,0,0,0,0,0|1,0,1]=3 266 B14R1.68 CCCCc1ccc(cc1)NC(=O)N 271570a_100020621405_100000198584 [1,0,0,0,0,0|2,0,1]=4 267 B14R1.68 CCCCc1ccc(cc1)OC(=O)C 271570a_100020621405_100000002173 [1,0,0,0,0,0|0,0,1]=2 268 B14R1.68 CCCCc1ccc(cc1)OC(=S)C 271570a_100020621405_200009816735 [1,0,0,0,0,0|0,1,1]=3 269 B14R1.68 CCCCc1ccc(cc1)OC(C)C 271570a_100020621405_100000169947 [1,0,0,0,0,0|1,0,2]=4 270 B14R1.68 CCCCc1ccc(cc1)OC(C)C 34a_100011216022_100000210206 [1,0,0,0,0,0|1,0,2]=4 271 B14R1.68 CCCCc1ccc(cc1)OC(C)C 7a_100011216022_100000210206 [1,0,0,0,0,0|1,0,2]=4 272 B14R1.68 CCCCc1ccc(cc1)SC(=O)C 271570a_100020621405_200009995050 [1,0,0,0,0,0|0,1,1]=3 273 B14R1.68 CCCCc1ccc(cn1)NC(=O)C 271570a_100020621405_100011934715 [1,0,0,0,0,0|2,0,1]=4 274 B14R1.68 CCCCc1ccc(nc1)NC(=O)C 271570a_100020621405_100000193312 [1,0,0,0,0,0|2,0,1]=4 275 B14R1.68 CCCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000210303 [1,0,0,0,0,0|2,0,1]=4 276 B14R1.68 CCCOc1ccc(cc1)CC(=O)C 1458a_100000070787_100000691472 [1,0,0,0,0,0|2,0,1]=4 277 B14R1.68 CCCOc1ccc(cc1)CC(=O)C 1458a_200000230827_200000210301 [1,0,0,0,0,0|2,0,1]=4 278 B14R1.68 CCCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000210303 [1,0,0,0,0,0|2,0,1]=4 279 B14R1.68 CCCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000210303 [1,0,0,0,0,0|2,0,1]=4 280 B14R1.68 CCCOc1ccc(cc1)CC(=O)[13CH3] 1458a_200000230827_200025704644 [1,0,0,0,0,0|2,0,1]=4 281 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 11a_100000748631_100015343762 [1,0,0,0,0,0|2,0,1]=4 282 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 1626a_100000748631_100015343762 [1,0,0,0,0,0|2,0,1]=4 283 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 22a_100000748631_100000070787 [1,0,0,0,0,0|2,0,1]=4 284 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000210303 [1,0,0,0,0,0|2,0,1]=4 285 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 527a_100000748631_100103153847 [1,0,0,0,0,0|2,0,1]=4 286 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000210303 [1,0,0,0,0,0|2,0,1]=4 287 B14R1.68 CCCSc1ccc(cc1)CC(=O)C 62a_100000210303_100000691760 [1,0,0,0,0,0|2,0,1]=4 288 B14R1.68 CCCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000210303 [1,0,0,0,0,0|2,0,1]=4 289 B14R1.68 CCCSc1ccc(cc1)NC(=O)C 11a_100015183887_100015343762 [1,0,0,0,0,0|2,0,1]=4 290 B14R1.68 CCCSc1ccc(cc1)NC(=O)C 22a_100015183887_100000070787 [1,0,0,0,0,0|2,0,1]=4 291 B14R1.68 CCCSc1ccc(cc1)NC(=O)C 527a_100015183887_100103153847 [1,0,0,0,0,0|2,0,1]=4 292 B14R1.68 CCCSc1ccc(cc1)NC(=O)C 62a_100000210303_100000155215 [1,0,0,0,0,0|2,0,1]=4 293 B14R1.68 CCCSc1ccc(cc1)OC(=O)C 62a_100000210303_100000002173 [1,0,0,0,0,0|1,0,1]=3 294 B14R1.68 CCCSc1ccc(cc1)OC(=S)C 62a_100000210303_200009816735 [1,0,0,0,0,0|1,1,1]=4 295 B14R1.68 CCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000210303 [1,0,0,0,0,0|1,1,1]=4 296 B14R1.68 CCNCc1ccc(cc1)NC(=O)C 207a_100015525214_100000210072 [1,0,0,0,0,0|2,0,1]=4 297 B14R1.68 CCNCc1ccc(cc1)NC(=O)C 2230a_100015525214_100000731167 [1,0,0,0,0,0|2,0,1]=4 298 B14R1.68 CCNCc1ccc(cc1)NC(=O)C 34a_100000735448_100000210202 [1,0,0,0,0,0|2,0,1]=4 299 B14R1.68 CCNCc1ccc(cc1)OC(=O)C 207a_100015525214_100000014718 [1,0,0,0,0,0|1,0,1]=3 300 B14R1.68 CCNCc1ccc(cc1)OC(=O)C 2230a_100015525214_100000033664 [1,0,0,0,0,0|1,0,1]=3 301 B14R1.68 CCNCc1ccc(cc1)OC(=O)C 270004a_100015525214_100000014718 [1,0,0,0,0,0|1,0,1]=3 302 B14R1.68 CCOCc1ccc(cc1)NC(=O)C 34a_100000246270_100000210202 [1,0,0,0,0,0|2,0,1]=4 303 B14R1.68 CCOCc1ccc(cc1)NC(=O)C 34a_100121572206_100000731167 [1,0,0,0,0,0|2,0,1]=4 304 B14R1.68 CCOCc1ccc(cc1)NC(=O)C 7a_100000246270_100000210202 [1,0,0,0,0,0|2,0,1]=4 305 B14R1.68 CCSCc1ccc(cc1)NC(=O)C 62a_100000210202_100000731167 [1,0,0,0,0,0|2,0,1]=4 306 B14R1.68 CCSCc1ccc(cc1)OC(=O)C 62a_100000210202_100000033664 [1,0,0,0,0,0|1,0,1]=3 307 B14R1.68 CNCCc1ccc(cc1)C=C(C)C 271570a_100102525489_100000752880 [1,0,0,0,0,0|3,0,0]=4 308 B14R1.68 CNCCc1ccc(cc1)OC(C)C 2230a_100015183000_200000210301 [1,0,0,0,0,0|2,0,1]=4 309 B14R1.68 CNCCc1ccc(cc1)OC(C)C 34a_100015183000_200000210301 [1,0,0,0,0,0|2,0,1]=4 310 B14R1.68 CNCCc1ccc(cc1)OC(C)C 34a_100016989440_100000210206 [1,0,0,0,0,0|2,0,1]=4 311 B14R1.68 COCCc1ccc(cc1)C=C(C)C 271570a_100102525489_100000739703 [1,0,0,0,0,0|3,0,0]=4 312 B14R1.68 COCCc1ccc(cc1)NC(=O)C 34a_100000752260_200000210301 [1,0,0,0,0,0|2,0,0]=3 313 B14R1.68 COCCc1ccc(cc1)NC(=O)C 7a_100000752260_200000210301 [1,0,0,0,0,0|2,0,0]=3 314 B14R1.68 COCCc1ccc(cc1)OC(C)C 34a_100000211638_100000210206 [1,0,0,0,0,0|2,0,1]=4 315 B14R1.68 COCCc1ccc(cc1)OC(C)C 7a_100000211638_100000210206 [1,0,0,0,0,0|2,0,1]=4 316 B14R1.68 COCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000766300 [1,0,0,0,0,0|3,0,0]=4 317 B14R1.68 COCSc1ccc(cc1)CC(=O)C 62a_100000766300_100000691760 [1,0,0,0,0,0|3,0,0]=4 318 B14R1.68 COCSc1ccc(cc1)NC(=O)C 62a_100000766300_100000155215 [1,0,0,0,0,0|3,0,0]=4 319 B14R1.68 COCSc1ccc(cc1)OC(=O)C 62a_100000766300_100000002173 [1,0,0,0,0,0|2,0,0]=3 320 B14R1.68 COCSc1ccc(cc1)OC(=S)C 62a_100000766300_200009816735 [1,0,0,0,0,0|2,1,0]=4 321 B14R1.68 COCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000766300 [1,0,0,0,0,0|2,1,0]=4 322 B14R1.68 CSCCc1ccc(cc1)NC(=O)C 11a_100000750819_100015343762 [1,0,0,0,0,0|2,0,0]=3 323 B14R1.68 CSCCc1ccc(cc1)NC(=O)C 1626a_100000750819_100015343762 [1,0,0,0,0,0|2,0,0]=3 324 B14R1.68 CSCCc1ccc(cc1)NC(=O)C 22a_100000750819_100000070787 [1,0,0,0,0,0|2,0,0]=3 325 B14R1.68 CSCCc1ccc(cc1)NC(=O)C 527a_100000750819_100103153847 [1,0,0,0,0,0|2,0,0]=3 326 B14R1.68 CSCNc1ccc(cc1)NC(=O)C 34a_100000184111_100011218213 [1,0,0,0,0,0|3,0,0]=4 327 B14R1.68 CSCOc1ccc(cc1)CC(=O)C 34a_100011218180_100011218213 [1,0,0,0,0,0|3,0,0]=4 328 B14R1.68 CSCOc1ccc(cc1)NC(=O)C 34a_100000184395_100011218213 [1,0,0,0,0,0|3,0,0]=4 329 B14R1.68 CSCSc1ccc(cc1)CC(=O)C 62a_100000691760_100011218213 [1,0,0,0,0,0|3,0,0]=4 330 B14R1.68 CSCSc1ccc(cc1)CC(=O)C 62a_100011218213_100000691760 [1,0,0,0,0,0|3,0,0]=4 331 B14R1.68 CSCSc1ccc(cc1)NC(=O)C 62a_100011218213_100000155215 [1,0,0,0,0,0|3,0,0]=4 332 B14R1.68 CSCSc1ccc(cc1)OC(=O)C 62a_100011218213_100000002173 [1,0,0,0,0,0|2,0,0]=3 333 B14R1.68 CSCSc1ccc(cc1)OC(=S)C 62a_100011218213_200009816735 [1,0,0,0,0,0|2,1,0]=4 334 B14R1.68 CSCSc1ccc(cc1)SC(=O)C 62a_200009995050_100011218213 [1,0,0,0,0,0|2,1,0]=4 335 B14R1.68 NC(=O)Cc1ccc(cc1)NCC=O 2230a_100000738315_200015260668 [1,0,0,0,0,0|3,0,0]=4 336 B14R1.68 NC(=O)Cc1ccc(cc1)NCC=O 34a_100000738315_200009817547 [1,0,0,0,0,0|3,0,0]=4 337 B14R1.68 NC(=O)Cc1ccc(cc1)OCC=O 34a_100000020825_200009817547 [1,0,0,0,0,0|3,0,0]=4 338 B14R1.68 NC(=O)Cc1ccc(cc1)SCC=O 62a_100000162331_200015260668 [1,0,0,0,0,0|3,0,0]=4 339 B14R1.68 NC(=O)Cc1ccc(cc1)SCC=O 62a_200015260668_100000162331 [1,0,0,0,0,0|3,0,0]=4 340 B14R1.68 NC(=O)Nc1ccc(cc1)SCC=O 62a_200015260668_100000198584 [1,0,0,0,0,0|3,0,0]=4 341 B14R1.142 C/C=C/c1ccc(cc1)SCC(=O)N 62a_100000747473_100016259036 [1,0,0,0,0,0|3,0,0]=4 342 B14R1.142 C/C=C/c1ccc(cc1)SCC(=O)N 62a_100016259036_100000747473 [1,0,0,0,0,0|3,0,0]=4 343 B14R1.142 C/C=C/c1ccc(cc1)SCC(=O)[O-] 62a_100016259036_100020667443 [1,0,0,0,0,0|3,0,0]=4 344 B14R1.142 C/C=C/c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100016259036 [1,0,0,0,0,0|3,0,0]=4 345 B14R1.142 C=C(C)CNc1ccc(cc1)OCC 2230a_100000739623_100000748629 [1,0,0,0,0,0|2,0,1]=4 346 B14R1.142 C=C(C)CNc1ccc(cc1)OCC 34a_100000739623_100000748629 [1,0,0,0,0,0|2,0,1]=4 347 B14R1.142 C=C(C)COc1ccc(cc1)OCC 34a_100000185467_100000748629 [1,0,0,0,0,0|2,0,1]=4 348 B14R1.142 C=C(C)CSc1ccc(cc1)/C=C/C 62a_100000748629_100016259036 [1,0,0,0,0,0|3,0,0]=4 349 B14R1.142 C=C(C)CSc1ccc(cc1)/C=C/C 62a_100016259036_100000211660 [1,0,0,0,0,0|3,0,0]=4 350 B14R1.142 C=C(C)CSc1ccc(cc1)CC=O 62a_100000748629_100011361690 [1,0,0,0,0,0|3,0,0]=4 351 B14R1.142 C=C(C)CSc1ccc(cc1)CC=O 62a_100011361690_100000211660 [1,0,0,0,0,0|3,0,0]=4 352 B14R1.142 C=C(C)CSc1ccc(cc1)OCC 62a_100000748629_100000171712 [1,0,0,0,0,0|2,0,1]=4 353 B14R1.142 C=C=Cc1ccc(cc1)CCC(=O)C 271570a_100015277604_100000723691 [1,0,0,0,0,0|1,0,2]=4 354 B14R1.142 C=COc1ccc(cc1)SCC(=C)C 62a_100000704263_100000211660 [1,0,0,0,0,0|2,0,1]=4 355 B14R1.142 C=COc1ccc(cc1)SCC(=C)C 62a_100000748629_100000704263 [1,0,0,0,0,0|2,0,1]=4 356 B14R1.142 C=COc1ccc(cc1)SCC(=O)N 62a_100000704263_100000747473 [1,0,0,0,0,0|2,0,1]=4 357 B14R1.142 C=COc1ccc(cc1)SCC(=O)N 62a_100000747473_100000704263 [1,0,0,0,0,0|2,0,1]=4 358 B14R1.142 C=COc1ccc(cc1)SCC(=O)[O-] 62a_100000704263_100020667443 [1,0,0,0,0,0|2,0,1]=4 359 B14R1.142 C=COc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000704263 [1,0,0,0,0,0|2,0,1]=4 360 B14R1.142 CC(=O)CCc1ccc(cc1)OCF 34a_100000198047_100015361967 [1,0,0,0,0,0|1,0,1]=3 361 B14R1.142 CC(=O)CCc1ccc(cc1)OCF 7a_100000198047_100015361967 [1,0,0,0,0,0|1,0,1]=3 362 B14R1.142 CC(=O)CCc1ccc(cc1)SCF 62a_100000723691_100015361967 [1,0,0,0,0,0|1,1,1]=4 363 B14R1.142 CC(=O)CCc1ccc(cc1)SCF 62a_100015361967_100000723691 [1,0,0,0,0,0|1,1,1]=4 364 B14R1.142 CC=Cc1ccc(cc1)/C=C/C(=O)C 271570a_100016259895_200016259395 [1,0,0,0,0,0|1,0,2]=4 365 B14R1.142 CC=Cc1ccc(cc1)CCC(=O)C 271570a_100016259895_100000723691 [1,0,0,0,0,0|1,0,0]=2 366 B14R1.142 CC=Cc1ccc(cc1)CCC(=O)N 271570a_100016259895_200010110666 [1,0,0,0,0,0|2,0,0]=3 367 B14R1.142 CC=Cc1ccc(cc1)CNC(=O)C 271570a_100016259895_200000685173 [1,0,0,0,0,0|2,0,0]=3 368 B14R1.142 CC=Cc1ccc(cc1)NNC(=O)C 271570a_100016259895_200009815283 [1,0,0,0,0,0|3,0,0]=4 369 B14R1.142 CC=Cc1ccc(cc1)SCC(=O)N 271570a_100016259895_100000149456 [1,0,0,0,0,0|3,0,0]=4 370 B14R1.142 CCCc1ccc(cc1)CNC(=O)C 11a_100020632977_100015343762 [1,0,0,0,0,0|2,0,1]=4 371 B14R1.142 CCCc1ccc(cc1)CNC(=O)C 1626a_100020632977_100015343762 [1,0,0,0,0,0|2,0,1]=4 372 B14R1.142 CCCc1ccc(cc1)CNC(=O)C 240690a_100020632977_100015343762 [1,0,0,0,0,0|2,0,1]=4 373 B14R1.142 CCCc1ccc(cc1)CNC(=O)C 527a_100020632977_100103153847 [1,0,0,0,0,0|2,0,1]=4 374 B14R1.142 CCNc1ccc(cc1)CNC(=O)C 34a_100000755463_100000210202 [1,0,0,0,0,0|2,0,1]=4 375 B14R1.142 CCOc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_100000210202 [1,0,0,0,0,0|0,0,3]=4 376 B14R1.142 CCOc1ccc(cc1)C=CC(=O)C 1458a_100000690215_200000210301 [1,0,0,0,0,0|0,0,3]=4 377 B14R1.142 CCOc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000690215_200025704644 [1,0,0,0,0,0|0,0,3]=4 378 B14R1.142 CCOc1ccc(cc1)CCC(=O)C 1458a_100000743745_200000210301 [1,0,0,0,0,0|0,0,1]=2 379 B14R1.142 CCOc1ccc(cc1)CCC(=O)C 34a_100000198047_100000210202 [1,0,0,0,0,0|0,0,1]=2 380 B14R1.142 CCOc1ccc(cc1)CCC(=O)C 7a_100000198047_100000210202 [1,0,0,0,0,0|0,0,1]=2 381 B14R1.142 CCOc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000743745_200025704644 [1,0,0,0,0,0|0,0,1]=2 382 B14R1.142 CCOc1ccc(cc1)CCC(C)O 34a_100000189425_100000210202 [1,0,0,0,0,0|0,0,3]=4 383 B14R1.142 CCOc1ccc(cc1)CCC(C)O 7a_100000189425_100000210202 [1,0,0,0,0,0|0,0,3]=4 384 B14R1.142 CCOc1ccc(cc1)CNC(=O)C 11a_100000185588_100015343762 [1,0,0,0,0,0|1,0,1]=3 385 B14R1.142 CCOc1ccc(cc1)CNC(=O)C 1626a_100000185588_100015343762 [1,0,0,0,0,0|1,0,1]=3 386 B14R1.142 CCOc1ccc(cc1)CNC(=O)C 240690a_100000185588_100015343762 [1,0,0,0,0,0|1,0,1]=3 387 B14R1.142 CCOc1ccc(cc1)CNC(=O)C 527a_100000185588_100103153847 [1,0,0,0,0,0|1,0,1]=3 388 B14R1.142 CCOc1ccc(cc1)NCC(=O)N 2230a_100000739623_100000747473 [1,0,0,0,0,0|2,0,1]=4 389 B14R1.142 CCOc1ccc(cc1)NCC(=O)N 34a_100000739623_100000187820 [1,0,0,0,0,0|2,0,1]=4 390 B14R1.142 CCOc1ccc(cc1)NCC(=O)[O-] 34a_100000739623_100020667443 [1,0,0,0,0,0|2,0,1]=4 391 B14R1.142 CCOc1ccc(cc1)NNC(=O)C 22a_100000738955_100000070787 [1,0,0,0,0,0|2,0,1]=4 392 B14R1.142 CCOc1ccc(cc1)OCC(=O)C 1458a_100000183567_200000210301 [1,0,0,0,0,0|1,0,1]=3 393 B14R1.142 CCOc1ccc(cc1)OCC(=O)N 34a_100000185467_100000187820 [1,0,0,0,0,0|2,0,1]=4 394 B14R1.142 CCOc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000183567_200025704644 [1,0,0,0,0,0|1,0,1]=3 395 B14R1.142 CCOc1ccc(cc1)OCC(=O)[O-] 34a_100000185467_100020667443 [1,0,0,0,0,0|2,0,1]=4 396 B14R1.142 CCOc1ccc(cc1)SCC(=O)C 1458a_100000016182_200000210301 [1,0,0,0,0,0|1,0,1]=3 397 B14R1.142 CCOc1ccc(cc1)SCC(=O)N 62a_100000747473_100000171712 [1,0,0,0,0,0|2,0,1]=4 398 B14R1.142 CCOc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000016182_200025704644 [1,0,0,0,0,0|1,0,1]=3 399 B14R1.142 CCOc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000171712 [1,0,0,0,0,0|2,0,1]=4 400 B14R1.142 CCOc1ccc(cn1)CNC(=O)C 11a_100102710506_100015343762 [1,0,0,0,0,0|2,0,1]=4 401 B14R1.142 CCOc1ccc(cn1)CNC(=O)C 1626a_100102710506_100015343762 [1,0,0,0,0,0|2,0,1]=4 402 B14R1.142 CCOc1ccc(cn1)CNC(=O)C 240690a_100102710506_100015343762 [1,0,0,0,0,0|2,0,1]=4 403 B14R1.142 CCOc1ccc(cn1)CNC(=O)C 527a_100102710506_100103153847 [1,0,0,0,0,0|2,0,1]=4 404 B14R1.142 CCSc1ccc(cc1)CCC(=O)C 62a_100000210202_100000723691 [1,0,0,0,0,0|0,1,1]=3 405 B14R1.142 CCSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000210202 [1,0,0,0,0,0|0,1,1]=3 406 B14R1.142 CCSc1ccc(cc1)CCC(=O)N 62a_100000210202_200010110666 [1,0,0,0,0,0|1,1,1]=4 407 B14R1.142 CCSc1ccc(cc1)CCC(=O)N 62a_200010110666_100000210202 [1,0,0,0,0,0|1,1,1]=4 408 B14R1.142 CCSc1ccc(cc1)CNC(=O)C 62a_100000210202_200000685173 [1,0,0,0,0,0|1,1,1]=4 409 B14R1.142 CCSc1ccc(cc1)CNC(=O)C 62a_200000685173_100000210202 [1,0,0,0,0,0|1,1,1]=4 410 B14R1.142 COCc1ccc(cc1)CNC(=O)C 11a_100000738208_100015343762 [1,0,0,0,0,0|3,0,0]=4 411 B14R1.142 COCc1ccc(cc1)CNC(=O)C 1626a_100000738208_100015343762 [1,0,0,0,0,0|3,0,0]=4 412 B14R1.142 COCc1ccc(cc1)CNC(=O)C 240690a_100000738208_100015343762 [1,0,0,0,0,0|3,0,0]=4 413 B14R1.142 COCc1ccc(cc1)CNC(=O)C 527a_100000738208_100103153847 [1,0,0,0,0,0|3,0,0]=4 414 B14R1.142 NC(=O)CSc1ccc(cc1)CC=O 62a_100000747473_100011361690 [1,0,0,0,0,0|3,0,0]=4 415 B14R1.142 NC(=O)CSc1ccc(cc1)CC=O 62a_100011361690_100000747473 [1,0,0,0,0,0|3,0,0]=4 416 B14R1.142 O=CCc1ccc(cc1)SCC(=O)[O-] 62a_100011361690_100020667443 [1,0,0,0,0,0|3,0,0]=4 417 B14R1.142 O=CCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100011361690 [1,0,0,0,0,0|3,0,0]=4 418 B16R1.602 C=C(C)CNc1ccc(cc1)N(C)C(=O)C 34a_100000229935_100000748629 [0,1,0,0,0,0|3,0,0]=4 419 B16R1.602 C=C(C)COc1ccc(cc1)N(C)C(=O)C 34a_100000743460_100000748629 [0,1,0,0,0,0|3,0,0]=4 420 B16R1.602 C=C(C)CSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100000211660 [0,1,0,0,0,0|3,0,0]=4 421 B16R1.602 CC(=C(C)c1ccc(cc1)CCC(=O)N)C 271570a_200000049429_200010110666 [0,1,0,0,0,0|3,0,0]=4 422 B16R1.602 CC(=O)CCc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100000723691 [0,1,0,0,0,0|2,0,0]=3 423 B16R1.602 CC(=O)N(C)c1ccc(cc1)NCC(=O)N 34a_100000229935_100000187820 [0,1,0,0,0,0|3,0,0]=4 424 B16R1.602 CC(=O)N(C)c1ccc(cc1)NCC(=O)[O-] 34a_100000229935_100020667443 [0,1,0,0,0,0|3,0,0]=4 425 B16R1.602 CC(=O)N(C)c1ccc(cc1)OCC(=O)N 34a_100000743460_100000187820 [0,1,0,0,0,0|3,0,0]=4 426 B16R1.602 CC(=O)N(C)c1ccc(cc1)OCC(=O)[O-] 34a_100000743460_100020667443 [0,1,0,0,0,0|3,0,0]=4 427 B16R1.602 CC(=O)N(C)c1ccc(cc1)SCC(=O)N 62a_200009816415_100000747473 [0,1,0,0,0,0|3,0,0]=4 428 B16R1.602 CC(=O)N(C)c1ccc(cc1)SCC(=O)[O-] 62a_200009816415_100020667443 [0,1,0,0,0,0|3,0,0]=4 429 B16R1.602 CC(=O)NCc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_200000685173 [0,1,0,0,0,0|3,0,0]=4 430 B16R1.1139 C#CC(C)NCc1ccc(cc1)OC(=O)C 2230a_100000707721_100000033664 [0,1,0,0,0,0|2,0,1]=4 431 B16R1.1139 C#CC(C)NCc1ccc(cc1)OC(=O)C 270004a_100000707721_100000014718 [0,1,0,0,0,0|2,0,1]=4 432 B16R1.1139 C#CC(C)SCc1ccc(cc1)OC(=O)C 62a_200000035995_100000033664 [0,1,0,0,0,0|2,0,1]=4 433 B16R1.1139 C#C[C@@H](C)OCc1ccc(cc1)OC(=O)C 7a_100009815206_100000033664 [0,1,0,0,0,0|2,0,1]=4 434 B16R1.1139 C=CC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100000185746 [0,1,0,0,0,0|2,0,1]=4 435 B16R1.1139 C=CC(=O)NCc1ccc(cc1)NC(=O)C 240690a_100000735448_200121576911 [0,1,0,0,0,0|2,0,1]=4 436 B16R1.1139 C=CC(C)SCc1ccc(cc1)OC(=O)C 62a_100011215867_100000033664 [0,1,0,0,0,0|2,0,1]=4 437 B16R1.1139 CC(=O)Nc1ccc(cc1)C=CC(=O)CF 1458a_100000735606_100015361967 [0,1,0,0,0,0|1,0,2]=4 438 B16R1.1139 CC(=O)Nc1ccc(cc1)CNC(=O)CO 240690a_100000735448_100000210174 [0,1,0,0,0,0|2,0,0]=3 439 B16R1.1139 CC(=O)Nc1ccc(cc1)CNC(=O)CO 527a_100000735448_100000210174 [0,1,0,0,0,0|2,0,0]=3 440 B16R1.1139 CC(=O)Nc1ccc(cc1)OCC(=O)CF 1458a_100011194236_100015361967 [0,1,0,0,0,0|2,0,0]=3 441 B16R1.1139 CC(=O)Oc1ccc(cc1)CNC(C)C#N 2230a_100000737613_100000033664 [0,1,0,0,0,0|2,0,1]=4 442 B16R1.1139 CC(=O)Oc1ccc(cc1)CN[C@H](C)CF 207a_100102880703_100000014718 [0,1,0,0,0,0|2,0,1]=4 443 B16R1.1139 CC(=O)Oc1ccc(cc1)CN[C@H](C)CF 270004a_100102880703_100000014718 [0,1,0,0,0,0|2,0,1]=4 444 B16R1.1139 CC(=O)Oc1ccc(cc1)CN[C@H](C)CO 207a_100000737577_100000014718 [0,1,0,0,0,0|1,0,2]=4 445 B16R1.1139 CC(=O)Oc1ccc(cc1)CN[C@H](C)CO 2230a_100000737577_100000033664 [0,1,0,0,0,0|1,0,2]=4 446 B16R1.1139 CC(=O)Oc1ccc(cc1)CN[C@H](C)CO 270004a_100000737577_100000014718 [0,1,0,0,0,0|1,0,2]=4 447 B16R1.1139 CC(=O)Oc1ccc(cc1)COC(C)CF 7a_100016041109_100000033664 [0,1,0,0,0,0|2,0,1]=4 448 B16R1.1139 CC(=O)Oc1ccc(cc1)CSC(C)C#N 62a_100000703298_100000033664 [0,1,0,0,0,0|2,0,1]=4 449 B16R1.1139 CC(=O)Oc1ccc(cc1)CSC(C)CO 62a_100012180447_100000033664 [0,1,0,0,0,0|1,0,2]=4 450 B16R1.1139 CC(=O)Oc1ccc(cc1)CS[C@H](C)CO 62a_100016084084_100000033664 [0,1,0,0,0,0|1,0,2]=4 451 B16R1.1139 CC(=O)Oc1ccc(cc1)SCC(O)CO 62a_100011219619_100000002173 [0,1,0,0,0,0|1,0,2]=4 452 B16R1.1139 CC(=O)Oc1ccc(cc1)SC[C@@H](C)CO 62a_100000059175_100000002173 [0,1,0,0,0,0|1,0,2]=4 453 B16R1.1139 CC(=O)Oc1ccc(cc1)SC[C@@H](O)CF 62a_100015614560_100000002173 [0,1,0,0,0,0|1,0,2]=4 454 B16R1.1139 CC(=O)Oc1ccc(cc1)SC[C@@H](O)CO 62a_100009815848_100000002173 [0,1,0,0,0,0|1,0,2]=4 455 B16R1.1139 CC(C)Cc1ccc(cc1)CCC(=O)CF 1458a_100000691995_100015361967 [0,1,0,0,0,0|2,0,1]=4 456 B16R1.1139 CC(C)Oc1ccc(cc1)CCC(=O)CF 1458a_100000743653_100015361967 [0,1,0,0,0,0|1,0,1]=3 457 B16R1.1139 CC(C)Oc1ccc(cc1)CCC(=O)NN 34a_100000048474_100000210206 [0,1,0,0,0,0|2,0,1]=4 458 B16R1.1139 CC(C)Oc1ccc(cc1)CNC(=O)CO 240690a_100020586559_100000210174 [0,1,0,0,0,0|2,0,1]=4 459 B16R1.1139 CC(C)Oc1ccc(cc1)CNC(=O)CO 527a_100020586559_100000210174 [0,1,0,0,0,0|2,0,1]=4 460 B16R1.1139 CCC(=O)C=Cc1ccc(cc1)NC(=O)C 1458a_100000735606_100000210202 [0,1,0,0,0,0|1,0,2]=4 461 B16R1.1139 CCC(=O)CCc1ccc(cc1)CC(C)C 1458a_100000691995_100000210202 [0,1,0,0,0,0|2,0,1]=4 462 B16R1.1139 CCC(=O)CCc1ccc(cc1)OC(C)C 1458a_100000743653_100000210202 [0,1,0,0,0,0|1,0,1]=3 463 B16R1.1139 CCC(=O)CCc1ccc(cc1)OC(F)F 1458a_100000736697_100000210202 [0,1,0,0,0,0|2,0,1]=4 464 B16R1.1139 CCC(=O)COc1ccc(cc1)CC(=O)C 7a_100011218180_100000747405 [0,1,0,0,0,0|2,0,0]=3 465 B16R1.1139 CCC(=O)COc1ccc(cc1)NC(=O)C 1458a_100011194236_100000210202 [0,1,0,0,0,0|2,0,0]=3 466 B16R1.1139 CCC(=O)COc1ccc(cc1)NC(=O)C 7a_100000184395_100000747405 [0,1,0,0,0,0|2,0,0]=3 467 B16R1.1139 CCC(=O)COc1ccc(cc1)OC(C)C 7a_100000757185_100000747405 [0,1,0,0,0,0|2,0,1]=4 468 B16R1.1139 CCC(=O)COc1ccc(nc1)NC(=O)C 7a_200000094647_100000747405 [0,1,0,0,0,0|3,0,0]=4 469 B16R1.1139 CCC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000691760_100000747405 [0,1,0,0,0,0|2,0,0]=3 470 B16R1.1139 CCC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000747405_100000691760 [0,1,0,0,0,0|2,0,0]=3 471 B16R1.1139 CCC(=O)CSc1ccc(cc1)CC(=O)N 62a_100000162331_100000747405 [0,1,0,0,0,0|3,0,0]=4 472 B16R1.1139 CCC(=O)CSc1ccc(cc1)CC(=O)N 62a_100000747405_100000162331 [0,1,0,0,0,0|3,0,0]=4 473 B16R1.1139 CCC(=O)CSc1ccc(cc1)NC(=O)C 62a_100000747405_100000155215 [0,1,0,0,0,0|2,0,0]=3 474 B16R1.1139 CCC(=O)CSc1ccc(cc1)NC(=O)N 62a_100000747405_100000198584 [0,1,0,0,0,0|3,0,0]=4 475 B16R1.1139 CCC(=O)CSc1ccc(cc1)OC(=O)C 62a_100000747405_100000002173 [0,1,0,0,0,0|1,0,0]=2 476 B16R1.1139 CCC(=O)CSc1ccc(cc1)OC(=S)C 62a_100000747405_200009816735 [0,1,0,0,0,0|1,1,0]=3 477 B16R1.1139 CCC(=O)CSc1ccc(cc1)OC(C)C 62a_100000169947_100000747405 [0,1,0,0,0,0|2,0,1]=4 478 B16R1.1139 CCC(=O)CSc1ccc(cc1)OC(C)C 62a_100000747405_100000169947 [0,1,0,0,0,0|2,0,1]=4 479 B16R1.1139 CCC(=O)CSc1ccc(cc1)SC(=O)C 62a_200009995050_100000747405 [0,1,0,0,0,0|1,1,0]=3 480 B16R1.1139 CCC(=O)CSc1ccc(cn1)NC(=O)C 62a_100000747405_100011934715 [0,1,0,0,0,0|3,0,0]=4 481 B16R1.1139 CCC(=O)CSc1ccc(nc1)NC(=O)C 62a_100000747405_100000193312 [0,1,0,0,0,0|3,0,0]=4 482 B16R1.1139 CCC(=O)NCc1ccc(cc1)NC(=O)C 11a_100000735448_100000210414 [0,1,0,0,0,0|2,0,0]=3 483 B16R1.1139 CCC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100000210414 [0,1,0,0,0,0|2,0,0]=3 484 B16R1.1139 CCC(=O)NCc1ccc(cc1)NC(=O)C 240690a_100000735448_100000210414 [0,1,0,0,0,0|2,0,0]=3 485 B16R1.1139 CCC(=O)NCc1ccc(cc1)NC(=O)C 527a_100000735448_100000210414 [0,1,0,0,0,0|2,0,0]=3 486 B16R1.1139 CCC(=O)NCc1ccc(cc1)OC(C)C 11a_100020586559_100000210414 [0,1,0,0,0,0|2,0,1]=4 487 B16R1.1139 CCC(=O)NCc1ccc(cc1)OC(C)C 1626a_100020586559_100000210414 [0,1,0,0,0,0|2,0,1]=4 488 B16R1.1139 CCC(=O)NCc1ccc(cc1)OC(C)C 240690a_100020586559_100000210414 [0,1,0,0,0,0|2,0,1]=4 489 B16R1.1139 CCC(=O)NCc1ccc(cc1)OC(C)C 527a_100020586559_100000210414 [0,1,0,0,0,0|2,0,1]=4 490 B16R1.1139 CCC(C)CSc1ccc(cc1)OC(=O)C 62a_100000748023_100000002173 [0,1,0,0,0,0|2,0,1]=4 491 B16R1.1139 CCC(C)NCc1ccc(cc1)OC(=O)C 207a_100000209981_100000014718 [0,1,0,0,0,0|2,0,1]=4 492 B16R1.1139 CCC(C)NCc1ccc(cc1)OC(=O)C 2230a_100000209981_100000033664 [0,1,0,0,0,0|2,0,1]=4 493 B16R1.1139 CCC(C)NCc1ccc(cc1)OC(=O)C 270004a_100000209981_100000014718 [0,1,0,0,0,0|2,0,1]=4 494 B16R1.1139 CCC(C)OCc1ccc(cc1)OC(=O)C 7a_100000210228_100000033664 [0,1,0,0,0,0|2,0,1]=4 495 B16R1.1139 CCC(C)SCc1ccc(cc1)OC(=O)C 62a_100000758301_100000033664 [0,1,0,0,0,0|2,0,1]=4 496 B16R1.1139 CCC(O)CSc1ccc(cc1)OC(=O)C 62a_100011218378_100000002173 [0,1,0,0,0,0|1,0,2]=4 497 B16R1.1139 CC[C@H](C)CSc1ccc(cc1)OC(=O)C 62a_100009816398_100000002173 [0,1,0,0,0,0|2,0,1]=4 498 B16R1.1139 CNC(=O)C=Cc1ccc(cc1)NC(=O)C 11a_106832991635_100000735606 [0,1,0,0,0,0|1,0,2]=4 499 B16R1.1139 CNC(=O)C=Cc1ccc(cc1)NC(=O)C 240690a_100102657272_100000735606 [0,1,0,0,0,0|1,0,2]=4 500 B16R1.1139 CNC(=O)CCc1ccc(cc1)C=C(C)C 271570a_100102525489_200010273138 [0,1,0,0,0,0|2,0,0]=3 501 B16R1.1139 CNC(=O)CCc1ccc(cc1)CC(C)C 11a_106832991635_100000691995 [0,1,0,0,0,0|2,0,1]=4 502 B16R1.1139 CNC(=O)CCc1ccc(cc1)CC(C)C 1626a_100102657272_100000691995 [0,1,0,0,0,0|2,0,1]=4 503 B16R1.1139 CNC(=O)CCc1ccc(cc1)CC(C)C 240690a_100102657272_100000691995 [0,1,0,0,0,0|2,0,1]=4 504 B16R1.1139 CNC(=O)CCc1ccc(cc1)CC(C)C 527a_100102657272_100000691995 [0,1,0,0,0,0|2,0,1]=4 505 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(=O)C 11a_106832991635_200000064328 [0,1,0,0,0,0|0,0,0]=1 506 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(=O)C 1626a_100102657272_200000064328 [0,1,0,0,0,0|0,0,0]=1 507 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(=O)C 240690a_100102657272_200000064328 [0,1,0,0,0,0|0,0,0]=1 508 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(C)C 11a_106832991635_100000743653 [0,1,0,0,0,0|1,0,1]=3 509 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(C)C 1626a_100102657272_100000743653 [0,1,0,0,0,0|1,0,1]=3 510 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(C)C 240690a_100102657272_100000743653 [0,1,0,0,0,0|1,0,1]=3 511 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(C)C 527a_100102657272_100000743653 [0,1,0,0,0,0|1,0,1]=3 512 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(F)F 11a_106832991635_100000736697 [0,1,0,0,0,0|2,0,1]=4 513 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(F)F 1626a_100102657272_100000736697 [0,1,0,0,0,0|2,0,1]=4 514 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(F)F 240690a_100102657272_100000736697 [0,1,0,0,0,0|2,0,1]=4 515 B16R1.1139 CNC(=O)CCc1ccc(cc1)OC(F)F 527a_100102657272_100000736697 [0,1,0,0,0,0|2,0,1]=4 516 B16R1.1139 CNC(=O)CCc1ccc(cc1)SC(C)C 62a_100000210206_200010273138 [0,1,0,0,0,0|1,1,1]=4 517 B16R1.1139 CNC(=O)CCc1ccc(cc1)SC(C)C 62a_200010273138_100000210206 [0,1,0,0,0,0|1,1,1]=4 518 B16R1.1139 CNC(=O)CNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000183359 [0,1,0,0,0,0|3,0,0]=4 519 B16R1.1139 CNC(=O)CNc1ccc(cc1)CC(=O)N 34a_100000738315_100000183359 [0,1,0,0,0,0|3,0,0]=4 520 B16R1.1139 CNC(=O)CNc1ccc(cc1)NC(=O)C 34a_100000184111_100000183359 [0,1,0,0,0,0|2,0,0]=3 521 B16R1.1139 CNC(=O)CNc1ccc(cc1)OC(C)C 2230a_100011194259_100000183359 [0,1,0,0,0,0|2,0,1]=4 522 B16R1.1139 CNC(=O)CNc1ccc(cc1)OC(C)C 34a_100011194259_100000183359 [0,1,0,0,0,0|2,0,1]=4 523 B16R1.1139 CNC(=O)COc1ccc(cc1)C=C(C)C 271570a_100102525489_200000150405 [0,1,0,0,0,0|3,0,0]=4 524 B16R1.1139 CNC(=O)COc1ccc(cc1)CC(=O)C 34a_100011218180_100000183359 [0,1,0,0,0,0|2,0,0]=3 525 B16R1.1139 CNC(=O)COc1ccc(cc1)CC(=O)C 7a_100011218180_100000183359 [0,1,0,0,0,0|2,0,0]=3 526 B16R1.1139 CNC(=O)COc1ccc(cc1)CC(=O)N 34a_100000020825_100000183359 [0,1,0,0,0,0|3,0,0]=4 527 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 11a_100000752409_100015343762 [0,1,0,0,0,0|2,0,0]=3 528 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 11a_106832991635_100011194236 [0,1,0,0,0,0|2,0,0]=3 529 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 1626a_100000752409_100015343762 [0,1,0,0,0,0|2,0,0]=3 530 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 1626a_100102657272_100011194236 [0,1,0,0,0,0|2,0,0]=3 531 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 22a_100000752409_100000070787 [0,1,0,0,0,0|2,0,0]=3 532 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 240690a_100102657272_100011194236 [0,1,0,0,0,0|2,0,0]=3 533 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 34a_100000184395_100000183359 [0,1,0,0,0,0|2,0,0]=3 534 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 527a_100000752409_100103153847 [0,1,0,0,0,0|2,0,0]=3 535 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 527a_100102657272_100011194236 [0,1,0,0,0,0|2,0,0]=3 536 B16R1.1139 CNC(=O)COc1ccc(cc1)NC(=O)C 7a_100000184395_100000183359 [0,1,0,0,0,0|2,0,0]=3 537 B16R1.1139 CNC(=O)COc1ccc(cc1)OC(C)C 34a_100000757185_100000183359 [0,1,0,0,0,0|2,0,1]=4 538 B16R1.1139 CNC(=O)COc1ccc(cc1)OC(C)C 7a_100000757185_100000183359 [0,1,0,0,0,0|2,0,1]=4 539 B16R1.1139 CNC(=O)COc1ccc(nc1)NC(=O)C 34a_200000094647_100000183359 [0,1,0,0,0,0|3,0,0]=4 540 B16R1.1139 CNC(=O)COc1ccc(nc1)NC(=O)C 7a_200000094647_100000183359 [0,1,0,0,0,0|3,0,0]=4 541 B16R1.1139 CNC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000183359_100000691760 [0,1,0,0,0,0|2,0,0]=3 542 B16R1.1139 CNC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000691760_100000183359 [0,1,0,0,0,0|2,0,0]=3 543 B16R1.1139 CNC(=O)CSc1ccc(cc1)CC(=O)N 62a_100000162331_100000183359 [0,1,0,0,0,0|3,0,0]=4 544 B16R1.1139 CNC(=O)CSc1ccc(cc1)CC(=O)N 62a_100000183359_100000162331 [0,1,0,0,0,0|3,0,0]=4 545 B16R1.1139 CNC(=O)CSc1ccc(cc1)NC(=O)C 62a_100000183359_100000155215 [0,1,0,0,0,0|2,0,0]=3 546 B16R1.1139 CNC(=O)CSc1ccc(cc1)NC(=O)N 62a_100000183359_100000198584 [0,1,0,0,0,0|3,0,0]=4 547 B16R1.1139 CNC(=O)CSc1ccc(cc1)OC(=O)C 62a_100000183359_100000002173 [0,1,0,0,0,0|1,0,0]=2 548 B16R1.1139 CNC(=O)CSc1ccc(cc1)OC(=S)C 62a_100000183359_200009816735 [0,1,0,0,0,0|1,1,0]=3 549 B16R1.1139 CNC(=O)CSc1ccc(cc1)OC(C)C 62a_100000169947_100000183359 [0,1,0,0,0,0|2,0,1]=4 550 B16R1.1139 CNC(=O)CSc1ccc(cc1)OC(C)C 62a_100000183359_100000169947 [0,1,0,0,0,0|2,0,1]=4 551 B16R1.1139 CNC(=O)CSc1ccc(cc1)SC(=O)C 62a_200009995050_100000183359 [0,1,0,0,0,0|1,1,0]=3 552 B16R1.1139 CNC(=O)CSc1ccc(cn1)NC(=O)C 62a_100000183359_100011934715 [0,1,0,0,0,0|3,0,0]=4 553 B16R1.1139 CNC(=O)CSc1ccc(nc1)NC(=O)C 62a_100000183359_100000193312 [0,1,0,0,0,0|3,0,0]=4 554 B16R1.1139 CNC(=O)NCc1ccc(cc1)NC(=O)C 2708a_100000735448_106832991635 [0,1,0,0,0,0|2,0,0]=3 555 B16R1.1139 CNC(=O)NCc1ccc(cc1)NC(=O)C 2708a_100102657272_100000735448 [0,1,0,0,0,0|2,0,0]=3 556 B16R1.1139 CNC(=O)NCc1ccc(cc1)NC(=O)C 273464a_100000735448_100102657272 [0,1,0,0,0,0|2,0,0]=3 557 B16R1.1139 CNC(=O)NCc1ccc(cc1)NC(=O)C 273464a_100102657272_100000735448 [0,1,0,0,0,0|2,0,0]=3 558 B16R1.1139 CNC(=O)NCc1ccc(cc1)NC(=O)C 512a_100000735448_100102657272 [0,1,0,0,0,0|2,0,0]=3 559 B16R1.1139 CNC(=O)NCc1ccc(cc1)NC(=O)C 512a_106832991638_100000735448 [0,1,0,0,0,0|2,0,0]=3 560 B16R1.1139 CNC(=O)NCc1ccc(cc1)OC(C)C 2708a_100020586559_106832991635 [0,1,0,0,0,0|2,0,1]=4 561 B16R1.1139 CNC(=O)NCc1ccc(cc1)OC(C)C 2708a_100102657272_100020586559 [0,1,0,0,0,0|2,0,1]=4 562 B16R1.1139 CNC(=O)NCc1ccc(cc1)OC(C)C 273464a_100020586559_100102657272 [0,1,0,0,0,0|2,0,1]=4 563 B16R1.1139 CNC(=O)NCc1ccc(cc1)OC(C)C 273464a_100102657272_100020586559 [0,1,0,0,0,0|2,0,1]=4 564 B16R1.1139 CNC(=O)NCc1ccc(cc1)OC(C)C 512a_100020586559_100102657272 [0,1,0,0,0,0|2,0,1]=4 565 B16R1.1139 CNC(=O)NCc1ccc(cc1)OC(C)C 512a_106832991638_100020586559 [0,1,0,0,0,0|2,0,1]=4 566 B16R1.1139 CNC(C)CCc1ccc(cc1)OC(=O)C 270004a_106832991635_100000002119 [0,1,0,0,0,0|1,0,1]=3 567 B16R1.1139 COC(=O)/C=C/c1ccc(cc1)CC(=O)C 1458a_100000070787_100016987420 [0,1,0,0,0,0|1,0,2]=4 568 B16R1.1139 COC(=O)/C=C/c1ccc(cc1)NC(=O)C 188690a_100102524928_100015343762 [0,1,0,0,0,0|1,0,2]=4 569 B16R1.1139 COC(=O)CCc1ccc(cc1)C=C(C)C 271570a_100102525489_100012357364 [0,1,0,0,0,0|2,0,0]=3 570 B16R1.1139 COC(=O)CCc1ccc(cc1)NC(=O)C 188690a_100000751780_100015343762 [0,1,0,0,0,0|1,0,0]=2 571 B16R1.1139 COC(=O)CCc1ccc(cc1)OC(C)C 34a_100000032826_100000210206 [0,1,0,0,0,0|1,0,1]=3 572 B16R1.1139 COC(=O)CCc1ccc(cc1)OC(C)C 7a_100000032826_100000210206 [0,1,0,0,0,0|1,0,1]=3 573 B16R1.1139 COC(=O)CCc1ccc(cc1)SC(C)C 62a_100000210206_100012357364 [0,1,0,0,0,0|1,1,1]=4 574 B16R1.1139 COC(=O)CCc1ccc(cc1)SC(C)C 62a_100012357364_100000210206 [0,1,0,0,0,0|1,1,1]=4 575 B16R1.1139 COC(=O)CNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000747449 [0,1,0,0,0,0|3,0,0]=4 576 B16R1.1139 COC(=O)CNc1ccc(cc1)CC(=O)N 34a_100000738315_100000747449 [0,1,0,0,0,0|3,0,0]=4 577 B16R1.1139 COC(=O)CNc1ccc(cc1)NC(=O)C 34a_100000184111_100000747449 [0,1,0,0,0,0|2,0,0]=3 578 B16R1.1139 COC(=O)CNc1ccc(cc1)OC(C)C 2230a_100011194259_100000747449 [0,1,0,0,0,0|2,0,1]=4 579 B16R1.1139 COC(=O)CNc1ccc(cc1)OC(C)C 34a_100011194259_100000747449 [0,1,0,0,0,0|2,0,1]=4 580 B16R1.1139 COC(=O)CNc1ccc(cc1)OC(C)C 34a_100016989482_100000210206 [0,1,0,0,0,0|2,0,1]=4 581 B16R1.1139 COC(=O)COc1ccc(cc1)C=C(C)C 271570a_100102525489_100000149925 [0,1,0,0,0,0|3,0,0]=4 582 B16R1.1139 COC(=O)COc1ccc(cc1)CC(=O)C 34a_100011218180_100000747449 [0,1,0,0,0,0|2,0,0]=3 583 B16R1.1139 COC(=O)COc1ccc(cc1)CC(=O)C 7a_100011218180_100000747449 [0,1,0,0,0,0|2,0,0]=3 584 B16R1.1139 COC(=O)COc1ccc(cc1)CC(=O)N 34a_100000020825_100000747449 [0,1,0,0,0,0|3,0,0]=4 585 B16R1.1139 COC(=O)COc1ccc(cc1)NC(=O)C 188690a_100000187534_100015343762 [0,1,0,0,0,0|2,0,0]=3 586 B16R1.1139 COC(=O)COc1ccc(cc1)NC(=O)C 34a_100000184395_100000747449 [0,1,0,0,0,0|2,0,0]=3 587 B16R1.1139 COC(=O)COc1ccc(cc1)NC(=O)C 7a_100000184395_100000747449 [0,1,0,0,0,0|2,0,0]=3 588 B16R1.1139 COC(=O)COc1ccc(cc1)OC(C)C 34a_100000757185_100000747449 [0,1,0,0,0,0|2,0,1]=4 589 B16R1.1139 COC(=O)COc1ccc(cc1)OC(C)C 7a_100000757185_100000747449 [0,1,0,0,0,0|2,0,1]=4 590 B16R1.1139 COC(=O)COc1ccc(nc1)NC(=O)C 34a_200000094647_100000747449 [0,1,0,0,0,0|3,0,0]=4 591 B16R1.1139 COC(=O)COc1ccc(nc1)NC(=O)C 7a_200000094647_100000747449 [0,1,0,0,0,0|3,0,0]=4 592 B16R1.1139 COC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000691760_100000747449 [0,1,0,0,0,0|2,0,0]=3 593 B16R1.1139 COC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000747449_100000691760 [0,1,0,0,0,0|2,0,0]=3 594 B16R1.1139 COC(=O)CSc1ccc(cc1)CC(=O)N 62a_100000162331_100000747449 [0,1,0,0,0,0|3,0,0]=4 595 B16R1.1139 COC(=O)CSc1ccc(cc1)CC(=O)N 62a_100000747449_100000162331 [0,1,0,0,0,0|3,0,0]=4 596 B16R1.1139 COC(=O)CSc1ccc(cc1)NC(=O)C 62a_100000747449_100000155215 [0,1,0,0,0,0|2,0,0]=3 597 B16R1.1139 COC(=O)CSc1ccc(cc1)NC(=O)N 62a_100000747449_100000198584 [0,1,0,0,0,0|3,0,0]=4 598 B16R1.1139 COC(=O)CSc1ccc(cc1)OC(=O)C 62a_100000747449_100000002173 [0,1,0,0,0,0|1,0,0]=2 599 B16R1.1139 COC(=O)CSc1ccc(cc1)OC(=S)C 62a_100000747449_200009816735 [0,1,0,0,0,0|1,1,0]=3 600 B16R1.1139 COC(=O)CSc1ccc(cc1)OC(C)C 62a_100000169947_100000747449 [0,1,0,0,0,0|2,0,1]=4 601 B16R1.1139 COC(=O)CSc1ccc(cc1)OC(C)C 62a_100000747449_100000169947 [0,1,0,0,0,0|2,0,1]=4 602 B16R1.1139 COC(=O)CSc1ccc(cc1)SC(=O)C 62a_200009995050_100000747449 [0,1,0,0,0,0|1,1,0]=3 603 B16R1.1139 COC(=O)CSc1ccc(cn1)NC(=O)C 62a_100000747449_100011934715 [0,1,0,0,0,0|3,0,0]=4 604 B16R1.1139 COC(=O)CSc1ccc(nc1)NC(=O)C 62a_100000747449_100000193312 [0,1,0,0,0,0|3,0,0]=4 605 B16R1.1139 COC(C)SCc1ccc(cc1)OC(=O)C 62a_100009879195_100000033664 [0,1,0,0,0,0|1,0,2]=4 606 B16R1.1139 O=C(CF)CCc1ccc(cc1)OC(F)F 1458a_100000736697_100015361967 [0,1,0,0,0,0|2,0,1]=4 607 B16R1.1282 C=C(C)CC(=O)c1ccc(cc1)NC(=O)C 1458a_100000185149_100000748629 [0,1,0,0,0,0|2,0,1]=4 608 B16R1.1282 C=C(C)CN(C)c1ccc(cc1)NC(=O)C 2230a_100000219403_100000748629 [0,1,0,0,0,0|3,0,0]=4 609 B16R1.1282 C=C(C)CN(C)c1ccc(cc1)NC(=O)C 269982a_100000219403_100000748629 [0,1,0,0,0,0|3,0,0]=4 610 B16R1.1282 C=C(C)CN(C)c1ccc(cc1)NC(=O)C 34a_100000219403_100000748629 [0,1,0,0,0,0|3,0,0]=4 611 B16R1.1282 C=C(C)CN(C)c1ccc(cc1)NC(=O)C 38a_100000219403_100000748629 [0,1,0,0,0,0|3,0,0]=4 612 B16R1.1282 CC(=O)CC(=O)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000184285 [0,1,0,0,0,0|2,0,1]=4 613 B16R1.1282 CC(=O)CC(=O)c1ccc(cc1)NC(=O)C 1458a_100000070787_100000183838 [0,1,0,0,0,0|1,0,1]=3 614 B16R1.1282 CC(=O)CC(=O)c1ccc(cc1)OC(=O)C 1458a_100000070787_100010246728 [0,1,0,0,0,0|0,0,1]=2 615 B16R1.1282 CC(=O)CC(=O)c1ccc(cc1)OC(C)C 1458a_100000070787_100000748467 [0,1,0,0,0,0|1,0,2]=4 616 B16R1.1282 CC(=O)Cc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000691760 [0,1,0,0,0,0|2,0,1]=4 617 B16R1.1282 CC(=O)NC(C)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000153805 [0,1,0,0,0,0|3,0,0]=4 618 B16R1.1282 CC(=O)N[C@@H](C)c1ccc(cc1)OC(C)C 11a_100161155966_100015343762 [0,1,0,0,0,0|2,0,1]=4 619 B16R1.1282 CC(=O)N[C@@H](C)c1ccc(cc1)OC(C)C 1626a_100161155966_100015343762 [0,1,0,0,0,0|2,0,1]=4 620 B16R1.1282 CC(=O)N[C@@H](C)c1ccc(cc1)OC(C)C 240690a_100161155966_100015343762 [0,1,0,0,0,0|2,0,1]=4 621 B16R1.1282 CC(=O)N[C@@H](C)c1ccc(cc1)OC(C)C 527a_100161155966_100103153847 [0,1,0,0,0,0|2,0,1]=4 622 B16R1.1282 CC(=O)Nc1ccc(cc1)C(=O)CC(=O)N 1458a_100000185149_100000187820 [0,1,0,0,0,0|2,0,1]=4 623 B16R1.1282 CC(=O)Nc1ccc(cc1)C(=O)CC(=O)[O-] 1458a_100000185149_100020667443 [0,1,0,0,0,0|2,0,1]=4 624 B16R1.1282 CC(=O)Nc1ccc(cc1)N(C)CC(=O)N 2230a_100000219403_100000747473 [0,1,0,0,0,0|3,0,0]=4 625 B16R1.1282 CC(=O)Nc1ccc(cc1)N(C)CC(=O)N 269982a_100000219403_100000187820 [0,1,0,0,0,0|3,0,0]=4 626 B16R1.1282 CC(=O)Nc1ccc(cc1)N(C)CC(=O)N 34a_100000219403_100000187820 [0,1,0,0,0,0|3,0,0]=4 627 B16R1.1282 CC(=O)Nc1ccc(cc1)N(C)CC(=O)N 38a_100000219403_100000747473 [0,1,0,0,0,0|3,0,0]=4 628 B16R1.1282 CC(=O)Nc1ccc(cc1)N(C)CC(=O)[O-] 269982a_100000219403_100020667443 [0,1,0,0,0,0|3,0,0]=4 629 B16R1.1282 CC(=O)Nc1ccc(cc1)N(C)CC(=O)[O-] 34a_100000219403_100020667443 [0,1,0,0,0,0|3,0,0]=4 630 B16R1.1282 CC(=O)Nc1ccc(cc1)N(C)CC(=O)[O-] 38a_100000219403_100020667443 [0,1,0,0,0,0|3,0,0]=4 631 B16R1.1282 CC(=O)Nc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000155215 [0,1,0,0,0,0|2,0,1]=4 632 B16R1.1282 CC(=O)Oc1ccc(cc1)C(=O)CN(C)C 2230a_100102631434_100010246728 [0,1,0,0,0,0|2,0,1]=4 633 B16R1.1282 CC(=O)Oc1ccc(cc1)C(=O)CN(C)C 269982a_100102631434_100010246728 [0,1,0,0,0,0|2,0,1]=4 634 B16R1.1282 CC(=O)Oc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000002173 [0,1,0,0,0,0|1,0,1]=3 635 B16R1.1282 CC(=O)Sc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_200009995050 [0,1,0,0,0,0|1,1,1]=4 636 B16R1.1282 CC(=S)Oc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_200009816735 [0,1,0,0,0,0|1,1,1]=4 637 B16R1.1283 C=C(C)C(=O)Cc1ccc(cc1)NC(=O)C 1458a_100000185857_100000731167 [0,1,0,0,0,0|2,0,1]=4 638 B16R1.1283 C=C(C)C(=O)Nc1ccc(cc1)OC(=O)C 11a_100009829859_100000185857 [0,1,0,0,0,0|2,0,1]=4 639 B16R1.1283 C=C(C)C(=O)Nc1ccc(cc1)OC(=O)C 1626a_100009829859_100000185857 [0,1,0,0,0,0|2,0,1]=4 640 B16R1.1283 C=C(C)C(=O)Nc1ccc(cc1)OC(=O)C 22a_100009829859_100000185857 [0,1,0,0,0,0|2,0,1]=4 641 B16R1.1283 CC(=O)C(C)Nc1ccc(cc1)CC(=O)N 2230a_100000738315_100009814033 [0,1,0,0,0,0|3,0,0]=4 642 B16R1.1283 CC(=O)C(C)Nc1ccc(cc1)OC(C)C 2230a_100011194259_100009814033 [0,1,0,0,0,0|2,0,1]=4 643 B16R1.1283 CC(=O)C(C)Oc1ccc(cc1)OC(C)C 7a_100000757185_100000179758 [0,1,0,0,0,0|2,0,1]=4 644 B16R1.1283 CC(=O)C(C)Sc1ccc(cc1)CC(=O)N 62a_100000162331_100009814033 [0,1,0,0,0,0|3,0,0]=4 645 B16R1.1283 CC(=O)C(C)Sc1ccc(cc1)CC(=O)N 62a_100009814033_100000162331 [0,1,0,0,0,0|3,0,0]=4 646 B16R1.1283 CC(=O)C(C)Sc1ccc(cc1)NC(=O)N 62a_100009814033_100000198584 [0,1,0,0,0,0|3,0,0]=4 647 B16R1.1283 CC(=O)C(C)Sc1ccc(cc1)OC(=S)C 62a_100009814033_200009816735 [0,1,0,0,0,0|1,1,0]=3 648 B16R1.1283 CC(=O)C(C)Sc1ccc(cc1)OC(C)C 62a_100000169947_100009814033 [0,1,0,0,0,0|2,0,1]=4 649 B16R1.1283 CC(=O)C(C)Sc1ccc(cc1)OC(C)C 62a_100009814033_100000169947 [0,1,0,0,0,0|2,0,1]=4 650 B16R1.1283 CC(=O)Cc1ccc(cc1)OC(C)C(=O)C 7a_100011218180_100000179758 [0,1,0,0,0,0|2,0,0]=3 651 B16R1.1283 CC(=O)Cc1ccc(cc1)OC(C)C(=O)N 34a_100011218180_100000702099 [0,1,0,0,0,0|3,0,0]=4 652 B16R1.1283 CC(=O)Cc1ccc(cc1)OC(C)C(=O)N 7a_100011218180_100000702099 [0,1,0,0,0,0|3,0,0]=4 653 B16R1.1283 CC(=O)Cc1ccc(cc1)OC(F)C(=O)N 34a_100011218180_100009813875 [0,1,0,0,0,0|3,0,0]=4 654 B16R1.1283 CC(=O)Cc1ccc(cc1)OC(F)C(=O)N 7a_100011218180_100009813875 [0,1,0,0,0,0|3,0,0]=4 655 B16R1.1283 CC(=O)Cc1ccc(cc1)OC(F)C(=O)[O-] 34a_100011218180_100020610796 [0,1,0,0,0,0|3,0,0]=4 656 B16R1.1283 CC(=O)Cc1ccc(cc1)SC(C)C(=O)C 62a_100000691760_100009814033 [0,1,0,0,0,0|2,0,0]=3 657 B16R1.1283 CC(=O)Cc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000691760 [0,1,0,0,0,0|2,0,0]=3 658 B16R1.1283 CC(=O)Cc1ccc(cc1)SC(C)C(=O)N 62a_100000691760_100000702099 [0,1,0,0,0,0|3,0,0]=4 659 B16R1.1283 CC(=O)Cc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000691760 [0,1,0,0,0,0|3,0,0]=4 660 B16R1.1283 CC(=O)Cc1ccc(cc1)SC(F)C(=O)N 62a_100000691760_100009813875 [0,1,0,0,0,0|3,0,0]=4 661 B16R1.1283 CC(=O)Cc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100000691760 [0,1,0,0,0,0|3,0,0]=4 662 B16R1.1283 CC(=O)Cc1ccc(cc1)SC(F)C(=O)[O-] 62a_100000691760_100020610796 [0,1,0,0,0,0|3,0,0]=4 663 B16R1.1283 CC(=O)Cc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100000691760 [0,1,0,0,0,0|3,0,0]=4 664 B16R1.1283 CC(=O)N(C)Cc1ccc(cc1)OC(C)C 11a_100000713913_100015343762 [0,1,0,0,0,0|2,0,1]=4 665 B16R1.1283 CC(=O)N(C)Cc1ccc(cc1)OC(C)C 1626a_100000713913_100015343762 [0,1,0,0,0,0|2,0,1]=4 666 B16R1.1283 CC(=O)N(C)Cc1ccc(cc1)OC(C)C 240690a_100000713913_100015343762 [0,1,0,0,0,0|2,0,1]=4 667 B16R1.1283 CC(=O)N(C)Cc1ccc(cc1)OC(C)C 527a_100000713913_100103153847 [0,1,0,0,0,0|2,0,1]=4 668 B16R1.1283 CC(=O)Nc1ccc(cc1)CC(C)N(C)C 270004a_100102631434_200000079293 [0,1,0,0,0,0|3,0,0]=4 669 B16R1.1283 CC(=O)Nc1ccc(cc1)NC(C)C(=O)N 34a_100000184111_100000702099 [0,1,0,0,0,0|3,0,0]=4 670 B16R1.1283 CC(=O)Nc1ccc(cc1)NC(F)C(=O)N 34a_100000184111_100009813875 [0,1,0,0,0,0|3,0,0]=4 671 B16R1.1283 CC(=O)Nc1ccc(cc1)NC(F)C(=O)[O-] 34a_100000184111_100020610796 [0,1,0,0,0,0|3,0,0]=4 672 B16R1.1283 CC(=O)Nc1ccc(cc1)OC(C)C(=O)C 7a_100000184395_100000179758 [0,1,0,0,0,0|2,0,0]=3 673 B16R1.1283 CC(=O)Nc1ccc(cc1)OC(C)C(=O)N 34a_100000184395_100000702099 [0,1,0,0,0,0|3,0,0]=4 674 B16R1.1283 CC(=O)Nc1ccc(cc1)OC(C)C(=O)N 7a_100000184395_100000702099 [0,1,0,0,0,0|3,0,0]=4 675 B16R1.1283 CC(=O)Nc1ccc(cc1)OC(F)C(=O)N 34a_100000184395_100009813875 [0,1,0,0,0,0|3,0,0]=4 676 B16R1.1283 CC(=O)Nc1ccc(cc1)OC(F)C(=O)N 7a_100000184395_100009813875 [0,1,0,0,0,0|3,0,0]=4 677 B16R1.1283 CC(=O)Nc1ccc(cc1)OC(F)C(=O)[O-] 34a_100000184395_100020610796 [0,1,0,0,0,0|3,0,0]=4 678 B16R1.1283 CC(=O)Nc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000155215 [0,1,0,0,0,0|2,0,0]=3 679 B16R1.1283 CC(=O)Nc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000155215 [0,1,0,0,0,0|3,0,0]=4 680 B16R1.1283 CC(=O)Nc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100000155215 [0,1,0,0,0,0|3,0,0]=4 681 B16R1.1283 CC(=O)Nc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100000155215 [0,1,0,0,0,0|3,0,0]=4 682 B16R1.1283 CC(=O)Nc1ccc(cn1)OC(C)C(=O)C 7a_200000094647_100000179758 [0,1,0,0,0,0|3,0,0]=4 683 B16R1.1283 CC(=O)Nc1ccc(cn1)SC(C)C(=O)C 62a_100009814033_100000193312 [0,1,0,0,0,0|3,0,0]=4 684 B16R1.1283 CC(=O)Nc1ccc(nc1)SC(C)C(=O)C 62a_100009814033_100011934715 [0,1,0,0,0,0|3,0,0]=4 685 B16R1.1283 CC(=O)Oc1ccc(cc1)CN(C)C(C)C 269982a_200000211004_100000033664 [0,1,0,0,0,0|2,0,1]=4 686 B16R1.1283 CC(=O)Oc1ccc(cc1)CN(C)C(C)C 270004a_200000211004_100000014718 [0,1,0,0,0,0|2,0,1]=4 687 B16R1.1283 CC(=O)Oc1ccc(cc1)NC(=O)C(=O)N 22a_100009829859_100011215815 [0,1,0,0,0,0|2,0,1]=4 688 B16R1.1283 CC(=O)Oc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000002173 [0,1,0,0,0,0|1,0,0]=2 689 B16R1.1283 CC(=O)Oc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000002173 [0,1,0,0,0,0|2,0,0]=3 690 B16R1.1283 CC(=O)Oc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100000002173 [0,1,0,0,0,0|2,0,0]=3 691 B16R1.1283 CC(=O)Oc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100000002173 [0,1,0,0,0,0|2,0,0]=3 692 B16R1.1283 CC(=O)Sc1ccc(cc1)SC(C)C(=O)C 62a_200009995050_100009814033 [0,1,0,0,0,0|1,1,0]=3 693 B16R1.1283 CC(=O)Sc1ccc(cc1)SC(C)C(=O)N 62a_200009995050_100000702099 [0,1,0,0,0,0|2,1,0]=4 694 B16R1.1283 CC(=O)Sc1ccc(cc1)SC(F)C(=O)N 62a_200009995050_100009813875 [0,1,0,0,0,0|2,1,0]=4 695 B16R1.1283 CC(=O)Sc1ccc(cc1)SC(F)C(=O)[O-] 62a_200009995050_100020610796 [0,1,0,0,0,0|2,1,0]=4 696 B16R1.1283 CC(=S)Oc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_200009816735 [0,1,0,0,0,0|2,1,0]=4 697 B16R1.1283 CC(=S)Oc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_200009816735 [0,1,0,0,0,0|2,1,0]=4 698 B16R1.1283 CC(=S)Oc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_200009816735 [0,1,0,0,0,0|2,1,0]=4 699 B16R1.1283 CC(C)Oc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_100000210206 [0,1,0,0,0,0|2,0,1]=4 700 B16R1.2915 C#CC(C)Oc1ccc(cc1)CCC(=O)C 34a_100000198047_200000035995 [0,1,0,0,0,0|1,0,1]=3 701 B16R1.2915 C#CC(C)Sc1ccc(cc1)CCC(=O)C 62a_200000035995_100000723691 [0,1,0,0,0,0|1,1,1]=4 702 B16R1.2915 C=C(C)CNc1ccc(cc1)CC(=O)NC 2230a_100000736799_100000748629 [0,1,0,0,0,0|3,0,0]=4 703 B16R1.2915 C=C(C)CNc1ccc(cc1)CC(=O)NC 34a_100000736799_100000748629 [0,1,0,0,0,0|3,0,0]=4 704 B16R1.2915 C=C(C)CNc1ccc(cc1)NC(=O)CC 34a_100000186511_100000748629 [0,1,0,0,0,0|3,0,0]=4 705 B16R1.2915 C=C(C)CNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000748629 [0,1,0,0,0,0|3,0,0]=4 706 B16R1.2915 C=C(C)COc1ccc(cc1)CC(=O)NC 34a_200000020795_100000748629 [0,1,0,0,0,0|3,0,0]=4 707 B16R1.2915 C=C(C)COc1ccc(cc1)CC(=O)OC 34a_100000211648_100000748629 [0,1,0,0,0,0|3,0,0]=4 708 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CC 11a_200015186533_100000210414 [0,1,0,0,0,0|3,0,0]=4 709 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CC 1626a_200015186533_100000210414 [0,1,0,0,0,0|3,0,0]=4 710 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CC 22a_200015186533_100000210414 [0,1,0,0,0,0|3,0,0]=4 711 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CC 34a_200000243810_100000748629 [0,1,0,0,0,0|3,0,0]=4 712 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CC 527a_200015186533_100000210414 [0,1,0,0,0,0|3,0,0]=4 713 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CC 7a_200000243810_100000748629 [0,1,0,0,0,0|3,0,0]=4 714 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000748629 [0,1,0,0,0,0|3,0,0]=4 715 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CO 22a_200015186533_100000210174 [0,1,0,0,0,0|3,0,0]=4 716 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)CO 527a_200015186533_100000210174 [0,1,0,0,0,0|3,0,0]=4 717 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)NC 2430a_200015186533_100102657272 [0,1,0,0,0,0|3,0,0]=4 718 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)NC 512a_200015186533_100102657272 [0,1,0,0,0,0|3,0,0]=4 719 B16R1.2915 C=C(C)COc1ccc(cc1)NC(=O)OC 34a_100011235918_100000748629 [0,1,0,0,0,0|3,0,0]=4 720 B16R1.2915 C=C(C)CSc1ccc(cc1)CC(=O)NC 62a_100000155101_100000211660 [0,1,0,0,0,0|3,0,0]=4 721 B16R1.2915 C=C(C)CSc1ccc(cc1)CC(=O)NC 62a_100000748629_100000155101 [0,1,0,0,0,0|3,0,0]=4 722 B16R1.2915 C=C(C)CSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000211660 [0,1,0,0,0,0|3,0,0]=4 723 B16R1.2915 C=C(C)CSc1ccc(cc1)CC(=O)OC 62a_100000748629_100000149743 [0,1,0,0,0,0|3,0,0]=4 724 B16R1.2915 C=C(C)CSc1ccc(cc1)NC(=O)CN 62a_100000748629_100000741985 [0,1,0,0,0,0|3,0,0]=4 725 B16R1.2915 C=C(C)CSc1ccc(cc1)NC(=O)OC 62a_100000748629_100000181880 [0,1,0,0,0,0|3,0,0]=4 726 B16R1.2915 C=C(C)CSc1ccc(cc1)OC(=O)CC 62a_100000748629_200009811598 [0,1,0,0,0,0|2,0,0]=3 727 B16R1.2915 C=C(F)CSc1ccc(cc1)OC(=O)CC 62a_100000042424_200009811598 [0,1,0,0,0,0|2,0,1]=4 728 B16R1.2915 C=CC(=O)Nc1ccc(cc1)CNC(=O)C 1626a_100000755463_100000185746 [0,1,0,0,0,0|2,0,1]=4 729 B16R1.2915 C=CC(=O)Nc1ccc(cc1)CNC(=O)C 22a_100000755463_100000185746 [0,1,0,0,0,0|2,0,1]=4 730 B16R1.2915 C=CC(C)Sc1ccc(cc1)CCC(=O)C 62a_100011215867_100000723691 [0,1,0,0,0,0|1,1,1]=4 731 B16R1.2915 CC(=O)CCc1ccc(cc1)OC(C)C#N 7a_100000198047_100000703298 [0,1,0,0,0,0|1,0,1]=3 732 B16R1.2915 CC(=O)CCc1ccc(cc1)OC(C)CO 34a_100000198047_100012180447 [0,1,0,0,0,0|0,0,2]=3 733 B16R1.2915 CC(=O)CCc1ccc(cc1)OC(C)CO 7a_100000198047_100012180447 [0,1,0,0,0,0|0,0,2]=3 734 B16R1.2915 CC(=O)CCc1ccc(cc1)SC(C)C#N 62a_100000703298_100000723691 [0,1,0,0,0,0|1,1,1]=4 735 B16R1.2915 CC(=O)CCc1ccc(cc1)SC(C)C#N 62a_100000723691_100000703298 [0,1,0,0,0,0|1,1,1]=4 736 B16R1.2915 CC(=O)CCc1ccc(cc1)SC(C)CO 62a_100012180447_100000723691 [0,1,0,0,0,0|0,1,2]=4 737 B16R1.2915 CC(=O)CCc1ccc(cc1)S[C@H](C)CO 62a_100000723691_100016084084 [0,1,0,0,0,0|0,1,2]=4 738 B16R1.2915 CC(=O)CCc1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000723691 [0,1,0,0,0,0|0,1,2]=4 739 B16R1.2915 CC(=O)NCc1ccc(cc1)NC(=O)CO 22a_100000755463_100000210174 [0,1,0,0,0,0|2,0,0]=3 740 B16R1.2915 CC(=O)NCc1ccc(cc1)NC(=O)CO 527a_100000755463_100000210174 [0,1,0,0,0,0|2,0,0]=3 741 B16R1.2915 CCC(=O)Nc1ccc(cc1)CCN(C)C 11a_100000751241_100000210414 [0,1,0,0,0,0|3,0,0]=4 742 B16R1.2915 CCC(=O)Nc1ccc(cc1)CCN(C)C 22a_100000751241_100000210414 [0,1,0,0,0,0|3,0,0]=4 743 B16R1.2915 CCC(=O)Nc1ccc(cc1)CCN(C)C 527a_100000751241_100000210414 [0,1,0,0,0,0|3,0,0]=4 744 B16R1.2915 CCC(=O)Nc1ccc(cc1)CNC(=O)C 11a_100000755463_100000210414 [0,1,0,0,0,0|2,0,0]=3 745 B16R1.2915 CCC(=O)Nc1ccc(cc1)CNC(=O)C 1626a_100000755463_100000210414 [0,1,0,0,0,0|2,0,0]=3 746 B16R1.2915 CCC(=O)Nc1ccc(cc1)CNC(=O)C 22a_100000755463_100000210414 [0,1,0,0,0,0|2,0,0]=3 747 B16R1.2915 CCC(=O)Nc1ccc(cc1)CNC(=O)C 527a_100000755463_100000210414 [0,1,0,0,0,0|2,0,0]=3 748 B16R1.2915 CCC(=O)Nc1ccc(cc1)CNC(=O)N 11a_100000747042_100000210414 [0,1,0,0,0,0|3,0,0]=4 749 B16R1.2915 CCC(=O)Nc1ccc(cc1)CNC(=O)N 1626a_100000747042_100000210414 [0,1,0,0,0,0|3,0,0]=4 750 B16R1.2915 CCC(=O)Nc1ccc(cc1)CNC(=O)N 22a_100000747042_100000210414 [0,1,0,0,0,0|3,0,0]=4 751 B16R1.2915 CCC(=O)Nc1ccc(cc1)NCC(=O)N 34a_100000186511_100000187820 [0,1,0,0,0,0|3,0,0]=4 752 B16R1.2915 CCC(=O)Nc1ccc(cc1)NCC(=O)[O-] 34a_100000186511_100020667443 [0,1,0,0,0,0|3,0,0]=4 753 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)C 1458a_100011593264_200000210301 [0,1,0,0,0,0|2,0,0]=3 754 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)N 11a_100000238760_100000210414 [0,1,0,0,0,0|3,0,0]=4 755 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)N 1626a_100000238760_100000210414 [0,1,0,0,0,0|3,0,0]=4 756 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)N 22a_100000238760_100000210414 [0,1,0,0,0,0|3,0,0]=4 757 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)N 34a_200000243810_100000187820 [0,1,0,0,0,0|3,0,0]=4 758 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)N 527a_100000238760_100000210414 [0,1,0,0,0,0|3,0,0]=4 759 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)N 7a_200000243810_100000187820 [0,1,0,0,0,0|3,0,0]=4 760 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)[13CH3] 1458a_100011593264_200025704644 [0,1,0,0,0,0|2,0,0]=3 761 B16R1.2915 CCC(=O)Nc1ccc(cc1)OCC(=O)[O-] 34a_200000243810_100020667443 [0,1,0,0,0,0|3,0,0]=4 762 B16R1.2915 CCC(=O)Oc1ccc(cc1)SCC(=O)N 62a_100000747473_200009811598 [0,1,0,0,0,0|2,0,0]=3 763 B16R1.2915 CCC(=O)Oc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200009811598 [0,1,0,0,0,0|2,0,0]=3 764 B16R1.2915 CCC(=O)Oc1ccc(cc1)SCC(C)C 62a_100000210624_200009811598 [0,1,0,0,0,0|2,0,1]=4 765 B16R1.2915 CCC(=O)Oc1ccc(cc1)SCC(C)O 62a_100011218427_200009811598 [0,1,0,0,0,0|1,0,2]=4 766 B16R1.2915 CCC(=O)Oc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_200009811598 [0,1,0,0,0,0|1,0,2]=4 767 B16R1.2915 CCC(C)Oc1ccc(cc1)CCC(=O)C 34a_100000198047_100011215416 [0,1,0,0,0,0|1,0,1]=3 768 B16R1.2915 CCC(C)Oc1ccc(cc1)CCC(=O)C 7a_100000198047_100000758301 [0,1,0,0,0,0|1,0,1]=3 769 B16R1.2915 CCC(C)Oc1ccc(cc1)CNC(=O)C 11a_100015187824_100015343762 [0,1,0,0,0,0|2,0,1]=4 770 B16R1.2915 CCC(C)Oc1ccc(cc1)CNC(=O)C 1626a_100015187824_100015343762 [0,1,0,0,0,0|2,0,1]=4 771 B16R1.2915 CCC(C)Oc1ccc(cc1)CNC(=O)C 240690a_100015187824_100015343762 [0,1,0,0,0,0|2,0,1]=4 772 B16R1.2915 CCC(C)Oc1ccc(cc1)CNC(=O)C 527a_100015187824_100103153847 [0,1,0,0,0,0|2,0,1]=4 773 B16R1.2915 CCC(C)Sc1ccc(cc1)CCC(=O)C 62a_100000723691_100000758301 [0,1,0,0,0,0|1,1,1]=4 774 B16R1.2915 CCC(C)Sc1ccc(cc1)CCC(=O)C 62a_100000758301_100000723691 [0,1,0,0,0,0|1,1,1]=4 775 B16R1.2915 CN(C)CCc1ccc(cc1)NC(=O)CO 22a_100000751241_100000210174 [0,1,0,0,0,0|3,0,0]=4 776 B16R1.2915 CN(C)CCc1ccc(cc1)NC(=O)CO 527a_100000751241_100000210174 [0,1,0,0,0,0|3,0,0]=4 777 B16R1.2915 CNC(=O)Cc1ccc(cc1)NCC(=O)N 2230a_100000736799_100000747473 [0,1,0,0,0,0|3,0,0]=4 778 B16R1.2915 CNC(=O)Cc1ccc(cc1)NCC(=O)N 34a_100000736799_100000187820 [0,1,0,0,0,0|3,0,0]=4 779 B16R1.2915 CNC(=O)Cc1ccc(cc1)NCC(=O)[O-] 34a_100000736799_100020667443 [0,1,0,0,0,0|3,0,0]=4 780 B16R1.2915 CNC(=O)Cc1ccc(cc1)OCC(=O)N 34a_200000020795_100000187820 [0,1,0,0,0,0|3,0,0]=4 781 B16R1.2915 CNC(=O)Cc1ccc(cc1)OCC(=O)[O-] 34a_200000020795_100020667443 [0,1,0,0,0,0|3,0,0]=4 782 B16R1.2915 CNC(=O)Cc1ccc(cc1)SCC(=O)N 62a_100000155101_100000747473 [0,1,0,0,0,0|3,0,0]=4 783 B16R1.2915 CNC(=O)Cc1ccc(cc1)SCC(=O)N 62a_100000747473_100000155101 [0,1,0,0,0,0|3,0,0]=4 784 B16R1.2915 CNC(=O)Cc1ccc(cc1)SCC(=O)[O-] 62a_100000155101_100020667443 [0,1,0,0,0,0|3,0,0]=4 785 B16R1.2915 CNC(=O)Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000155101 [0,1,0,0,0,0|3,0,0]=4 786 B16R1.2915 CNC(=O)Nc1ccc(cc1)CCN(C)C 2430a_100000751241_100102657272 [0,1,0,0,0,0|3,0,0]=4 787 B16R1.2915 CNC(=O)Nc1ccc(cc1)CNC(=O)C 2430a_100000755463_100102657272 [0,1,0,0,0,0|2,0,0]=3 788 B16R1.2915 CNC(=O)Nc1ccc(cc1)OCC(=O)N 2430a_100000238760_100102657272 [0,1,0,0,0,0|3,0,0]=4 789 B16R1.2915 COC(=O)Cc1ccc(cc1)CNC(=O)C 188690a_100016995050_100015343762 [0,1,0,0,0,0|2,0,0]=3 790 B16R1.2915 COC(=O)Cc1ccc(cc1)OCC(=O)N 34a_100000211648_100000187820 [0,1,0,0,0,0|3,0,0]=4 791 B16R1.2915 COC(=O)Cc1ccc(cc1)OCC(=O)[O-] 34a_100000211648_100020667443 [0,1,0,0,0,0|3,0,0]=4 792 B16R1.2915 COC(=O)Cc1ccc(cc1)SCC(=O)N 62a_100000149743_100000747473 [0,1,0,0,0,0|3,0,0]=4 793 B16R1.2915 COC(=O)Cc1ccc(cc1)SCC(=O)N 62a_100000747473_100000149743 [0,1,0,0,0,0|3,0,0]=4 794 B16R1.2915 COC(=O)Cc1ccc(cc1)SCC(=O)[O-] 62a_100000149743_100020667443 [0,1,0,0,0,0|3,0,0]=4 795 B16R1.2915 COC(=O)Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000149743 [0,1,0,0,0,0|3,0,0]=4 796 B16R1.2915 COC(=O)Nc1ccc(cc1)OCC(=O)N 34a_100011235918_100000187820 [0,1,0,0,0,0|3,0,0]=4 797 B16R1.2915 COC(=O)Nc1ccc(cc1)OCC(=O)[O-] 34a_100011235918_100020667443 [0,1,0,0,0,0|3,0,0]=4 798 B16R1.2915 COC(=O)Nc1ccc(cc1)SCC(=O)N 62a_100000747473_100000181880 [0,1,0,0,0,0|3,0,0]=4 799 B16R1.2915 COC(=O)Nc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000181880 [0,1,0,0,0,0|3,0,0]=4 800 B16R1.2915 COC(C)Sc1ccc(cc1)CCC(=O)C 62a_100000723691_100009879195 [0,1,0,0,0,0|0,1,2]=4 801 B16R1.2915 COC(C)Sc1ccc(cc1)CCC(=O)C 62a_100009879195_100000723691 [0,1,0,0,0,0|0,1,2]=4 802 B16R1.2915 NC(=O)CNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000187820 [0,1,0,0,0,0|3,0,0]=4 803 B16R1.2915 NC(=O)COc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000187820 [0,1,0,0,0,0|3,0,0]=4 804 B16R1.2915 NC(=O)COc1ccc(cc1)NC(=O)CO 22a_100000238760_100000210174 [0,1,0,0,0,0|3,0,0]=4 805 B16R1.2915 NC(=O)COc1ccc(cc1)NC(=O)CO 527a_100000238760_100000210174 [0,1,0,0,0,0|3,0,0]=4 806 B16R1.2915 NC(=O)NCc1ccc(cc1)NC(=O)CO 22a_100000747042_100000210174 [0,1,0,0,0,0|3,0,0]=4 807 B16R1.2915 NCC(=O)Nc1ccc(cc1)SCC(=O)N 62a_100000747473_100000741985 [0,1,0,0,0,0|3,0,0]=4 808 B16R1.2915 NCC(=O)Nc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000741985 [0,1,0,0,0,0|3,0,0]=4 809 B16R1.2915 O=C([O-])CNc1ccc(cc1)NC(=O)CO 34a_100011269904_100020667443 [0,1,0,0,0,0|3,0,0]=4 810 B16R1.2915 O=C([O-])COc1ccc(cc1)NC(=O)CCl 34a_100000233757_100020667443 [0,1,0,0,0,0|3,0,0]=4 811 B16R1.6700 C=C(C)CNc1ccc(c(c1)C)NC(=O)C 34a_100000736504_100000748629 [0,1,0,0,0,0|3,0,0]=4 812 B16R1.6700 C=C(C)CNc1ccc(c(c1)C)NC(=O)C 7a_100000736504_100000748629 [0,1,0,0,0,0|3,0,0]=4 813 B16R1.6700 C=C(C)CNc1ccc(c(c1)Cl)NC(=O)C 34a_100000244014_100000748629 [0,1,0,0,0,0|3,0,0]=4 814 B16R1.6700 C=C(C)CNc1ccc(c(c1)Cl)NC(=O)C 7a_100000244014_100000748629 [0,1,0,0,0,0|3,0,0]=4 815 B16R1.6700 C=C(C)COc1ccc(c(c1)Cl)CC(=O)C 34a_200000084595_100000748629 [0,1,0,0,0,0|3,0,0]=4 816 B16R1.6700 C=C(C)COc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_100000748629 [0,1,0,0,0,0|3,0,0]=4 817 B16R1.6700 C=C(C)CSc1ccc(c(c1)C)NC(=O)C 62a_100000748629_100000152120 [0,1,0,0,0,0|3,0,0]=4 818 B16R1.6700 C=C(C)CSc1ccc(c(c1)Cl)NC(=O)C 62a_100000748629_100011273303 [0,1,0,0,0,0|3,0,0]=4 819 B16R1.6700 C=C(C)CSc1ccc(c(c1)F)NC(=O)C 62a_100000748629_100000155584 [0,1,0,0,0,0|3,0,0]=4 820 B16R1.6700 C=C(C)CSc1ccc(c(c1)F)OC(=O)C 62a_100000748629_100009811628 [0,1,0,0,0,0|2,0,0]=3 821 B16R1.6700 C=C(C)CSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000211660 [0,1,0,0,0,0|2,0,0]=3 822 B16R1.6700 C=C(F)CSc1ccc(c(c1)F)OC(=O)C 62a_100000042424_100009811628 [0,1,0,0,0,0|2,0,1]=4 823 B16R1.6700 C=C(F)CSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000042424 [0,1,0,0,0,0|2,0,1]=4 824 B16R1.6700 CC(=O)Cc1ccc(cc1Cl)OCC(=O)N 34a_200000084595_100000187820 [0,1,0,0,0,0|3,0,0]=4 825 B16R1.6700 CC(=O)Cc1ccc(cc1Cl)OCC(=O)N 7a_200000084595_100000187820 [0,1,0,0,0,0|3,0,0]=4 826 B16R1.6700 CC(=O)Cc1ccc(cc1Cl)OCC(=O)[O-] 34a_200000084595_100020667443 [0,1,0,0,0,0|3,0,0]=4 827 B16R1.6700 CC(=O)NCc1ccc(c(c1)F)OC(C)C 11a_106430523230_100015343762 [0,1,0,0,0,0|2,0,1]=4 828 B16R1.6700 CC(=O)NCc1ccc(c(c1)F)OC(C)C 1626a_106430523230_100015343762 [0,1,0,0,0,0|2,0,1]=4 829 B16R1.6700 CC(=O)NCc1ccc(c(c1)F)OC(C)C 240690a_106430523230_100015343762 [0,1,0,0,0,0|2,0,1]=4 830 B16R1.6700 CC(=O)NCc1ccc(c(c1)F)OC(C)C 527a_106430523230_100103153847 [0,1,0,0,0,0|2,0,1]=4 831 B16R1.6700 CC(=O)Nc1ccc(cc1C)NCC(=O)N 34a_100000736504_100000187820 [0,1,0,0,0,0|3,0,0]=4 832 B16R1.6700 CC(=O)Nc1ccc(cc1C)NCC(=O)N 7a_100000736504_100000187820 [0,1,0,0,0,0|3,0,0]=4 833 B16R1.6700 CC(=O)Nc1ccc(cc1C)NCC(=O)[O-] 34a_100000736504_100020667443 [0,1,0,0,0,0|3,0,0]=4 834 B16R1.6700 CC(=O)Nc1ccc(cc1C)SCC(=O)N 62a_100000747473_100000152120 [0,1,0,0,0,0|3,0,0]=4 835 B16R1.6700 CC(=O)Nc1ccc(cc1C)SCC(=O)[O-] 62a_100020667443_100000152120 [0,1,0,0,0,0|3,0,0]=4 836 B16R1.6700 CC(=O)Nc1ccc(cc1Cl)NCC(=O)N 34a_100000244014_100000187820 [0,1,0,0,0,0|3,0,0]=4 837 B16R1.6700 CC(=O)Nc1ccc(cc1Cl)NCC(=O)N 7a_100000244014_100000187820 [0,1,0,0,0,0|3,0,0]=4 838 B16R1.6700 CC(=O)Nc1ccc(cc1Cl)NCC(=O)[O-] 34a_100000244014_100020667443 [0,1,0,0,0,0|3,0,0]=4 839 B16R1.6700 CC(=O)Nc1ccc(cc1Cl)SCC(=O)N 62a_100000747473_100011273303 [0,1,0,0,0,0|3,0,0]=4 840 B16R1.6700 CC(=O)Nc1ccc(cc1Cl)SCC(=O)[O-] 62a_100020667443_100011273303 [0,1,0,0,0,0|3,0,0]=4 841 B16R1.6700 CC(=O)Nc1ccc(cc1F)SCC(=O)N 62a_100000747473_100000155584 [0,1,0,0,0,0|3,0,0]=4 842 B16R1.6700 CC(=O)Nc1ccc(cc1F)SCC(=O)[O-] 62a_100020667443_100000155584 [0,1,0,0,0,0|3,0,0]=4 843 B16R1.6700 CC(=O)Oc1ccc(cc1F)SCC(=O)N 62a_100000747473_100009811628 [0,1,0,0,0,0|2,0,0]=3 844 B16R1.6700 CC(=O)Oc1ccc(cc1F)SCC(=O)N 62a_100009811628_100000747473 [0,1,0,0,0,0|2,0,0]=3 845 B16R1.6700 CC(=O)Oc1ccc(cc1F)SCC(=O)[O-] 62a_100009811628_100020667443 [0,1,0,0,0,0|2,0,0]=3 846 B16R1.6700 CC(=O)Oc1ccc(cc1F)SCC(=O)[O-] 62a_100020667443_100009811628 [0,1,0,0,0,0|2,0,0]=3 847 B16R1.6700 CC(=O)Oc1ccc(cc1F)SCC(C)C 62a_100000210624_100009811628 [0,1,0,0,0,0|2,0,1]=4 848 B16R1.6700 CC(=O)Oc1ccc(cc1F)SCC(C)C 62a_100009811628_100000210760 [0,1,0,0,0,0|2,0,1]=4 849 B16R1.6700 CC(=O)Oc1ccc(cc1F)SCC(C)O 62a_100009811628_100011218427 [0,1,0,0,0,0|1,0,2]=4 850 B16R1.6700 CC(=O)Oc1ccc(cc1F)SCC(C)O 62a_100011218427_100009811628 [0,1,0,0,0,0|1,0,2]=4 851 B16R1.6700 CC(=O)Oc1ccc(cc1F)SC[C@@H](C)O 62a_100009811628_100009817552 [0,1,0,0,0,0|1,0,2]=4 852 B16R1.6700 CC(=O)Oc1ccc(cc1F)SC[C@@H](C)O 62a_100009817552_100009811628 [0,1,0,0,0,0|1,0,2]=4 853 B16R1.6700 CC(=O)Oc1ccc(cc1F)SC[N+](=O)[O-] 62a_100009811628_100000761209 [0,1,0,0,0,0|3,0,0]=4 854 B16R1.7610 CC(=O)CCc1ccc(cc1)OC(C)(C)C 34a_100000198047_100000210625 [0,1,0,0,0,0|1,0,1]=3 855 B16R1.7610 CC(=O)CCc1ccc(cc1)OC(F)(F)F 1458a_100000750466_200000210301 [0,1,0,0,0,0|2,0,1]=4 856 B16R1.7610 CC(=O)CCc1ccc(cc1)OC(F)(F)F 34a_100000198047_200103152311 [0,1,0,0,0,0|2,0,1]=4 857 B16R1.7610 CC(=O)CCc1ccc(cc1)OC(F)(F)F 7a_100000198047_200000243211 [0,1,0,0,0,0|2,0,1]=4 858 B16R1.7610 CC(=O)CCc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000723691 [0,1,0,0,0,0|1,1,1]=4 859 B16R1.7610 CC(=O)CCc1ccc(cc1)SC(C)(C)C 62a_100000723691_100000211941 [0,1,0,0,0,0|1,1,1]=4 860 B16R1.7610 CC(=O)NCc1ccc(cc1)NS(=O)(=O)C 11a_100000740523_100015343762 [0,1,0,0,0,0|3,0,0]=4 861 B16R1.7610 CC(=O)NCc1ccc(cc1)NS(=O)(=O)C 240690a_100000740523_100015343762 [0,1,0,0,0,0|3,0,0]=4 862 B16R1.7610 CC(=O)NCc1ccc(cc1)NS(=O)(=O)C 527a_100000740523_100103153847 [0,1,0,0,0,0|3,0,0]=4 863 B16R1.7610 CC(=O)NCc1ccc(cc1)OC(C)(C)C 11a_100000745534_100015343762 [0,1,0,0,0,0|2,0,1]=4 864 B16R1.7610 CC(=O)NCc1ccc(cc1)OC(C)(C)C 1626a_100000745534_100015343762 [0,1,0,0,0,0|2,0,1]=4 865 B16R1.7610 CC(=O)NCc1ccc(cc1)OC(C)(C)C 240690a_100000745534_100015343762 [0,1,0,0,0,0|2,0,1]=4 866 B16R1.7610 CC(=O)NCc1ccc(cc1)OC(C)(C)C 527a_100000745534_100103153847 [0,1,0,0,0,0|2,0,1]=4 867 B16R1.7610 [13CH3]C(=O)CCc1ccc(cc1)OC(F)(F)F 1458a_100000750466_200025704644 [0,1,0,0,0,0|2,0,1]=4 868 B16R1.11036 C=C(C)COc1ccc(cc1Br)CC(=O)C 34a_100010141077_100000748629 [0,1,0,0,0,0|3,0,0]=4 869 B16R1.11036 C=C(C)COc1ccc(cc1Br)CC(=O)C 7a_100010141077_100000748629 [0,1,0,0,0,0|3,0,0]=4 870 B16R1.11036 C=C(C)COc1ccc(cc1C)CC(=O)C 34a_200000080089_100000748629 [0,1,0,0,0,0|3,0,0]=4 871 B16R1.11036 C=C(C)COc1ccc(cc1C)CC(=O)C 7a_200000080089_100000748629 [0,1,0,0,0,0|3,0,0]=4 872 B16R1.11036 C=C(C)COc1ccc(cc1C)NC(=O)C 34a_100012186693_100000748629 [0,1,0,0,0,0|3,0,0]=4 873 B16R1.11036 C=C(C)COc1ccc(cc1C)NC(=O)C 7a_100012186693_100000748629 [0,1,0,0,0,0|3,0,0]=4 874 B16R1.11036 C=C(C)COc1ccc(cc1Cl)CC(=O)C 34a_200000080078_100000748629 [0,1,0,0,0,0|3,0,0]=4 875 B16R1.11036 C=C(C)COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_100000748629 [0,1,0,0,0,0|3,0,0]=4 876 B16R1.11036 C=C(C)COc1ccc(cc1Cl)NC(=O)C 34a_100011215158_100000748629 [0,1,0,0,0,0|3,0,0]=4 877 B16R1.11036 C=C(C)COc1ccc(cc1Cl)NC(=O)C 7a_100011215158_100000748629 [0,1,0,0,0,0|3,0,0]=4 878 B16R1.11036 C=C(C)CSc1ccc(cc1C)NC(=O)C 62a_100000748629_100000155607 [0,1,0,0,0,0|3,0,0]=4 879 B16R1.11036 C=C(C)CSc1ccc(cc1F)NC(=O)C 62a_100000748629_100011219590 [0,1,0,0,0,0|3,0,0]=4 880 B16R1.11036 CC(=O)Cc1ccc(c(c1)Br)OCC(=O)N 34a_100010141077_100000187820 [0,1,0,0,0,0|3,0,0]=4 881 B16R1.11036 CC(=O)Cc1ccc(c(c1)Br)OCC(=O)N 7a_100010141077_100000187820 [0,1,0,0,0,0|3,0,0]=4 882 B16R1.11036 CC(=O)Cc1ccc(c(c1)Br)OCC(=O)[O-] 34a_100010141077_100020667443 [0,1,0,0,0,0|3,0,0]=4 883 B16R1.11036 CC(=O)Cc1ccc(c(c1)C)OCC(=O)N 34a_200000080089_100000187820 [0,1,0,0,0,0|3,0,0]=4 884 B16R1.11036 CC(=O)Cc1ccc(c(c1)C)OCC(=O)N 7a_200000080089_100000187820 [0,1,0,0,0,0|3,0,0]=4 885 B16R1.11036 CC(=O)Cc1ccc(c(c1)C)OCC(=O)[O-] 34a_200000080089_100020667443 [0,1,0,0,0,0|3,0,0]=4 886 B16R1.11036 CC(=O)Cc1ccc(c(c1)Cl)OCC(=O)N 34a_200000080078_100000187820 [0,1,0,0,0,0|3,0,0]=4 887 B16R1.11036 CC(=O)Cc1ccc(c(c1)Cl)OCC(=O)N 7a_200000080078_100000187820 [0,1,0,0,0,0|3,0,0]=4 888 B16R1.11036 CC(=O)Cc1ccc(c(c1)Cl)OCC(=O)[O-] 34a_200000080078_100020667443 [0,1,0,0,0,0|3,0,0]=4 889 B16R1.11036 CC(=O)Nc1ccc(c(c1)C)OCC(=O)N 34a_100012186693_100000187820 [0,1,0,0,0,0|3,0,0]=4 890 B16R1.11036 CC(=O)Nc1ccc(c(c1)C)OCC(=O)N 7a_100012186693_100000187820 [0,1,0,0,0,0|3,0,0]=4 891 B16R1.11036 CC(=O)Nc1ccc(c(c1)C)OCC(=O)[O-] 34a_100012186693_100020667443 [0,1,0,0,0,0|3,0,0]=4 892 B16R1.11036 CC(=O)Nc1ccc(c(c1)C)SCC(=O)N 62a_100000747473_100000155607 [0,1,0,0,0,0|3,0,0]=4 893 B16R1.11036 CC(=O)Nc1ccc(c(c1)C)SCC(=O)[O-] 62a_100020667443_100000155607 [0,1,0,0,0,0|3,0,0]=4 894 B16R1.11036 CC(=O)Nc1ccc(c(c1)Cl)OCC(=O)N 34a_100011215158_100000187820 [0,1,0,0,0,0|3,0,0]=4 895 B16R1.11036 CC(=O)Nc1ccc(c(c1)Cl)OCC(=O)N 7a_100011215158_100000187820 [0,1,0,0,0,0|3,0,0]=4 896 B16R1.11036 CC(=O)Nc1ccc(c(c1)Cl)OCC(=O)[O-] 34a_100011215158_100020667443 [0,1,0,0,0,0|3,0,0]=4 897 B16R1.11036 CC(=O)Nc1ccc(c(c1)F)SCC(=O)N 62a_100000747473_100011219590 [0,1,0,0,0,0|3,0,0]=4 898 B16R1.11036 CC(=O)Nc1ccc(c(c1)F)SCC(=O)[O-] 62a_100020667443_100011219590 [0,1,0,0,0,0|3,0,0]=4 899 B16R1.18083 CC(=O)Nc1ccc(cc1)CNS(=O)(=O)C 40a_100000735448_100000738038 [0,1,0,0,0,0|3,0,0]=4 900 B16R1.18083 CC(=O)Oc1ccc(cc1)CNC(C)(C)C 207a_100000715429_100000014718 [0,1,0,0,0,0|2,0,1]=4 901 B16R1.18083 CC(=O)Oc1ccc(cc1)CNC(C)(C)C 2230a_100000715429_100000033664 [0,1,0,0,0,0|2,0,1]=4 902 B16R1.18083 CC(=O)Oc1ccc(cc1)COC(C)(C)C 7a_100015890283_100000033664 [0,1,0,0,0,0|2,0,1]=4 903 B16R1.18083 CC(=O)Oc1ccc(cc1)CSC(C)(C)C 62a_100000211941_100000033664 [0,1,0,0,0,0|2,0,1]=4 904 B16R1.18083 CC(=O)Oc1ccc(cc1)SCC(C)(C)C 62a_100011219605_100000002173 [0,1,0,0,0,0|2,0,1]=4 905 B16R1.18083 CC(=O)Oc1ccc(cc1)SCC(C)(C)F 62a_100011997219_100000002173 [0,1,0,0,0,0|2,0,1]=4 906 B16R1.18083 CC(=O)Oc1ccc(cc1)SCC(C)(C)O 62a_100000764493_100000002173 [0,1,0,0,0,0|1,0,2]=4 907 B16R1.18083 CC(=O)Oc1ccc(cc1)SCS(=O)(=O)N 62a_100000741382_100000002173 [0,1,0,0,0,0|3,0,0]=4 908 B16R1.18083 CC(=O)Oc1ccc(cc1)SCS(=O)(=O)[O-] 62a_100009817235_100000002173 [0,1,0,0,0,0|3,0,0]=4 909 B16R1.18083 CC(=O)Oc1ccc(cc1)SC[N+](C)(C)C 62a_200000036245_100000002173 [0,1,0,0,0,0|3,0,0]=4 910 B16R1.18083 CC(=O)Oc1ccc(cc1)SC[Si](C)(C)C 62a_100000037933_100000002173 [0,1,0,0,0,0|2,1,0]=4 911 B16R2.3892 C=C(C)CNc1ccc2oc(nc2c1)C 34a_100000195416_100000748629 [0,0,0,1,0,0|3,0,0]=4 912 B16R2.3892 C=C(C)COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000748629 [0,0,0,1,0,0|2,0,0]=3 913 B16R2.3892 C=C(C)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000748629 [0,0,0,1,0,0|2,0,0]=3 914 B16R2.3892 C=C(C)COc1ccc2oc(nc2c1)C 34a_100000102623_100000748629 [0,0,0,1,0,0|3,0,0]=4 915 B16R2.3892 C=C(C)COc1ccc2oc(nc2c1)C 7a_100000102623_100000748629 [0,0,0,1,0,0|3,0,0]=4 916 B16R2.3892 C=C(C)CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000211660 [0,0,0,1,0,0|3,0,0]=4 917 B16R2.3892 C=C(C)CSc1ccc2c(c1)CC(=O)N2 62a_100000748629_100000754858 [0,0,0,1,0,0|3,0,0]=4 918 B16R2.3892 C=C(C)CSc1ccc2oc(nc2c1)C 62a_100000748629_100009816932 [0,0,0,1,0,0|3,0,0]=4 919 B16R2.3892 C=C(F)COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100009893438 [0,0,0,1,0,0|2,0,1]=4 920 B16R2.3892 C=C(F)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000042424 [0,0,0,1,0,0|2,0,1]=4 921 B16R2.3892 CC(=O)NCc1ccc2[nH]c(=O)[nH]c2c1 11a_100000697230_100015343762 [0,0,0,1,0,0|3,0,0]=4 922 B16R2.3892 CC(=O)NCc1ccc2[nH]c(=O)[nH]c2c1 240690a_100000697230_100015343762 [0,0,0,1,0,0|3,0,0]=4 923 B16R2.3892 CC(=O)NCc1ccc2[nH]c(=O)[nH]c2c1 527a_100000697230_100103153847 [0,0,0,1,0,0|3,0,0]=4 924 B16R2.3892 CC(=O)NCc1ccc2[nH]c(cc2c1)C 240690a_100000027266_100015343762 [0,0,0,1,0,0|3,0,0]=4 925 B16R2.3892 CC(=O)NCc1ccc2[nH]c(cc2c1)C 527a_100000027266_100103153847 [0,0,0,1,0,0|3,0,0]=4 926 B16R2.3892 CC(C)COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000210624 [0,0,0,1,0,0|2,0,1]=4 927 B16R2.3892 CC(C)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000210760 [0,0,0,1,0,0|2,0,1]=4 928 B16R2.3892 CC(O)COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100011218427 [0,0,0,1,0,0|1,0,2]=4 929 B16R2.3892 CC(O)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100011218427 [0,0,0,1,0,0|1,0,2]=4 930 B16R2.3892 C[C@@H](O)COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100009817552 [0,0,0,1,0,0|1,0,2]=4 931 B16R2.3892 C[C@@H](O)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100009817552 [0,0,0,1,0,0|1,0,2]=4 932 B16R2.3892 Cc1nc2cc(ccc2o1)NCC(=O)N 34a_100000195416_100000187820 [0,0,0,1,0,0|3,0,0]=4 933 B16R2.3892 Cc1nc2cc(ccc2o1)NCC(=O)[O-] 34a_100000195416_100020667443 [0,0,0,1,0,0|3,0,0]=4 934 B16R2.3892 Cc1nc2cc(ccc2o1)OCC(=O)N 34a_100000102623_100000187820 [0,0,0,1,0,0|3,0,0]=4 935 B16R2.3892 Cc1nc2cc(ccc2o1)OCC(=O)N 7a_100000102623_100000187820 [0,0,0,1,0,0|3,0,0]=4 936 B16R2.3892 Cc1nc2cc(ccc2o1)OCC(=O)[O-] 34a_100000102623_100020667443 [0,0,0,1,0,0|3,0,0]=4 937 B16R2.3892 Cc1nc2cc(ccc2o1)SCC(=O)N 62a_100000747473_100009816932 [0,0,0,1,0,0|3,0,0]=4 938 B16R2.3892 Cc1nc2cc(ccc2o1)SCC(=O)[O-] 62a_100020667443_100009816932 [0,0,0,1,0,0|3,0,0]=4 939 B16R2.3892 NC(=O)COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000187820 [0,0,0,1,0,0|2,0,0]=3 940 B16R2.3892 NC(=O)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000187820 [0,0,0,1,0,0|2,0,0]=3 941 B16R2.3892 NC(=O)CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000747473 [0,0,0,1,0,0|3,0,0]=4 942 B16R2.3892 NC(=O)CSc1ccc2c(c1)CC(=O)N2 62a_100000747473_100000754858 [0,0,0,1,0,0|3,0,0]=4 943 B16R2.3892 O=C([O-])COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100020667443 [0,0,0,1,0,0|2,0,0]=3 944 B16R2.3892 O=C([O-])CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100020667443 [0,0,0,1,0,0|3,0,0]=4 945 B16R2.3892 O=C([O-])CSc1ccc2c(c1)CC(=O)N2 62a_100020667443_100000754858 [0,0,0,1,0,0|3,0,0]=4 946 B16R2.3892 O=C1Cc2cc(ccc2O1)OC[N+](=O)[O-] 34a_100000035078_100000761209 [0,0,0,1,0,0|3,0,0]=4 947 B16R2.4127 CC(=Cc1ccc(cc1)C2CC(=O)C2)C 271570a_100102525489_100000741321 [0,0,0,1,0,0|2,0,0]=3 948 B16R2.4127 CC(C)Sc1ccc(cc1)C2CC(=O)C2 62a_100000210206_100000741321 [0,0,0,1,0,0|1,1,1]=4 949 B16R2.4127 CC(C)Sc1ccc(cc1)C2CC(=O)C2 62a_100000741321_100000210206 [0,0,0,1,0,0|1,1,1]=4 950 B16R2.11975 CC(=Cc1ccc2c(c1)CC(=O)CC2)C 271570a_100102525489_100010138410 [0,0,0,1,0,0|2,0,0]=3 951 B16R2.11975 CC(=Cc1ccc2c(c1)NC(=O)CC2)C 271570a_100102525489_100000763451 [0,0,0,1,0,0|3,0,0]=4 952 B16R2.11975 CC(=O)Nc1ccc2=NCC(=O)N=c2c1 11a_100015868083_100015343762 [0,0,0,1,0,0|3,0,0]=4 953 B16R2.11975 CC(=O)Nc1ccc2=NCC(=O)N=c2c1 1626a_100015868083_100015343762 [0,0,0,1,0,0|3,0,0]=4 954 B16R2.11975 CC(=O)Nc1ccc2=NCC(=O)N=c2c1 22a_100015868083_100000070787 [0,0,0,1,0,0|3,0,0]=4 955 B16R2.11975 CC(=O)Nc1ccc2=NCC(=O)N=c2c1 527a_100015868083_100103153847 [0,0,0,1,0,0|3,0,0]=4 956 B16R2.11975 CC(=O)Nc1ccc2c(c1)CN(CC2)C 11a_100012157641_100015343762 [0,0,0,1,0,0|3,0,0]=4 957 B16R2.11975 CC(=O)Nc1ccc2c(c1)CN(CC2)C 1626a_100012157641_100015343762 [0,0,0,1,0,0|3,0,0]=4 958 B16R2.11975 CC(=O)Nc1ccc2c(c1)CN(CC2)C 22a_100012157641_100000070787 [0,0,0,1,0,0|3,0,0]=4 959 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CC2 11a_100000055022_100015343762 [0,0,0,1,0,0|2,0,0]=3 960 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CC2 1626a_100000055022_100015343762 [0,0,0,1,0,0|2,0,0]=3 961 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CC2 22a_100000055022_100000070787 [0,0,0,1,0,0|2,0,0]=3 962 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CC2 527a_100000055022_100103153847 [0,0,0,1,0,0|2,0,0]=3 963 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CO2 11a_100000230169_100015343762 [0,0,0,1,0,0|3,0,0]=4 964 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CO2 1626a_100000230169_100015343762 [0,0,0,1,0,0|3,0,0]=4 965 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CO2 22a_100000230169_100000070787 [0,0,0,1,0,0|3,0,0]=4 966 B16R2.11975 CC(=O)Nc1ccc2c(c1)NC(=O)CO2 527a_100000230169_100103153847 [0,0,0,1,0,0|3,0,0]=4 967 B16R2.11975 CC(C)Oc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100000210206 [0,0,0,1,0,0|1,0,1]=3 968 B16R2.11975 CC(C)Oc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100000210206 [0,0,0,1,0,0|1,0,1]=3 969 B16R2.11975 CC(C)Oc1ccc2c(c1)NC(=O)CC2 34a_100000708604_100000210206 [0,0,0,1,0,0|2,0,1]=4 970 B16R2.11975 CC(C)Oc1ccc2c(c1)OC(=O)CC2 7a_100000044819_100000210206 [0,0,0,1,0,0|2,0,1]=4 971 B16R2.11975 CC(C)Sc1ccc2c(c1)CC(=O)CC2 62a_100000210206_100010138410 [0,0,0,1,0,0|1,1,1]=4 972 B16R2.11975 CC(C)Sc1ccc2c(c1)CC(=O)CC2 62a_100010138410_100000210206 [0,0,0,1,0,0|1,1,1]=4 973 B16R2.27341 CC(=O)CCc1ccc(cc1)OC2CC2 34a_100000198047_100000211595 [0,0,0,1,0,0|1,0,1]=3 974 B16R2.27341 CC(=O)CCc1ccc(cc1)SC2CC2 62a_100000723691_100000211595 [0,0,0,1,0,0|1,1,1]=4 975 B16R2.34961 CC(=O)Oc1ccc(cc1)SCC2CC2 62a_100000756562_100000002173 [0,0,0,1,0,0|2,0,1]=4 976 B16R2.34961 CC(=O)Oc1ccc(cc1)SCC2CO2 62a_102125554688_100000002173 [0,0,0,1,0,0|1,0,2]=4 977 B16R2.34961 CC(=O)Oc1ccc(cc1)SCC2CS2 62a_100000031435_100000002173 [0,0,0,1,0,0|1,1,1]=4 978 B16R2.34961 CC(=O)Oc1ccc(cc1)SC[C@@H]2CO2 62a_100000745022_100000002173 [0,0,0,1,0,0|1,0,2]=4 979 B14R1.419 C=C(C)CNc1ccc(cc1)C(=O)N 27a_100000765925_100000162191 [0,0,0,0,1,0|3,0,0]=4 980 B14R1.419 C=C(C)CNc1ccc(cc1)C(=O)N 34a_100000210537_100000748629 [0,0,0,0,1,0|3,0,0]=4 981 B14R1.419 C=C(C)CNc1ccc(cn1)C(=O)C 27a_100000765925_100000690552 [0,0,0,0,1,0|3,0,0]=4 982 B14R1.419 C=C(C)COc1ccc(cc1)C(=C)C 34a_100009880102_100000748629 [0,0,0,0,1,0|3,0,0]=4 983 B14R1.419 C=C(C)COc1ccc(cc1)C(=C)C 7a_100009880102_100000748629 [0,0,0,0,1,0|3,0,0]=4 984 B14R1.419 C=C(C)COc1ccc(cc1)C(=O)C 34a_100000185113_100000748629 [0,0,0,0,1,0|2,0,0]=3 985 B14R1.419 C=C(C)COc1ccc(cc1)C(=O)C 7a_100000185113_100000748629 [0,0,0,0,1,0|2,0,0]=3 986 B14R1.419 C=C(C)COc1ccc(cc1)C(=O)N 34a_100000746352_100000748629 [0,0,0,0,1,0|3,0,0]=4 987 B14R1.419 C=C(C)COc1ccc(cc1)C(=O)N 7a_100000746352_100000748629 [0,0,0,0,1,0|3,0,0]=4 988 B14R1.419 C=C(C)COc1ccc(cc1)S(=O)C 34a_200000064373_100000748629 [0,0,0,0,1,0|3,0,0]=4 989 B14R1.419 C=C(C)COc1ccc(cc1)S(=O)C 7a_200000064373_100000748629 [0,0,0,0,1,0|3,0,0]=4 990 B14R1.419 C=C(C)COc1ccc(nc1)C(=O)C 34a_100012001710_100000748629 [0,0,0,0,1,0|3,0,0]=4 991 B14R1.419 C=C(C)COc1ccc(nc1)C(=O)C 7a_100012001710_100000748629 [0,0,0,0,1,0|3,0,0]=4 992 B14R1.419 C=C(C)CSc1ccc(cc1)C(=C)C 62a_100000185454_100000211660 [0,0,0,0,1,0|3,0,0]=4 993 B14R1.419 C=C(C)CSc1ccc(cc1)C(=C)C 62a_100000748629_100000185454 [0,0,0,0,1,0|3,0,0]=4 994 B14R1.419 C=C(C)CSc1ccc(cc1)C(=O)C 62a_100000185465_100000211660 [0,0,0,0,1,0|2,0,0]=3 995 B14R1.419 C=C(C)CSc1ccc(cc1)C(=O)C 62a_100000748629_100000185465 [0,0,0,0,1,0|2,0,0]=3 996 B14R1.419 C=C(C)CSc1ccc(cc1)C(=O)N 62a_100000162191_100000211660 [0,0,0,0,1,0|3,0,0]=4 997 B14R1.419 C=C(C)CSc1ccc(cc1)C(=O)N 62a_100000748629_100000162191 [0,0,0,0,1,0|3,0,0]=4 998 B14R1.419 C=C(C)CSc1ccc(cc1)S(=O)C 62a_100009816266_100000211660 [0,0,0,0,1,0|3,0,0]=4 999 B14R1.419 C=C(C)CSc1ccc(cn1)C(=O)C 62a_100000684857_100000211660 [0,0,0,0,1,0|3,0,0]=4 1000 B14R1.419 C=C(C)CSc1ccc(cn1)C(=O)C 62a_100000748629_100000684857 [0,0,0,0,1,0|3,0,0]=4 1001 B14R1.419 C=C(C)CSc1ccc(nc1)C(=O)C 62a_100000686046_100000211660 [0,0,0,0,1,0|3,0,0]=4 1002 B14R1.419 C=C(C)CSc1ccc(nc1)C(=O)C 62a_100000748629_100000686046 [0,0,0,0,1,0|3,0,0]=4 1003 B14R1.419 C=C(C)c1ccc(cc1)/C=C/C(=O)C 271570a_100000694244_200016259395 [0,0,0,0,1,0|1,0,2]=4 1004 B14R1.419 C=C(C)c1ccc(cc1)CCC(=O)C 271570a_100000694244_100000723691 [0,0,0,0,1,0|1,0,0]=2 1005 B14R1.419 C=C(C)c1ccc(cc1)CCC(=O)N 271570a_100000694244_200010110666 [0,0,0,0,1,0|2,0,0]=3 1006 B14R1.419 C=C(C)c1ccc(cc1)CNC(=O)C 271570a_100000694244_200000685173 [0,0,0,0,1,0|2,0,0]=3 1007 B14R1.419 C=C(C)c1ccc(cc1)NNC(=O)C 271570a_100000694244_200009815283 [0,0,0,0,1,0|3,0,0]=4 1008 B14R1.419 C=C(C)c1ccc(cc1)OCC(=O)N 34a_100009880102_100000187820 [0,0,0,0,1,0|3,0,0]=4 1009 B14R1.419 C=C(C)c1ccc(cc1)OCC(=O)N 7a_100009880102_100000187820 [0,0,0,0,1,0|3,0,0]=4 1010 B14R1.419 C=C(C)c1ccc(cc1)OCC(=O)[O-] 34a_100009880102_100020667443 [0,0,0,0,1,0|3,0,0]=4 1011 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)N 271570a_100000694244_100000149456 [0,0,0,0,1,0|3,0,0]=4 1012 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)N 62a_100000185454_100000747473 [0,0,0,0,1,0|3,0,0]=4 1013 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000185454 [0,0,0,0,1,0|3,0,0]=4 1014 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)[O-] 62a_100000185454_100020667443 [0,0,0,0,1,0|3,0,0]=4 1015 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000185454 [0,0,0,0,1,0|3,0,0]=4 1016 B14R1.419 C=C(F)COc1ccc(cc1)C(=O)C 34a_100000185113_100009893438 [0,0,0,0,1,0|2,0,1]=4 1017 B14R1.419 C=C(F)COc1ccc(cc1)C(=O)C 7a_100000185113_100000042424 [0,0,0,0,1,0|2,0,1]=4 1018 B14R1.419 C=C(F)CSc1ccc(cc1)C(=O)C 62a_100000042424_100000185465 [0,0,0,0,1,0|2,0,1]=4 1019 B14R1.419 C=C(F)CSc1ccc(cc1)C(=O)C 62a_100000185465_100000042424 [0,0,0,0,1,0|2,0,1]=4 1020 B14R1.419 CC(=O)CCc1ccc(cc1)C(=O)C 1458a_100000070787_200000038727 [0,0,0,0,1,0|0,0,0]=1 1021 B14R1.419 CC(=O)CCc1ccc(cc1)C(C)C 1458a_100000234928_200000210301 [0,0,0,0,1,0|1,0,1]=3 1022 B14R1.419 CC(=O)CCc1ccc(cc1)N(C)C 1458a_100000205957_200000210301 [0,0,0,0,1,0|2,0,0]=3 1023 B14R1.419 CC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000736421 [0,0,0,0,1,0|2,0,0]=3 1024 B14R1.419 CC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_200000210301 [0,0,0,0,1,0|2,0,0]=3 1025 B14R1.419 CC(=O)COc1ccc(cc1)C(C)C 1458a_100000189144_200000210301 [0,0,0,0,1,0|2,0,1]=4 1026 B14R1.419 CC(=O)COc1ccc(cc1)[N+](=O)[O-] 1458a_100000181393_200000210301 [0,0,0,0,1,0|3,0,0]=4 1027 B14R1.419 CC(=O)CSc1ccc(cc1)C(C)C 1458a_100000740577_200000210301 [0,0,0,0,1,0|2,0,1]=4 1028 B14R1.419 CC(=O)CSc1ccc(cc1)[N+](=O)[O-] 1458a_100000156286_200000210301 [0,0,0,0,1,0|3,0,0]=4 1029 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)C 1458a_100000193300_200000210301 [0,0,0,0,1,0|1,0,0]=2 1030 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 11a_100000185037_100015343762 [0,0,0,0,1,0|2,0,0]=3 1031 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 1626a_100000185037_100015343762 [0,0,0,0,1,0|2,0,0]=3 1032 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 240690a_100000185037_100015343762 [0,0,0,0,1,0|2,0,0]=3 1033 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 527a_100000185037_100103153847 [0,0,0,0,1,0|2,0,0]=3 1034 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)[13CH3] 1458a_100000193300_200025704644 [0,0,0,0,1,0|1,0,0]=2 1035 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 11a_100000174979_100015343762 [0,0,0,0,1,0|2,0,1]=4 1036 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 1626a_100000174979_100015343762 [0,0,0,0,1,0|2,0,1]=4 1037 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 240690a_100000174979_100015343762 [0,0,0,0,1,0|2,0,1]=4 1038 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 527a_100000174979_100103153847 [0,0,0,0,1,0|2,0,1]=4 1039 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)O 240690a_200000048501_100015343762 [0,0,0,0,1,0|1,0,2]=4 1040 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)O 527a_200000048501_100103153847 [0,0,0,0,1,0|1,0,2]=4 1041 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 11a_100000199032_100015343762 [0,0,0,0,1,0|3,0,0]=4 1042 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 1626a_100000199032_100015343762 [0,0,0,0,1,0|3,0,0]=4 1043 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 240690a_100000199032_100015343762 [0,0,0,0,1,0|3,0,0]=4 1044 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 527a_100000199032_100103153847 [0,0,0,0,1,0|3,0,0]=4 1045 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 11a_100000742766_100015343762 [0,0,0,0,1,0|3,0,0]=4 1046 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 240690a_100000742766_100015343762 [0,0,0,0,1,0|3,0,0]=4 1047 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 527a_100000742766_100103153847 [0,0,0,0,1,0|3,0,0]=4 1048 B14R1.419 CC(=O)OCc1ccc(cc1)C(=O)C 1458a_100000006716_200000210301 [0,0,0,0,1,0|1,0,0]=2 1049 B14R1.419 CC(=O)OCc1ccc(cc1)C(=O)[13CH3] 1458a_100000006716_200025704644 [0,0,0,0,1,0|1,0,0]=2 1050 B14R1.419 CC(=O)c1ccc(cc1)CCN(C)C 2230a_100102631434_200000038727 [0,0,0,0,1,0|2,0,0]=3 1051 B14R1.419 CC(=O)c1ccc(cc1)CCN(C)C 269982a_100102631434_200000038727 [0,0,0,0,1,0|2,0,0]=3 1052 B14R1.419 CC(=O)c1ccc(cc1)CNC(C)C 2230a_100138425928_100000756337 [0,0,0,0,1,0|2,0,1]=4 1053 B14R1.419 CC(=O)c1ccc(cc1)CNC(C)C 34a_100138425928_100000756337 [0,0,0,0,1,0|2,0,1]=4 1054 B14R1.419 CC(=O)c1ccc(cc1)COC(C)C 34a_100000212225_100000756337 [0,0,0,0,1,0|2,0,1]=4 1055 B14R1.419 CC(=O)c1ccc(cc1)COC(C)C 7a_100000082505_100000210206 [0,0,0,0,1,0|2,0,1]=4 1056 B14R1.419 CC(=O)c1ccc(cc1)CSC(C)C 62a_100000210206_100000756337 [0,0,0,0,1,0|2,0,1]=4 1057 B14R1.419 CC(=O)c1ccc(cc1)CSC(C)C 62a_100000756337_100000210206 [0,0,0,0,1,0|2,0,1]=4 1058 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 1458a_100000186835_200000210301 [0,0,0,0,1,0|2,0,0]=3 1059 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 34a_100000185113_100000187820 [0,0,0,0,1,0|2,0,0]=3 1060 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 7a_100000185113_100000187820 [0,0,0,0,1,0|2,0,0]=3 1061 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)[O-] 34a_100000185113_100020667443 [0,0,0,0,1,0|2,0,0]=3 1062 B14R1.419 CC(=O)c1ccc(cc1)OCC(C)C 1458a_100000182900_200000210301 [0,0,0,0,1,0|2,0,1]=4 1063 B14R1.419 CC(=O)c1ccc(cc1)OCC(C)C 34a_100000185113_100000210624 [0,0,0,0,1,0|2,0,1]=4 1064 B14R1.419 CC(=O)c1ccc(cc1)OCC(C)C 7a_100000185113_100000210760 [0,0,0,0,1,0|2,0,1]=4 1065 B14R1.419 CC(=O)c1ccc(cc1)OCC(C)O 34a_100000185113_100011218427 [0,0,0,0,1,0|1,0,2]=4 1066 B14R1.419 CC(=O)c1ccc(cc1)OCC(C)O 7a_100000185113_100011218427 [0,0,0,0,1,0|1,0,2]=4 1067 B14R1.419 CC(=O)c1ccc(cc1)OC[C@@H](C)O 34a_100000185113_100009817552 [0,0,0,0,1,0|1,0,2]=4 1068 B14R1.419 CC(=O)c1ccc(cc1)OC[C@@H](C)O 7a_100000185113_100009817552 [0,0,0,0,1,0|1,0,2]=4 1069 B14R1.419 CC(=O)c1ccc(cc1)OC[N+](=O)[O-] 34a_100000185113_100000761209 [0,0,0,0,1,0|3,0,0]=4 1070 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)N 62a_100000185465_100000747473 [0,0,0,0,1,0|2,0,0]=3 1071 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000185465 [0,0,0,0,1,0|2,0,0]=3 1072 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100000185465_100020667443 [0,0,0,0,1,0|2,0,0]=3 1073 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000185465 [0,0,0,0,1,0|2,0,0]=3 1074 B14R1.419 CC(=O)c1ccc(cc1)SCC(C)C 62a_100000185465_100000210760 [0,0,0,0,1,0|2,0,1]=4 1075 B14R1.419 CC(=O)c1ccc(cc1)SCC(C)C 62a_100000210624_100000185465 [0,0,0,0,1,0|2,0,1]=4 1076 B14R1.419 CC(=O)c1ccc(cc1)SCC(C)O 62a_100000185465_100011218427 [0,0,0,0,1,0|1,0,2]=4 1077 B14R1.419 CC(=O)c1ccc(cc1)SCC(C)O 62a_100011218427_100000185465 [0,0,0,0,1,0|1,0,2]=4 1078 B14R1.419 CC(=O)c1ccc(cc1)SC[C@@H](C)O 62a_100000185465_100009817552 [0,0,0,0,1,0|1,0,2]=4 1079 B14R1.419 CC(=O)c1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000185465 [0,0,0,0,1,0|1,0,2]=4 1080 B14R1.419 CC(=O)c1ccc(cc1)SC[N+](=O)[O-] 62a_100000185465_100000761209 [0,0,0,0,1,0|3,0,0]=4 1081 B14R1.419 CC(=O)c1ccc(cn1)OCC(=O)N 34a_100012001710_100000187820 [0,0,0,0,1,0|3,0,0]=4 1082 B14R1.419 CC(=O)c1ccc(cn1)OCC(=O)N 7a_100012001710_100000187820 [0,0,0,0,1,0|3,0,0]=4 1083 B14R1.419 CC(=O)c1ccc(cn1)OCC(=O)[O-] 34a_100012001710_100020667443 [0,0,0,0,1,0|3,0,0]=4 1084 B14R1.419 CC(=O)c1ccc(cn1)SCC(=O)N 62a_100000686046_100000747473 [0,0,0,0,1,0|3,0,0]=4 1085 B14R1.419 CC(=O)c1ccc(cn1)SCC(=O)N 62a_100000747473_100000686046 [0,0,0,0,1,0|3,0,0]=4 1086 B14R1.419 CC(=O)c1ccc(cn1)SCC(=O)[O-] 62a_100000686046_100020667443 [0,0,0,0,1,0|3,0,0]=4 1087 B14R1.419 CC(=O)c1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100000686046 [0,0,0,0,1,0|3,0,0]=4 1088 B14R1.419 CC(=O)c1ccc(nc1)SCC(=O)N 62a_100000684857_100000747473 [0,0,0,0,1,0|3,0,0]=4 1089 B14R1.419 CC(=O)c1ccc(nc1)SCC(=O)N 62a_100000747473_100000684857 [0,0,0,0,1,0|3,0,0]=4 1090 B14R1.419 CC(=O)c1ccc(nc1)SCC(=O)[O-] 62a_100000684857_100020667443 [0,0,0,0,1,0|3,0,0]=4 1091 B14R1.419 CC(=O)c1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100000684857 [0,0,0,0,1,0|3,0,0]=4 1092 B14R1.419 CC(C)COc1ccc(cc1)C(=O)[13CH3] 1458a_100000182900_200025704644 [0,0,0,0,1,0|2,0,1]=4 1093 B14R1.419 CC(C)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234928_200025704644 [0,0,0,0,1,0|1,0,1]=3 1094 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)[13CH3] 1458a_100000189144_200025704644 [0,0,0,0,1,0|2,0,1]=4 1095 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)[13CH3] 1458a_100000740577_200025704644 [0,0,0,0,1,0|2,0,1]=4 1096 B14R1.419 CN(C)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000205957_200025704644 [0,0,0,0,1,0|2,0,0]=3 1097 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)N 34a_200000064373_100000187820 [0,0,0,0,1,0|3,0,0]=4 1098 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)N 7a_200000064373_100000187820 [0,0,0,0,1,0|3,0,0]=4 1099 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)[O-] 34a_200000064373_100020667443 [0,0,0,0,1,0|3,0,0]=4 1100 B14R1.419 CS(=O)c1ccc(cc1)SCC(=O)N 62a_100009816266_100000747473 [0,0,0,0,1,0|3,0,0]=4 1101 B14R1.419 CS(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100009816266_100020667443 [0,0,0,0,1,0|3,0,0]=4 1102 B14R1.419 NC(=O)CNc1ccc(cc1)C(=O)N 34a_100000210537_100000187820 [0,0,0,0,1,0|3,0,0]=4 1103 B14R1.419 NC(=O)COc1ccc(cc1)C(=O)N 34a_100000746352_100000187820 [0,0,0,0,1,0|3,0,0]=4 1104 B14R1.419 NC(=O)COc1ccc(cc1)C(=O)N 7a_100000746352_100000187820 [0,0,0,0,1,0|3,0,0]=4 1105 B14R1.419 NC(=O)CSc1ccc(cc1)C(=O)N 62a_100000162191_100000747473 [0,0,0,0,1,0|3,0,0]=4 1106 B14R1.419 NC(=O)CSc1ccc(cc1)C(=O)N 62a_100000747473_100000162191 [0,0,0,0,1,0|3,0,0]=4 1107 B14R1.419 NC(=O)c1ccc(cc1)NCC(=O)[O-] 34a_100000210537_100020667443 [0,0,0,0,1,0|3,0,0]=4 1108 B14R1.419 NC(=O)c1ccc(cc1)OCC(=O)[O-] 34a_100000746352_100020667443 [0,0,0,0,1,0|3,0,0]=4 1109 B14R1.419 NC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100000162191_100020667443 [0,0,0,0,1,0|3,0,0]=4 1110 B14R1.419 NC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000162191 [0,0,0,0,1,0|3,0,0]=4 1111 B14R1.419 [13CH3]C(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_200025704644 [0,0,0,0,1,0|2,0,0]=3 1112 B14R1.419 [13CH3]C(=O)COc1ccc(cc1)[N+](=O)[O-] 1458a_100000181393_200025704644 [0,0,0,0,1,0|3,0,0]=4 1113 B14R1.419 [13CH3]C(=O)CSc1ccc(cc1)[N+](=O)[O-] 1458a_100000156286_200025704644 [0,0,0,0,1,0|3,0,0]=4 1114 B14R1.419 [13CH3]C(=O)c1ccc(cc1)OCC(=O)N 1458a_100000186835_200025704644 [0,0,0,0,1,0|2,0,0]=3 1115 B14R1.805 CC(=Cc1ccc(cc1)CC(=O)N)C 271570a_100102525489_100000162331 [0,0,0,0,1,0|3,0,0]=4 1116 B14R1.805 CC(=O)Cc1ccc(cc1)C=C(C)C 271570a_100102525489_100000691760 [0,0,0,0,1,0|2,0,0]=3 1117 B14R1.805 CC(=O)Cc1ccc(cc1)CC(C)C 1458a_100000070787_100011982790 [0,0,0,0,1,0|2,0,1]=4 1118 B14R1.805 CC(=O)Cc1ccc(cc1)CC(C)C 1458a_100000204619_200000210301 [0,0,0,0,1,0|2,0,1]=4 1119 B14R1.805 CC(=O)Cc1ccc(cc1)NC(=O)C 1458a_100000070787_100000731167 [0,0,0,0,1,0|1,0,0]=2 1120 B14R1.805 CC(=O)Cc1ccc(cc1)NC(=O)C 1458a_100000199044_200000210301 [0,0,0,0,1,0|1,0,0]=2 1121 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 1458a_100000244678_200000210301 [0,0,0,0,1,0|1,0,1]=3 1122 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 34a_100011218180_100000210206 [0,0,0,0,1,0|1,0,1]=3 1123 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 7a_100011218180_100000210206 [0,0,0,0,1,0|1,0,1]=3 1124 B14R1.805 CC(=O)Cc1ccc(cc1)OC(F)F 1458a_100000070787_100011217905 [0,0,0,0,1,0|2,0,1]=4 1125 B14R1.805 CC(=O)Cc1ccc(cc1)OC(F)F 1458a_100000199076_200000210301 [0,0,0,0,1,0|2,0,1]=4 1126 B14R1.805 CC(=O)Cc1ccc(cc1)SC(C)C 62a_100000210206_100000691760 [0,0,0,0,1,0|1,1,1]=4 1127 B14R1.805 CC(=O)Cc1ccc(cc1)SC(C)C 62a_100000691760_100000210206 [0,0,0,0,1,0|1,1,1]=4 1128 B14R1.805 CC(=O)Nc1ccc(cc1)C=C(C)C 271570a_100102525489_100000155215 [0,0,0,0,1,0|2,0,1]=4 1129 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 11a_100000738315_100015343762 [0,0,0,0,1,0|2,0,0]=3 1130 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 1626a_100000738315_100015343762 [0,0,0,0,1,0|2,0,0]=3 1131 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 22a_100000738315_100000070787 [0,0,0,0,1,0|2,0,0]=3 1132 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 527a_100000738315_100103153847 [0,0,0,0,1,0|2,0,0]=3 1133 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)[13CH3] 1458a_100000199044_200025704644 [0,0,0,0,1,0|1,0,0]=2 1134 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 11a_100000687309_100015343762 [0,0,0,0,1,0|2,0,1]=4 1135 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 1626a_100000687309_100015343762 [0,0,0,0,1,0|2,0,1]=4 1136 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 22a_100000687309_100000070787 [0,0,0,0,1,0|2,0,1]=4 1137 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 527a_100000687309_100103153847 [0,0,0,0,1,0|2,0,1]=4 1138 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 11a_100000246131_100015343762 [0,0,0,0,1,0|3,0,0]=4 1139 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 2230a_100102631434_100000731167 [0,0,0,0,1,0|3,0,0]=4 1140 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 22a_100000246131_100000070787 [0,0,0,0,1,0|3,0,0]=4 1141 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 269982a_100102631434_100000731167 [0,0,0,0,1,0|3,0,0]=4 1142 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 527a_100000246131_100103153847 [0,0,0,0,1,0|3,0,0]=4 1143 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C 11a_100000184111_100015343762 [0,0,0,0,1,0|2,0,0]=3 1144 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C 1626a_100000184111_100015343762 [0,0,0,0,1,0|2,0,0]=3 1145 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C 22a_100000184111_100000070787 [0,0,0,0,1,0|2,0,0]=3 1146 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C 527a_100000184111_100103153847 [0,0,0,0,1,0|2,0,0]=3 1147 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C 11a_100009829859_100015343762 [0,0,0,0,1,0|1,0,0]=2 1148 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C 1626a_100009829859_100015343762 [0,0,0,0,1,0|1,0,0]=2 1149 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C 22a_100009829859_100000070787 [0,0,0,0,1,0|1,0,0]=2 1150 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C 527a_100009829859_100103153847 [0,0,0,0,1,0|1,0,0]=2 1151 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 11a_100011194259_100015343762 [0,0,0,0,1,0|2,0,1]=4 1152 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 1626a_100011194259_100015343762 [0,0,0,0,1,0|2,0,1]=4 1153 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 22a_100011194259_100000070787 [0,0,0,0,1,0|2,0,1]=4 1154 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 34a_100000184395_100000210206 [0,0,0,0,1,0|2,0,1]=4 1155 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 527a_100011194259_100103153847 [0,0,0,0,1,0|2,0,1]=4 1156 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 7a_100000184395_100000210206 [0,0,0,0,1,0|2,0,1]=4 1157 B14R1.805 CC(=O)Oc1ccc(cc1)C=C(C)C 271570a_100102525489_100000002173 [0,0,0,0,1,0|1,0,1]=3 1158 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 2230a_100102631434_100000033664 [0,0,0,0,1,0|2,0,0]=3 1159 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 269982a_100102631434_100000033664 [0,0,0,0,1,0|2,0,0]=3 1160 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 270004a_100102631434_100000014718 [0,0,0,0,1,0|2,0,0]=3 1161 B14R1.805 CC(=O)Oc1ccc(cc1)SC(C)C 62a_100000210206_100000002173 [0,0,0,0,1,0|2,0,1]=4 1162 B14R1.805 CC(=O)Sc1ccc(cc1)C=C(C)C 271570a_100102525489_200009995050 [0,0,0,0,1,0|1,1,1]=4 1163 B14R1.805 CC(=S)Oc1ccc(cc1)C=C(C)C 271570a_100102525489_200009816735 [0,0,0,0,1,0|1,1,1]=4 1164 B14R1.805 CC(C)Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000204619_200025704644 [0,0,0,0,1,0|2,0,1]=4 1165 B14R1.805 CC(C)Oc1ccc(cc1)CC(=O)N 34a_100000020825_100000210206 [0,0,0,0,1,0|2,0,1]=4 1166 B14R1.805 CC(C)Oc1ccc(cc1)CC(=O)[13CH3] 1458a_100000244678_200025704644 [0,0,0,0,1,0|1,0,1]=3 1167 B14R1.805 [13CH3]C(=O)Cc1ccc(cc1)OC(F)F 1458a_100000199076_200025704644 [0,0,0,0,1,0|2,0,1]=4 1168 B16R1.603 C=C(C)CNc1ccc(cc1)CNC(=O)C 34a_100000755463_100000748629 [0,0,0,0,0,1|3,0,0]=4 1169 B16R1.603 C=C(C)CNc1ccc(cc1)OCC(=C)C 2230a_200015186533_100000748629 [0,0,0,0,0,1|3,0,0]=4 1170 B16R1.603 C=C(C)CNc1ccc(cc1)OCC(=C)C 34a_200015186533_100000748629 [0,0,0,0,0,1|3,0,0]=4 1171 B16R1.603 C=C(C)CNc1ccc(cc1)OCC(=O)N 2230a_100000238760_100000748629 [0,0,0,0,0,1|3,0,0]=4 1172 B16R1.603 C=C(C)CNc1ccc(cc1)OCC(=O)N 34a_100000238760_100000748629 [0,0,0,0,0,1|3,0,0]=4 1173 B16R1.603 C=C(C)COc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_100000748629 [0,0,0,0,0,1|1,0,2]=4 1174 B16R1.603 C=C(C)COc1ccc(cc1)CCC(=O)C 34a_100000198047_100000748629 [0,0,0,0,0,1|1,0,0]=2 1175 B16R1.603 C=C(C)COc1ccc(cc1)CCC(=O)C 7a_100000198047_100000748629 [0,0,0,0,0,1|1,0,0]=2 1176 B16R1.603 C=C(C)COc1ccc(cc1)CCC(C)O 34a_100000189425_100000748629 [0,0,0,0,0,1|1,0,2]=4 1177 B16R1.603 C=C(C)COc1ccc(cc1)CCC(C)O 7a_100000189425_100000748629 [0,0,0,0,0,1|1,0,2]=4 1178 B16R1.603 C=C(C)COc1ccc(cc1)NCC(=O)N 2230a_200015186533_100000747473 [0,0,0,0,0,1|3,0,0]=4 1179 B16R1.603 C=C(C)COc1ccc(cc1)NCC(=O)N 34a_200015186533_100000187820 [0,0,0,0,0,1|3,0,0]=4 1180 B16R1.603 C=C(C)COc1ccc(cc1)NCC(=O)[O-] 34a_200015186533_100020667443 [0,0,0,0,0,1|3,0,0]=4 1181 B16R1.603 C=C(C)CSc1ccc(cc1)/C=C/C(=O)C 62a_100000748629_200016259395 [0,0,0,0,0,1|3,0,0]=4 1182 B16R1.603 C=C(C)CSc1ccc(cc1)/C=C/C(=O)C 62a_200016259395_100000211660 [0,0,0,0,0,1|3,0,0]=4 1183 B16R1.603 C=C(C)CSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000211660 [0,0,0,0,0,1|1,1,0]=3 1184 B16R1.603 C=C(C)CSc1ccc(cc1)CCC(=O)C 62a_100000748629_100000723691 [0,0,0,0,0,1|1,1,0]=3 1185 B16R1.603 C=C(C)CSc1ccc(cc1)CCC(=O)N 62a_100000748629_200010110666 [0,0,0,0,0,1|2,1,0]=4 1186 B16R1.603 C=C(C)CSc1ccc(cc1)CCC(=O)N 62a_200010110666_100000211660 [0,0,0,0,0,1|2,1,0]=4 1187 B16R1.603 C=C(C)CSc1ccc(cc1)CNC(=O)C 62a_100000748629_200000685173 [0,0,0,0,0,1|2,1,0]=4 1188 B16R1.603 C=C(C)CSc1ccc(cc1)CNC(=O)C 62a_200000685173_100000211660 [0,0,0,0,0,1|2,1,0]=4 1189 B16R1.603 C=C(C)CSc1ccc(cc1)NNC(=O)C 62a_100000748629_200009815283 [0,0,0,0,0,1|3,0,0]=4 1190 B16R1.603 C=C(C)CSc1ccc(cc1)NNC(=O)C 62a_200009815283_100000211660 [0,0,0,0,0,1|3,0,0]=4 1191 B16R1.603 C=C(F)COc1ccc(cc1)CCC(=O)C 34a_100000198047_100009893438 [0,0,0,0,0,1|1,0,1]=3 1192 B16R1.603 C=C(F)COc1ccc(cc1)CCC(=O)C 7a_100000198047_100000042424 [0,0,0,0,0,1|1,0,1]=3 1193 B16R1.603 C=C(F)CSc1ccc(cc1)CCC(=O)C 62a_100000042424_100000723691 [0,0,0,0,0,1|1,1,1]=4 1194 B16R1.603 C=C(F)CSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000042424 [0,0,0,0,0,1|1,1,1]=4 1195 B16R1.603 CC(=O)/C=C/c1ccc(cc1)OCC(=O)N 34a_100000189429_100000187820 [0,0,0,0,0,1|1,0,2]=4 1196 B16R1.603 CC(=O)/C=C/c1ccc(cc1)OCC(=O)[O-] 34a_100000189429_100020667443 [0,0,0,0,0,1|1,0,2]=4 1197 B16R1.603 CC(=O)/C=C/c1ccc(cc1)SCC(=O)N 62a_100000747473_200016259395 [0,0,0,0,0,1|3,0,0]=4 1198 B16R1.603 CC(=O)/C=C/c1ccc(cc1)SCC(=O)N 62a_200016259395_100000747473 [0,0,0,0,0,1|3,0,0]=4 1199 B16R1.603 CC(=O)/C=C/c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200016259395 [0,0,0,0,0,1|3,0,0]=4 1200 B16R1.603 CC(=O)/C=C/c1ccc(cc1)SCC(=O)[O-] 62a_200016259395_100020667443 [0,0,0,0,0,1|3,0,0]=4 1201 B16R1.603 CC(=O)C=Cc1ccc(cc1)OCC(=O)N 1458a_200000217505_200000210301 [0,0,0,0,0,1|1,0,2]=4 1202 B16R1.603 CC(=O)CCc1ccc(cc1)C=CC(C)C 271570a_100016257149_100000723691 [0,0,0,0,0,1|2,0,1]=4 1203 B16R1.603 CC(=O)CCc1ccc(cc1)C=CC(C)O 271570a_200011019289_100000723691 [0,0,0,0,0,1|1,0,2]=4 1204 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(=O)N 34a_100000198047_100000187820 [0,0,0,0,0,1|1,0,0]=2 1205 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(=O)N 7a_100000198047_100000187820 [0,0,0,0,0,1|1,0,0]=2 1206 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(=O)[O-] 34a_100000198047_100020667443 [0,0,0,0,0,1|1,0,0]=2 1207 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(C)C 34a_100000198047_100000210624 [0,0,0,0,0,1|1,0,1]=3 1208 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(C)C 7a_100000198047_100000210760 [0,0,0,0,0,1|1,0,1]=3 1209 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(C)O 34a_100000198047_100011218427 [0,0,0,0,0,1|0,0,2]=3 1210 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(C)O 7a_100000198047_100011218427 [0,0,0,0,0,1|0,0,2]=3 1211 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(F)F 34a_100000198047_100011934356 [0,0,0,0,0,1|2,0,1]=4 1212 B16R1.603 CC(=O)CCc1ccc(cc1)OCC(F)F 7a_100000198047_100011934356 [0,0,0,0,0,1|2,0,1]=4 1213 B16R1.603 CC(=O)CCc1ccc(cc1)OC[C@@H](C)O 34a_100000198047_100009817552 [0,0,0,0,0,1|0,0,2]=3 1214 B16R1.603 CC(=O)CCc1ccc(cc1)OC[C@@H](C)O 7a_100000198047_100009817552 [0,0,0,0,0,1|0,0,2]=3 1215 B16R1.603 CC(=O)CCc1ccc(cc1)OC[N+](=O)[O-] 34a_100000198047_100000761209 [0,0,0,0,0,1|2,0,0]=3 1216 B16R1.603 CC(=O)CCc1ccc(cc1)SCC(=O)N 62a_100000723691_100000747473 [0,0,0,0,0,1|1,1,0]=3 1217 B16R1.603 CC(=O)CCc1ccc(cc1)SCC(=O)N 62a_100000747473_100000723691 [0,0,0,0,0,1|1,1,0]=3 1218 B16R1.603 CC(=O)CCc1ccc(cc1)SCC(=O)[O-] 62a_100000723691_100020667443 [0,0,0,0,0,1|1,1,0]=3 1219 B16R1.603 CC(=O)CCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000723691 [0,0,0,0,0,1|1,1,0]=3 1220 B16R1.603 CC(=O)CCc1ccc(cc1)SCC(C)C 62a_100000210624_100000723691 [0,0,0,0,0,1|1,1,1]=4 1221 B16R1.603 CC(=O)CCc1ccc(cc1)SCC(C)C 62a_100000723691_100000210760 [0,0,0,0,0,1|1,1,1]=4 1222 B16R1.603 CC(=O)CCc1ccc(cc1)SCC(C)O 62a_100000723691_100011218427 [0,0,0,0,0,1|0,1,2]=4 1223 B16R1.603 CC(=O)CCc1ccc(cc1)SCC(C)O 62a_100011218427_100000723691 [0,0,0,0,0,1|0,1,2]=4 1224 B16R1.603 CC(=O)CCc1ccc(cc1)SC[C@@H](C)O 62a_100000723691_100009817552 [0,0,0,0,0,1|0,1,2]=4 1225 B16R1.603 CC(=O)CCc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000723691 [0,0,0,0,0,1|0,1,2]=4 1226 B16R1.603 CC(=O)CCc1ccc(cc1)SC[N+](=O)[O-] 62a_100000723691_100000761209 [0,0,0,0,0,1|2,1,0]=4 1227 B16R1.603 CC(=O)NCc1ccc(cc1)NCC(=O)N 34a_100000755463_100000187820 [0,0,0,0,0,1|3,0,0]=4 1228 B16R1.603 CC(=O)NCc1ccc(cc1)NCC(=O)[O-] 34a_100000755463_100020667443 [0,0,0,0,0,1|3,0,0]=4 1229 B16R1.603 CC(=O)NCc1ccc(cc1)OCC(=O)N 1626a_100000244766_100015343762 [0,0,0,0,0,1|2,0,0]=3 1230 B16R1.603 CC(=O)NCc1ccc(cc1)OCC(=O)N 240690a_100000244766_100015343762 [0,0,0,0,0,1|2,0,0]=3 1231 B16R1.603 CC(=O)NCc1ccc(cc1)OCC(=O)N 527a_100000244766_100103153847 [0,0,0,0,0,1|2,0,0]=3 1232 B16R1.603 CC(=O)NCc1ccc(cc1)OCC(C)C 11a_100103151094_100015343762 [0,0,0,0,0,1|2,0,1]=4 1233 B16R1.603 CC(=O)NCc1ccc(cc1)OCC(C)C 1626a_100103151094_100015343762 [0,0,0,0,0,1|2,0,1]=4 1234 B16R1.603 CC(=O)NCc1ccc(cc1)OCC(C)C 240690a_100103151094_100015343762 [0,0,0,0,0,1|2,0,1]=4 1235 B16R1.603 CC(=O)NCc1ccc(cc1)OCC(C)C 527a_100103151094_100103153847 [0,0,0,0,0,1|2,0,1]=4 1236 B16R1.603 CC(=O)NCc1ccc(cc1)SCC(=O)N 62a_100000747473_200000685173 [0,0,0,0,0,1|2,1,0]=4 1237 B16R1.603 CC(=O)NCc1ccc(cc1)SCC(=O)N 62a_200000685173_100000747473 [0,0,0,0,0,1|2,1,0]=4 1238 B16R1.603 CC(=O)NCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200000685173 [0,0,0,0,0,1|2,1,0]=4 1239 B16R1.603 CC(=O)NCc1ccc(cc1)SCC(=O)[O-] 62a_200000685173_100020667443 [0,0,0,0,0,1|2,1,0]=4 1240 B16R1.603 CC(=O)NNc1ccc(cc1)SCC(=O)N 62a_100000747473_200009815283 [0,0,0,0,0,1|3,0,0]=4 1241 B16R1.603 CC(=O)NNc1ccc(cc1)SCC(=O)N 62a_200009815283_100000747473 [0,0,0,0,0,1|3,0,0]=4 1242 B16R1.603 CC(=O)NNc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200009815283 [0,0,0,0,0,1|3,0,0]=4 1243 B16R1.603 CC(=O)NNc1ccc(cc1)SCC(=O)[O-] 62a_200009815283_100020667443 [0,0,0,0,0,1|3,0,0]=4 1244 B16R1.603 CC(O)CCc1ccc(cc1)OCC(=O)N 34a_100000189425_100000187820 [0,0,0,0,0,1|1,0,2]=4 1245 B16R1.603 CC(O)CCc1ccc(cc1)OCC(=O)N 7a_100000189425_100000187820 [0,0,0,0,0,1|1,0,2]=4 1246 B16R1.603 CC(O)CCc1ccc(cc1)OCC(=O)[O-] 34a_100000189425_100020667443 [0,0,0,0,0,1|1,0,2]=4 1247 B16R1.603 NC(=O)CCc1ccc(cc1)SCC(=O)N 62a_100000747473_200010110666 [0,0,0,0,0,1|2,1,0]=4 1248 B16R1.603 NC(=O)CCc1ccc(cc1)SCC(=O)N 62a_200010110666_100000747473 [0,0,0,0,0,1|2,1,0]=4 1249 B16R1.603 NC(=O)CCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200010110666 [0,0,0,0,0,1|2,1,0]=4 1250 B16R1.603 NC(=O)CCc1ccc(cc1)SCC(=O)[O-] 62a_200010110666_100020667443 [0,0,0,0,0,1|2,1,0]=4 1251 B16R1.603 NC(=O)CNc1ccc(cc1)OCC(=O)N 2230a_100000238760_100000747473 [0,0,0,0,0,1|3,0,0]=4 1252 B16R1.603 NC(=O)CNc1ccc(cc1)OCC(=O)N 34a_100000238760_100000187820 [0,0,0,0,0,1|3,0,0]=4 1253 B16R1.603 NC(=O)COc1ccc(cc1)NCC(=O)[O-] 34a_100000238760_100020667443 [0,0,0,0,0,1|3,0,0]=4 1254 B16R1.603 [13CH3]C(=O)C=Cc1ccc(cc1)OCC(=O)N 1458a_200000217505_200025704644 [0,0,0,0,0,1|1,0,2]=4 1255 B16R1.1287 C=C(C)CCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000730704 [0,0,0,0,0,1|3,0,0]=4 1256 B16R1.1287 C=C(C)CCNc1ccc(cc1)CC(=O)N 34a_100000738315_100000730704 [0,0,0,0,0,1|3,0,0]=4 1257 B16R1.1287 C=C(C)CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000730704 [0,0,0,0,0,1|2,0,0]=3 1258 B16R1.1287 C=C(C)CCNc1ccc(cc1)OC(C)C 2230a_100011194259_100000730704 [0,0,0,0,0,1|2,0,1]=4 1259 B16R1.1287 C=C(C)CCNc1ccc(cc1)OC(C)C 34a_100011194259_100000730704 [0,0,0,0,0,1|2,0,1]=4 1260 B16R1.1287 C=C(C)CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000730704 [0,0,0,0,0,1|2,0,0]=3 1261 B16R1.1287 C=C(C)CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000730704 [0,0,0,0,0,1|2,0,0]=3 1262 B16R1.1287 C=C(C)CCOc1ccc(cc1)CC(=O)N 34a_100000020825_100000730704 [0,0,0,0,0,1|3,0,0]=4 1263 B16R1.1287 C=C(C)CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000730704 [0,0,0,0,0,1|2,0,0]=3 1264 B16R1.1287 C=C(C)CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000730704 [0,0,0,0,0,1|2,0,0]=3 1265 B16R1.1287 C=C(C)CCOc1ccc(cc1)OC(C)C 34a_100000757185_100000730704 [0,0,0,0,0,1|2,0,1]=4 1266 B16R1.1287 C=C(C)CCOc1ccc(cc1)OC(C)C 7a_100000757185_100000730704 [0,0,0,0,0,1|2,0,1]=4 1267 B16R1.1287 C=C(C)CCOc1ccc(nc1)NC(=O)C 34a_200000094647_100000730704 [0,0,0,0,0,1|3,0,0]=4 1268 B16R1.1287 C=C(C)CCOc1ccc(nc1)NC(=O)C 7a_200000094647_100000730704 [0,0,0,0,0,1|3,0,0]=4 1269 B16R1.1287 C=C(C)CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000730704 [0,0,0,0,0,1|2,0,0]=3 1270 B16R1.1287 C=C(C)CCSc1ccc(cc1)CC(=O)C 62a_100000730704_100000691760 [0,0,0,0,0,1|2,0,0]=3 1271 B16R1.1287 C=C(C)CCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000730704 [0,0,0,0,0,1|3,0,0]=4 1272 B16R1.1287 C=C(C)CCSc1ccc(cc1)CC(=O)N 62a_100000730704_100000162331 [0,0,0,0,0,1|3,0,0]=4 1273 B16R1.1287 C=C(C)CCSc1ccc(cc1)NC(=O)C 62a_100000730704_100000155215 [0,0,0,0,0,1|2,0,0]=3 1274 B16R1.1287 C=C(C)CCSc1ccc(cc1)NC(=O)N 62a_100000730704_100000198584 [0,0,0,0,0,1|3,0,0]=4 1275 B16R1.1287 C=C(C)CCSc1ccc(cc1)OC(=O)C 62a_100000730704_100000002173 [0,0,0,0,0,1|1,0,0]=2 1276 B16R1.1287 C=C(C)CCSc1ccc(cc1)OC(=S)C 62a_100000730704_200009816735 [0,0,0,0,0,1|1,1,0]=3 1277 B16R1.1287 C=C(C)CCSc1ccc(cc1)OC(C)C 62a_100000169947_100000730704 [0,0,0,0,0,1|2,0,1]=4 1278 B16R1.1287 C=C(C)CCSc1ccc(cc1)OC(C)C 62a_100000730704_100000169947 [0,0,0,0,0,1|2,0,1]=4 1279 B16R1.1287 C=C(C)CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000730704 [0,0,0,0,0,1|1,1,0]=3 1280 B16R1.1287 C=C(C)CCSc1ccc(cn1)NC(=O)C 62a_100000730704_100011934715 [0,0,0,0,0,1|3,0,0]=4 1281 B16R1.1287 C=C(C)CCSc1ccc(nc1)NC(=O)C 62a_100000730704_100000193312 [0,0,0,0,0,1|3,0,0]=4 1282 B16R1.1287 C=C(C)CNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100000748629 [0,0,0,0,0,1|3,0,0]=4 1283 B16R1.1287 C=C(C)CNCc1ccc(cc1)NC(=O)C 34a_100000735448_100000748629 [0,0,0,0,0,1|2,0,0]=3 1284 B16R1.1287 C=C(C)CNCc1ccc(cc1)OC(C)C 2230a_100020586559_100000748629 [0,0,0,0,0,1|2,0,1]=4 1285 B16R1.1287 C=C(C)CNCc1ccc(cc1)OC(C)C 34a_100020586559_100000748629 [0,0,0,0,0,1|2,0,1]=4 1286 B16R1.1287 C=C(C)COCc1ccc(cc1)NC(=O)C 34a_100000210245_100000731167 [0,0,0,0,0,1|2,0,0]=3 1287 B16R1.1287 C=C(C)COCc1ccc(cc1)NC(=O)C 34a_100000246270_100000748629 [0,0,0,0,0,1|2,0,0]=3 1288 B16R1.1287 C=C(C)COCc1ccc(cc1)NC(=O)C 7a_100000246270_100000748629 [0,0,0,0,0,1|2,0,0]=3 1289 B16R1.1287 C=C(C)COCc1ccc(cc1)OC(C)C 34a_100000173089_100000748629 [0,0,0,0,0,1|2,0,1]=4 1290 B16R1.1287 C=C(C)COCc1ccc(cc1)OC(C)C 7a_100000173089_100000748629 [0,0,0,0,0,1|2,0,1]=4 1291 B16R1.1287 C=C(C)CSCc1ccc(cc1)NC(=O)C 62a_100000748629_100000731167 [0,0,0,0,0,1|2,0,0]=3 1292 B16R1.1287 C=C(C)CSCc1ccc(cc1)OC(=O)C 62a_100000748629_100000033664 [0,0,0,0,0,1|1,0,0]=2 1293 B16R1.1287 C=C(F)CNCc1ccc(cc1)NC(=O)C 34a_100000735448_100009893438 [0,0,0,0,0,1|2,0,1]=4 1294 B16R1.1287 C=C(F)COCc1ccc(cc1)NC(=O)C 34a_100000246270_100009893438 [0,0,0,0,0,1|2,0,1]=4 1295 B16R1.1287 C=C(F)COCc1ccc(cc1)NC(=O)C 34a_200010262243_100000731167 [0,0,0,0,0,1|2,0,1]=4 1296 B16R1.1287 C=C(F)COCc1ccc(cc1)NC(=O)C 7a_100000246270_100000042424 [0,0,0,0,0,1|2,0,1]=4 1297 B16R1.1287 C=C(F)CSCc1ccc(cc1)NC(=O)C 62a_100000042424_100000731167 [0,0,0,0,0,1|2,0,1]=4 1298 B16R1.1287 C=C(F)CSCc1ccc(cc1)OC(=O)C 62a_100000042424_100000033664 [0,0,0,0,0,1|1,0,1]=3 1299 B16R1.1287 CC(=O)CCCc1ccc(cc1)CC(C)C 1458a_200000692872_200000210301 [0,0,0,0,0,1|2,0,1]=4 1300 B16R1.1287 CC(=O)CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000053229 [0,0,0,0,0,1|1,0,0]=2 1301 B16R1.1287 CC(=O)CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000053229 [0,0,0,0,0,1|1,0,0]=2 1302 B16R1.1287 CC(=O)CCOc1ccc(cc1)OC(C)C 1458a_100000070787_100000069049 [0,0,0,0,0,1|1,0,1]=3 1303 B16R1.1287 CC(=O)CCOc1ccc(cc1)OC(C)C 7a_100000757185_100000053229 [0,0,0,0,0,1|1,0,1]=3 1304 B16R1.1287 CC(=O)CCOc1ccc(cc1)OC(F)F 7a_100011217645_100000053229 [0,0,0,0,0,1|2,0,1]=4 1305 B16R1.1287 CC(=O)CCOc1ccc(nc1)NC(=O)C 7a_200000094647_100000053229 [0,0,0,0,0,1|2,0,0]=3 1306 B16R1.1287 CC(=O)CCSc1ccc(cc1)C=C(Br)Br 62a_100000053229_200013992848 [0,0,0,0,0,1|3,0,0]=4 1307 B16R1.1287 CC(=O)CCSc1ccc(cc1)C=C(Br)Br 62a_200013992848_100000053229 [0,0,0,0,0,1|3,0,0]=4 1308 B16R1.1287 CC(=O)CCSc1ccc(cc1)C=C(F)F 62a_100000053229_200009816947 [0,0,0,0,0,1|3,0,0]=4 1309 B16R1.1287 CC(=O)CCSc1ccc(cc1)C=C(F)F 62a_200009816947_100000053229 [0,0,0,0,0,1|3,0,0]=4 1310 B16R1.1287 CC(=O)CCSc1ccc(cc1)CC(=O)C 62a_100000053229_100000691760 [0,0,0,0,0,1|1,0,0]=2 1311 B16R1.1287 CC(=O)CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000053229 [0,0,0,0,0,1|1,0,0]=2 1312 B16R1.1287 CC(=O)CCSc1ccc(cc1)CC(=O)N 62a_100000053229_100000162331 [0,0,0,0,0,1|2,0,0]=3 1313 B16R1.1287 CC(=O)CCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000053229 [0,0,0,0,0,1|2,0,0]=3 1314 B16R1.1287 CC(=O)CCSc1ccc(cc1)CC(C)C 62a_100000053229_100011221366 [0,0,0,0,0,1|2,0,1]=4 1315 B16R1.1287 CC(=O)CCSc1ccc(cc1)CC(C)C 62a_100011221366_100000053229 [0,0,0,0,0,1|2,0,1]=4 1316 B16R1.1287 CC(=O)CCSc1ccc(cc1)CN(C)C 62a_100000053229_100000174694 [0,0,0,0,0,1|3,0,0]=4 1317 B16R1.1287 CC(=O)CCSc1ccc(cc1)CN(C)C 62a_100000174694_100000053229 [0,0,0,0,0,1|3,0,0]=4 1318 B16R1.1287 CC(=O)CCSc1ccc(cc1)NC(=O)C 62a_100000053229_100000155215 [0,0,0,0,0,1|1,0,0]=2 1319 B16R1.1287 CC(=O)CCSc1ccc(cc1)NC(=O)N 62a_100000053229_100000198584 [0,0,0,0,0,1|2,0,0]=3 1320 B16R1.1287 CC(=O)CCSc1ccc(cc1)NC(C)C 62a_100000053229_100000219625 [0,0,0,0,0,1|2,0,1]=4 1321 B16R1.1287 CC(=O)CCSc1ccc(cc1)NC(C)C 62a_100000219625_100000053229 [0,0,0,0,0,1|2,0,1]=4 1322 B16R1.1287 CC(=O)CCSc1ccc(cc1)OC(=O)C 62a_100000053229_100000002173 [0,0,0,0,0,1|0,0,0]=1 1323 B16R1.1287 CC(=O)CCSc1ccc(cc1)OC(=S)C 62a_100000053229_200009816735 [0,0,0,0,0,1|0,1,0]=2 1324 B16R1.1287 CC(=O)CCSc1ccc(cc1)OC(C)C 62a_100000053229_100000169947 [0,0,0,0,0,1|1,0,1]=3 1325 B16R1.1287 CC(=O)CCSc1ccc(cc1)OC(C)C 62a_100000169947_100000053229 [0,0,0,0,0,1|1,0,1]=3 1326 B16R1.1287 CC(=O)CCSc1ccc(cc1)OC(F)F 62a_100000053229_100000179047 [0,0,0,0,0,1|2,0,1]=4 1327 B16R1.1287 CC(=O)CCSc1ccc(cc1)OC(F)F 62a_100000179047_100000053229 [0,0,0,0,0,1|2,0,1]=4 1328 B16R1.1287 CC(=O)CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000053229 [0,0,0,0,0,1|0,1,0]=2 1329 B16R1.1287 CC(=O)CCSc1ccc(cc1)SC(C)C 62a_100000053229_100009811894 [0,0,0,0,0,1|1,1,1]=4 1330 B16R1.1287 CC(=O)CCSc1ccc(cc1)SC(C)C 62a_100009811894_100000053229 [0,0,0,0,0,1|1,1,1]=4 1331 B16R1.1287 CC(=O)CCSc1ccc(cn1)CC(=O)N 62a_100000053229_200000071513 [0,0,0,0,0,1|3,0,0]=4 1332 B16R1.1287 CC(=O)CCSc1ccc(cn1)CC(=O)N 62a_200000071513_100000053229 [0,0,0,0,0,1|3,0,0]=4 1333 B16R1.1287 CC(=O)CCSc1ccc(cn1)NC(=O)C 62a_100000053229_100011934715 [0,0,0,0,0,1|2,0,0]=3 1334 B16R1.1287 CC(=O)CCSc1ccc(cn1)OC(C)C 62a_100000053229_100012354243 [0,0,0,0,0,1|2,0,1]=4 1335 B16R1.1287 CC(=O)CCSc1ccc(cn1)OC(C)C 62a_100012354243_100000053229 [0,0,0,0,0,1|2,0,1]=4 1336 B16R1.1287 CC(=O)CCSc1ccc(nc1)CC(=O)N 62a_100000053229_200010888337 [0,0,0,0,0,1|3,0,0]=4 1337 B16R1.1287 CC(=O)CCSc1ccc(nc1)CC(=O)N 62a_200010888337_100000053229 [0,0,0,0,0,1|3,0,0]=4 1338 B16R1.1287 CC(=O)CCSc1ccc(nc1)NC(=O)C 62a_100000053229_100000193312 [0,0,0,0,0,1|2,0,0]=3 1339 B16R1.1287 CC(=O)CCSc1ccc(nc1)OC(C)C 62a_100000053229_100000688564 [0,0,0,0,0,1|2,0,1]=4 1340 B16R1.1287 CC(=O)CCSc1ccc(nc1)OC(C)C 62a_100000688564_100000053229 [0,0,0,0,0,1|2,0,1]=4 1341 B16R1.1287 CC(=O)CCSc1ccc(nn1)NC(=O)C 62a_100000053229_100011804224 [0,0,0,0,0,1|3,0,0]=4 1342 B16R1.1287 CC(=O)CCSc1cnc(nc1)NC(=O)C 62a_100000053229_100010141023 [0,0,0,0,0,1|3,0,0]=4 1343 B16R1.1287 CC(=O)CCSc1cnc(nc1)NC(=O)C 62a_100010141023_100000053229 [0,0,0,0,0,1|3,0,0]=4 1344 B16R1.1287 CC(=O)CCSc1ncc(cn1)NC(=O)C 62a_100000053229_200010565192 [0,0,0,0,0,1|3,0,0]=4 1345 B16R1.1287 CC(=O)COCc1ccc(cc1)CC(C)C 34a_100000211253_100011982790 [0,0,0,0,0,1|2,0,1]=4 1346 B16R1.1287 CC(=O)COCc1ccc(cc1)NC(=O)C 34a_100000211253_100000731167 [0,0,0,0,0,1|1,0,0]=2 1347 B16R1.1287 CC(=O)COCc1ccc(cc1)OC(F)F 34a_100000211253_100011217905 [0,0,0,0,0,1|2,0,1]=4 1348 B16R1.1287 CC(=O)Cc1ccc(cc1)OCC=C(C)C 34a_100011218180_100000761012 [0,0,0,0,0,1|2,0,1]=4 1349 B16R1.1287 CC(=O)Cc1ccc(cc1)OCC=C(C)C 7a_100011218180_100000761012 [0,0,0,0,0,1|2,0,1]=4 1350 B16R1.1287 CC(=O)Cc1ccc(cc1)OCCC(=O)N 34a_100011218180_100000731001 [0,0,0,0,0,1|2,0,0]=3 1351 B16R1.1287 CC(=O)Cc1ccc(cc1)OCCC(=O)N 7a_100011218180_100000744528 [0,0,0,0,0,1|2,0,0]=3 1352 B16R1.1287 CC(=O)Cc1ccc(cc1)OCCC(C)C 34a_100011218180_100000210312 [0,0,0,0,0,1|2,0,1]=4 1353 B16R1.1287 CC(=O)Cc1ccc(cc1)OCCC(C)C 7a_100011218180_100000210626 [0,0,0,0,0,1|2,0,1]=4 1354 B16R1.1287 CC(=O)Cc1ccc(cc1)OCCC(C)O 34a_100011218180_100012276601 [0,0,0,0,0,1|1,0,2]=4 1355 B16R1.1287 CC(=O)Cc1ccc(cc1)OCCC(C)O 7a_100011218180_100012276601 [0,0,0,0,0,1|1,0,2]=4 1356 B16R1.1287 CC(=O)Cc1ccc(cc1)OCCN(C)C 7a_100011218180_100000755713 [0,0,0,0,0,1|3,0,0]=4 1357 B16R1.1287 CC(=O)Cc1ccc(cc1)OCOC(=O)C 34a_100011218180_100009813279 [0,0,0,0,0,1|2,0,0]=3 1358 B16R1.1287 CC(=O)Cc1ccc(cc1)SCC=C(C)C 62a_100000691760_100000761012 [0,0,0,0,0,1|2,0,1]=4 1359 B16R1.1287 CC(=O)Cc1ccc(cc1)SCC=C(C)C 62a_100000761012_100000691760 [0,0,0,0,0,1|2,0,1]=4 1360 B16R1.1287 CC(=O)Cc1ccc(cc1)SCCC(=O)N 62a_100000691760_100000744528 [0,0,0,0,0,1|2,0,0]=3 1361 B16R1.1287 CC(=O)Cc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000691760 [0,0,0,0,0,1|2,0,0]=3 1362 B16R1.1287 CC(=O)Cc1ccc(cc1)SCCC(C)C 62a_100000210312_100000691760 [0,0,0,0,0,1|2,0,1]=4 1363 B16R1.1287 CC(=O)Cc1ccc(cc1)SCCC(C)C 62a_100000691760_100000210312 [0,0,0,0,0,1|2,0,1]=4 1364 B16R1.1287 CC(=O)Cc1ccc(cc1)SCCC(C)O 62a_100000691760_100012276601 [0,0,0,0,0,1|1,0,2]=4 1365 B16R1.1287 CC(=O)Cc1ccc(cc1)SCCC(C)O 62a_100012276601_100000691760 [0,0,0,0,0,1|1,0,2]=4 1366 B16R1.1287 CC(=O)Cc1ccc(cc1)SCCN(C)C 62a_100000691760_100000755713 [0,0,0,0,0,1|3,0,0]=4 1367 B16R1.1287 CC(=O)Cc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000691760 [0,0,0,0,0,1|2,0,0]=3 1368 B16R1.1287 CC(=O)Cc1ccc(cc1)SCOC(=O)C 62a_100000691760_100000076356 [0,0,0,0,0,1|2,0,0]=3 1369 B16R1.1287 CC(=O)NCCc1ccc(cc1)OC(C)C 11a_100015183000_100015343762 [0,0,0,0,0,1|1,0,1]=3 1370 B16R1.1287 CC(=O)NCCc1ccc(cc1)OC(C)C 1626a_100015183000_100015343762 [0,0,0,0,0,1|1,0,1]=3 1371 B16R1.1287 CC(=O)NCCc1ccc(cc1)OC(C)C 240690a_100015183000_100015343762 [0,0,0,0,0,1|1,0,1]=3 1372 B16R1.1287 CC(=O)NCCc1ccc(cc1)OC(C)C 34a_100011395907_100000210206 [0,0,0,0,0,1|1,0,1]=3 1373 B16R1.1287 CC(=O)NCCc1ccc(cc1)OC(C)C 527a_100015183000_100103153847 [0,0,0,0,0,1|1,0,1]=3 1374 B16R1.1287 CC(=O)NCCc1ccc(cc1)OC(C)C 7a_100011395907_100000210206 [0,0,0,0,0,1|1,0,1]=3 1375 B16R1.1287 CC(=O)NN=Cc1ccc(cc1)NC(=O)C 4a_100000189765_100000210072 [0,0,0,0,0,1|2,0,1]=4 1376 B16R1.1287 CC(=O)Nc1ccc(cc1)CCCN(C)C 11a_100011216278_100015343762 [0,0,0,0,0,1|3,0,0]=4 1377 B16R1.1287 CC(=O)Nc1ccc(cc1)CCCN(C)C 22a_100011216278_100000070787 [0,0,0,0,0,1|3,0,0]=4 1378 B16R1.1287 CC(=O)Nc1ccc(cc1)CCOC(C)C 34a_100000752260_100000210206 [0,0,0,0,0,1|2,0,1]=4 1379 B16R1.1287 CC(=O)Nc1ccc(cc1)CCOC(C)C 7a_100000752260_100000210206 [0,0,0,0,0,1|2,0,1]=4 1380 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(=O)N 2230a_100000711301_100000731167 [0,0,0,0,0,1|2,0,0]=3 1381 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(=O)N 34a_100000735448_100000187820 [0,0,0,0,0,1|2,0,0]=3 1382 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000731167 [0,0,0,0,0,1|2,0,0]=3 1383 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(=O)[O-] 34a_100000735448_100020667443 [0,0,0,0,0,1|2,0,0]=3 1384 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)C 207a_100000210953_100000210072 [0,0,0,0,0,1|2,0,1]=4 1385 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)C 2230a_100000210953_100000731167 [0,0,0,0,0,1|2,0,1]=4 1386 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)C 270004a_100000735448_100000210432 [0,0,0,0,0,1|2,0,1]=4 1387 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)C 34a_100000210953_100000731167 [0,0,0,0,0,1|2,0,1]=4 1388 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)C 34a_100000735448_100000210624 [0,0,0,0,0,1|2,0,1]=4 1389 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)O 207a_100000210904_100000210072 [0,0,0,0,0,1|1,0,2]=4 1390 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)O 2230a_100000210904_100000731167 [0,0,0,0,0,1|1,0,2]=4 1391 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)O 34a_100000210904_100000731167 [0,0,0,0,0,1|1,0,2]=4 1392 B16R1.1287 CC(=O)Nc1ccc(cc1)CNCC(C)O 34a_100000735448_100011218427 [0,0,0,0,0,1|1,0,2]=4 1393 B16R1.1287 CC(=O)Nc1ccc(cc1)CNC[C@@H](C)O 34a_100000735448_100009817552 [0,0,0,0,0,1|1,0,2]=4 1394 B16R1.1287 CC(=O)Nc1ccc(cc1)CNC[N+](=O)[O-] 34a_100000735448_100000761209 [0,0,0,0,0,1|3,0,0]=4 1395 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(=O)N 34a_100000246270_100000187820 [0,0,0,0,0,1|2,0,0]=3 1396 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(=O)N 7a_100000246270_100000187820 [0,0,0,0,0,1|2,0,0]=3 1397 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(=O)[O-] 34a_100000246270_100020667443 [0,0,0,0,0,1|2,0,0]=3 1398 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(C)Br 34a_100012180447_100000731167 [0,0,0,0,0,1|2,0,1]=4 1399 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(C)C 34a_100000210257_100000731167 [0,0,0,0,0,1|2,0,1]=4 1400 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(C)C 34a_100000246270_100000210624 [0,0,0,0,0,1|2,0,1]=4 1401 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(C)C 7a_100000246270_100000210760 [0,0,0,0,0,1|2,0,1]=4 1402 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(C)F 34a_100015925927_100000731167 [0,0,0,0,0,1|2,0,1]=4 1403 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(C)O 34a_100000246270_100011218427 [0,0,0,0,0,1|1,0,2]=4 1404 B16R1.1287 CC(=O)Nc1ccc(cc1)COCC(C)O 7a_100000246270_100011218427 [0,0,0,0,0,1|1,0,2]=4 1405 B16R1.1287 CC(=O)Nc1ccc(cc1)COC[C@@H](C)Cl 34a_100016084084_100000731167 [0,0,0,0,0,1|2,0,1]=4 1406 B16R1.1287 CC(=O)Nc1ccc(cc1)COC[C@@H](C)N 34a_100000737577_100000731167 [0,0,0,0,0,1|2,0,1]=4 1407 B16R1.1287 CC(=O)Nc1ccc(cc1)COC[C@@H](C)O 34a_100000246270_100009817552 [0,0,0,0,0,1|1,0,2]=4 1408 B16R1.1287 CC(=O)Nc1ccc(cc1)COC[C@@H](C)O 7a_100000246270_100009817552 [0,0,0,0,0,1|1,0,2]=4 1409 B16R1.1287 CC(=O)Nc1ccc(cc1)COC[N+](=O)[O-] 34a_100000246270_100000761209 [0,0,0,0,0,1|3,0,0]=4 1410 B16R1.1287 CC(=O)Nc1ccc(cc1)CSCC(=O)N 62a_100000747473_100000731167 [0,0,0,0,0,1|2,0,0]=3 1411 B16R1.1287 CC(=O)Nc1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100000731167 [0,0,0,0,0,1|2,0,0]=3 1412 B16R1.1287 CC(=O)Nc1ccc(cc1)CSCC(C)C 62a_100000210624_100000731167 [0,0,0,0,0,1|2,0,1]=4 1413 B16R1.1287 CC(=O)Nc1ccc(cc1)CSCC(C)O 62a_100011218427_100000731167 [0,0,0,0,0,1|1,0,2]=4 1414 B16R1.1287 CC(=O)Nc1ccc(cc1)CSC[C@@H](C)O 62a_100009817552_100000731167 [0,0,0,0,0,1|1,0,2]=4 1415 B16R1.1287 CC(=O)Nc1ccc(cc1)NCC=C(C)C 34a_100000184111_100000761012 [0,0,0,0,0,1|2,0,1]=4 1416 B16R1.1287 CC(=O)Nc1ccc(cc1)NCCC(=O)N 34a_100000184111_100000731001 [0,0,0,0,0,1|2,0,0]=3 1417 B16R1.1287 CC(=O)Nc1ccc(cc1)NCCC(C)C 34a_100000184111_100000210312 [0,0,0,0,0,1|2,0,1]=4 1418 B16R1.1287 CC(=O)Nc1ccc(cc1)NCCC(C)O 34a_100000184111_100012276601 [0,0,0,0,0,1|1,0,2]=4 1419 B16R1.1287 CC(=O)Nc1ccc(cc1)NCOC(=O)C 34a_100000184111_100009813279 [0,0,0,0,0,1|2,0,0]=3 1420 B16R1.1287 CC(=O)Nc1ccc(cc1)OCC=C(C)C 34a_100000184395_100000761012 [0,0,0,0,0,1|2,0,1]=4 1421 B16R1.1287 CC(=O)Nc1ccc(cc1)OCC=C(C)C 7a_100000184395_100000761012 [0,0,0,0,0,1|2,0,1]=4 1422 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCC(=O)N 34a_100000184395_100000731001 [0,0,0,0,0,1|2,0,0]=3 1423 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCC(=O)N 7a_100000184395_100000744528 [0,0,0,0,0,1|2,0,0]=3 1424 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCC(C)C 34a_100000184395_100000210312 [0,0,0,0,0,1|2,0,1]=4 1425 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCC(C)C 7a_100000184395_100000210626 [0,0,0,0,0,1|2,0,1]=4 1426 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCC(C)O 34a_100000184395_100012276601 [0,0,0,0,0,1|1,0,2]=4 1427 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCC(C)O 7a_100000184395_100012276601 [0,0,0,0,0,1|1,0,2]=4 1428 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCN(C)C 11a_100000741564_100015343762 [0,0,0,0,0,1|3,0,0]=4 1429 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCN(C)C 22a_100000741564_100000070787 [0,0,0,0,0,1|3,0,0]=4 1430 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCN(C)C 527a_100000741564_100103153847 [0,0,0,0,0,1|3,0,0]=4 1431 B16R1.1287 CC(=O)Nc1ccc(cc1)OCCN(C)C 7a_100000184395_100000755713 [0,0,0,0,0,1|3,0,0]=4 1432 B16R1.1287 CC(=O)Nc1ccc(cc1)OCOC(=O)C 34a_100000184395_100009813279 [0,0,0,0,0,1|2,0,0]=3 1433 B16R1.1287 CC(=O)Nc1ccc(cc1)SCC=C(C)C 62a_100000761012_100000155215 [0,0,0,0,0,1|2,0,1]=4 1434 B16R1.1287 CC(=O)Nc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000155215 [0,0,0,0,0,1|2,0,0]=3 1435 B16R1.1287 CC(=O)Nc1ccc(cc1)SCCC(C)C 62a_100000210312_100000155215 [0,0,0,0,0,1|2,0,1]=4 1436 B16R1.1287 CC(=O)Nc1ccc(cc1)SCCC(C)O 62a_100012276601_100000155215 [0,0,0,0,0,1|1,0,2]=4 1437 B16R1.1287 CC(=O)Nc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000155215 [0,0,0,0,0,1|2,0,0]=3 1438 B16R1.1287 CC(=O)Nc1ccc(cn1)OCCC(=O)N 34a_200000094647_100000731001 [0,0,0,0,0,1|3,0,0]=4 1439 B16R1.1287 CC(=O)Nc1ccc(cn1)OCCC(=O)N 7a_200000094647_100000744528 [0,0,0,0,0,1|3,0,0]=4 1440 B16R1.1287 CC(=O)Nc1ccc(cn1)OCOC(=O)C 34a_200000094647_100009813279 [0,0,0,0,0,1|3,0,0]=4 1441 B16R1.1287 CC(=O)Nc1ccc(cn1)SCCC(=O)N 62a_100000744528_100000193312 [0,0,0,0,0,1|3,0,0]=4 1442 B16R1.1287 CC(=O)Nc1ccc(cn1)SCOC(=O)C 62a_100000076356_100000193312 [0,0,0,0,0,1|3,0,0]=4 1443 B16R1.1287 CC(=O)Nc1ccc(nc1)SCCC(=O)N 62a_100000744528_100011934715 [0,0,0,0,0,1|3,0,0]=4 1444 B16R1.1287 CC(=O)Nc1ccc(nc1)SCOC(=O)C 62a_100000076356_100011934715 [0,0,0,0,0,1|3,0,0]=4 1445 B16R1.1287 CC(=O)OCCc1ccc(cc1)C=C(C)C 271570a_100102525489_200016374084 [0,0,0,0,0,1|2,0,0]=3 1446 B16R1.1287 CC(=O)OCCc1ccc(cc1)SC(C)C 62a_100000210206_200016374084 [0,0,0,0,0,1|1,1,1]=4 1447 B16R1.1287 CC(=O)OCCc1ccc(cc1)SC(C)C 62a_200016374084_100000210206 [0,0,0,0,0,1|1,1,1]=4 1448 B16R1.1287 CC(=O)OCNc1ccc(cc1)CC(=O)N 34a_100000738315_100009813279 [0,0,0,0,0,1|3,0,0]=4 1449 B16R1.1287 CC(=O)OCNc1ccc(cc1)OC(C)C 34a_100011194259_100009813279 [0,0,0,0,0,1|2,0,1]=4 1450 B16R1.1287 CC(=O)OCOc1ccc(cc1)CC(=O)N 34a_100000020825_100009813279 [0,0,0,0,0,1|3,0,0]=4 1451 B16R1.1287 CC(=O)OCOc1ccc(cc1)OC(C)C 34a_100000757185_100009813279 [0,0,0,0,0,1|2,0,1]=4 1452 B16R1.1287 CC(=O)OCSc1ccc(cc1)CC(=O)N 62a_100000076356_100000162331 [0,0,0,0,0,1|3,0,0]=4 1453 B16R1.1287 CC(=O)OCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000076356 [0,0,0,0,0,1|3,0,0]=4 1454 B16R1.1287 CC(=O)OCSc1ccc(cc1)NC(=O)N 62a_100000076356_100000198584 [0,0,0,0,0,1|3,0,0]=4 1455 B16R1.1287 CC(=O)OCSc1ccc(cc1)OC(=O)C 62a_100000076356_100000002173 [0,0,0,0,0,1|1,0,0]=2 1456 B16R1.1287 CC(=O)OCSc1ccc(cc1)OC(=S)C 62a_100000076356_200009816735 [0,0,0,0,0,1|1,1,0]=3 1457 B16R1.1287 CC(=O)OCSc1ccc(cc1)OC(C)C 62a_100000076356_100000169947 [0,0,0,0,0,1|2,0,1]=4 1458 B16R1.1287 CC(=O)OCSc1ccc(cc1)OC(C)C 62a_100000169947_100000076356 [0,0,0,0,0,1|2,0,1]=4 1459 B16R1.1287 CC(=O)OCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000076356 [0,0,0,0,0,1|1,1,0]=3 1460 B16R1.1287 CC(=O)Oc1ccc(cc1)C=CCC(C)C 271570a_100016259101_100000002173 [0,0,0,0,0,1|1,0,2]=4 1461 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(=O)N 2230a_100000711301_100000033664 [0,0,0,0,0,1|1,0,0]=2 1462 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000033664 [0,0,0,0,0,1|1,0,0]=2 1463 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(C)C 207a_100000210953_100000014718 [0,0,0,0,0,1|1,0,1]=3 1464 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(C)C 2230a_100000210953_100000033664 [0,0,0,0,0,1|1,0,1]=3 1465 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(C)C 270004a_100000210953_100000014718 [0,0,0,0,0,1|1,0,1]=3 1466 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(C)O 207a_100000210904_100000014718 [0,0,0,0,0,1|0,0,2]=3 1467 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(C)O 2230a_100000210904_100000033664 [0,0,0,0,0,1|0,0,2]=3 1468 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(C)O 270004a_100000210904_100000014718 [0,0,0,0,0,1|0,0,2]=3 1469 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(F)F 207a_100000765723_100000014718 [0,0,0,0,0,1|2,0,1]=4 1470 B16R1.1287 CC(=O)Oc1ccc(cc1)CNCC(F)F 270004a_100000765723_100000014718 [0,0,0,0,0,1|2,0,1]=4 1471 B16R1.1287 CC(=O)Oc1ccc(cc1)CSCC(=O)N 62a_100000747473_100000033664 [0,0,0,0,0,1|1,0,0]=2 1472 B16R1.1287 CC(=O)Oc1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100000033664 [0,0,0,0,0,1|1,0,0]=2 1473 B16R1.1287 CC(=O)Oc1ccc(cc1)CSCC(C)C 62a_100000210624_100000033664 [0,0,0,0,0,1|1,0,1]=3 1474 B16R1.1287 CC(=O)Oc1ccc(cc1)CSCC(C)O 62a_100011218427_100000033664 [0,0,0,0,0,1|0,0,2]=3 1475 B16R1.1287 CC(=O)Oc1ccc(cc1)CSCC(F)F 62a_100011934356_100000033664 [0,0,0,0,0,1|2,0,1]=4 1476 B16R1.1287 CC(=O)Oc1ccc(cc1)CSC[C@@H](C)O 62a_100009817552_100000033664 [0,0,0,0,0,1|0,0,2]=3 1477 B16R1.1287 CC(=O)Oc1ccc(cc1)SCC=C(C)C 62a_100000761012_100000002173 [0,0,0,0,0,1|1,0,1]=3 1478 B16R1.1287 CC(=O)Oc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000002173 [0,0,0,0,0,1|1,0,0]=2 1479 B16R1.1287 CC(=O)Oc1ccc(cc1)SCCC(C)C 62a_100000210312_100000002173 [0,0,0,0,0,1|1,0,1]=3 1480 B16R1.1287 CC(=O)Oc1ccc(cc1)SCCC(C)O 62a_100012276601_100000002173 [0,0,0,0,0,1|0,0,2]=3 1481 B16R1.1287 CC(=O)Oc1ccc(cc1)SCOC(C)C 62a_100000709892_100000002173 [0,0,0,0,0,1|2,0,1]=4 1482 B16R1.1287 CC(=O)Sc1ccc(cc1)SCC=C(C)C 62a_200009995050_100000761012 [0,0,0,0,0,1|1,1,1]=4 1483 B16R1.1287 CC(=O)Sc1ccc(cc1)SCCC(=O)N 62a_200009995050_100000744528 [0,0,0,0,0,1|1,1,0]=3 1484 B16R1.1287 CC(=O)Sc1ccc(cc1)SCCC(C)C 62a_200009995050_100000210312 [0,0,0,0,0,1|1,1,1]=4 1485 B16R1.1287 CC(=O)Sc1ccc(cc1)SCCC(C)O 62a_200009995050_100012276601 [0,0,0,0,0,1|0,1,2]=4 1486 B16R1.1287 CC(=O)Sc1ccc(cc1)SCCN(C)C 62a_200009995050_100000755713 [0,0,0,0,0,1|2,1,0]=4 1487 B16R1.1287 CC(=S)Oc1ccc(cc1)SCC=C(C)C 62a_100000761012_200009816735 [0,0,0,0,0,1|1,1,1]=4 1488 B16R1.1287 CC(=S)Oc1ccc(cc1)SCCC(=O)N 62a_100000744528_200009816735 [0,0,0,0,0,1|1,1,0]=3 1489 B16R1.1287 CC(=S)Oc1ccc(cc1)SCCC(C)C 62a_100000210312_200009816735 [0,0,0,0,0,1|1,1,1]=4 1490 B16R1.1287 CC(=S)Oc1ccc(cc1)SCCC(C)O 62a_100012276601_200009816735 [0,0,0,0,0,1|0,1,2]=4 1491 B16R1.1287 CC(C)Cc1ccc(cc1)CCCC(=O)[13CH3] 1458a_200000692872_200025704644 [0,0,0,0,0,1|2,0,1]=4 1492 B16R1.1287 CC(C)Oc1ccc(cc1)CNCC(=O)N 2230a_100020586559_100000747473 [0,0,0,0,0,1|2,0,1]=4 1493 B16R1.1287 CC(C)Oc1ccc(cc1)CNCC(=O)N 34a_100020586559_100000187820 [0,0,0,0,0,1|2,0,1]=4 1494 B16R1.1287 CC(C)Oc1ccc(cc1)CNCC(=O)[O-] 34a_100020586559_100020667443 [0,0,0,0,0,1|2,0,1]=4 1495 B16R1.1287 CC(C)Oc1ccc(cc1)COCC(=O)N 34a_100000173089_100000187820 [0,0,0,0,0,1|2,0,1]=4 1496 B16R1.1287 CC(C)Oc1ccc(cc1)COCC(=O)N 7a_100000173089_100000187820 [0,0,0,0,0,1|2,0,1]=4 1497 B16R1.1287 CC(C)Oc1ccc(cc1)COCC(=O)[O-] 34a_100000173089_100020667443 [0,0,0,0,0,1|2,0,1]=4 1498 B16R1.1287 CC(C)Oc1ccc(cc1)NCCC(=O)N 2230a_100011194259_100000744528 [0,0,0,0,0,1|2,0,1]=4 1499 B16R1.1287 CC(C)Oc1ccc(cc1)NCCC(=O)N 34a_100011194259_100000731001 [0,0,0,0,0,1|2,0,1]=4 1500 B16R1.1287 CC(C)Oc1ccc(cc1)OCCC(=O)N 34a_100000757185_100000731001 [0,0,0,0,0,1|2,0,1]=4 1501 B16R1.1287 CC(C)Oc1ccc(cc1)OCCC(=O)N 7a_100000757185_100000744528 [0,0,0,0,0,1|2,0,1]=4 1502 B16R1.1287 CC(C)Oc1ccc(cc1)SCCC(=O)N 62a_100000169947_100000744528 [0,0,0,0,0,1|2,0,1]=4 1503 B16R1.1287 CC(C)Oc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000169947 [0,0,0,0,0,1|2,0,1]=4 1504 B16R1.1287 NC(=O)CCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000744528 [0,0,0,0,0,1|3,0,0]=4 1505 B16R1.1287 NC(=O)CCNc1ccc(cc1)CC(=O)N 34a_100000738315_100000731001 [0,0,0,0,0,1|3,0,0]=4 1506 B16R1.1287 NC(=O)CCOc1ccc(cc1)CC(=O)N 34a_100000020825_100000731001 [0,0,0,0,0,1|3,0,0]=4 1507 B16R1.1287 NC(=O)CCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000744528 [0,0,0,0,0,1|3,0,0]=4 1508 B16R1.1287 NC(=O)CCSc1ccc(cc1)CC(=O)N 62a_100000744528_100000162331 [0,0,0,0,0,1|3,0,0]=4 1509 B16R1.1287 NC(=O)CCSc1ccc(cc1)NC(=O)N 62a_100000744528_100000198584 [0,0,0,0,0,1|3,0,0]=4 1510 B16R1.1287 NC(=O)CNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100000187820 [0,0,0,0,0,1|3,0,0]=4 1511 B16R1.1287 O=C([O-])CNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100020667443 [0,0,0,0,0,1|3,0,0]=4 1512 B13R1.77 C/C=C/c1ccc(cc1)CCCC 271570a_100020621405_100016259036 [2,0,0,0,0,0|1,0,1]=4 1513 B13R1.77 C/C=C/c1ccc(cc1)SCC=O 62a_100016259036_200015260668 [2,0,0,0,0,0|2,0,0]=4 1514 B13R1.77 C/C=C/c1ccc(cc1)SCC=O 62a_200015260668_100016259036 [2,0,0,0,0,0|2,0,0]=4 1515 B13R1.77 C=COc1ccc(cc1)SCC=O 62a_100000704263_200015260668 [2,0,0,0,0,0|1,0,1]=4 1516 B13R1.77 C=COc1ccc(cc1)SCC=O 62a_200015260668_100000704263 [2,0,0,0,0,0|1,0,1]=4 1517 B13R1.77 CC=Cc1ccc(cc1)CCC=O 271570a_100016259895_100011361538 [2,0,0,0,0,0|1,0,0]=3 1518 B13R1.77 CC=Cc1ccc(cc1)CCCC 271570a_100016259895_100011215597 [2,0,0,0,0,0|1,0,1]=4 1519 B13R1.77 CC=Cc1ccc(cc1)CCNC 271570a_100016259895_100000752880 [2,0,0,0,0,0|2,0,0]=4 1520 B13R1.77 CC=Cc1ccc(cc1)CCOC 271570a_100016259895_100000739703 [2,0,0,0,0,0|2,0,0]=4 1521 B13R1.77 CCCCc1ccc(cc1)CC=O 271570a_100020621405_100011361690 [2,0,0,0,0,0|1,0,1]=4 1522 B13R1.77 CCCCc1ccc(cc1)OCC 271570a_100020621405_100000169946 [2,0,0,0,0,0|0,0,2]=4 1523 B13R1.77 CCCCc1ccc(cc1)OCC 34a_100011216022_100000210202 [2,0,0,0,0,0|0,0,2]=4 1524 B13R1.77 CCCCc1ccc(cc1)OCC 7a_100011216022_100000210202 [2,0,0,0,0,0|0,0,2]=4 1525 B13R1.77 CCOc1ccc(cc1)CCNC 2230a_100011194255_200000210301 [2,0,0,0,0,0|1,0,1]=4 1526 B13R1.77 CCOc1ccc(cc1)CCNC 34a_100011194255_200000210301 [2,0,0,0,0,0|1,0,1]=4 1527 B13R1.77 CCOc1ccc(cc1)CCNC 34a_100016989440_100000210202 [2,0,0,0,0,0|1,0,1]=4 1528 B13R1.77 CCOc1ccc(cc1)CCN[13CH3] 2230a_100011194255_200025704644 [2,0,0,0,0,0|1,0,1]=4 1529 B13R1.77 CCOc1ccc(cc1)CCN[13CH3] 34a_100011194255_200025704644 [2,0,0,0,0,0|1,0,1]=4 1530 B13R1.77 CCOc1ccc(cc1)CCOC 34a_100000211638_100000210202 [2,0,0,0,0,0|1,0,1]=4 1531 B13R1.77 CCOc1ccc(cc1)CCOC 34a_100011217992_200000210301 [2,0,0,0,0,0|1,0,1]=4 1532 B13R1.77 CCOc1ccc(cc1)CCOC 7a_100000211638_100000210202 [2,0,0,0,0,0|1,0,1]=4 1533 B13R1.77 CCOc1ccc(cc1)CCOC 7a_100011217992_200000210301 [2,0,0,0,0,0|1,0,1]=4 1534 B13R1.77 CCOc1ccc(cc1)CCO[13CH3] 34a_100011217992_200025704644 [2,0,0,0,0,0|1,0,1]=4 1535 B13R1.77 CCOc1ccc(cc1)CCO[13CH3] 7a_100011217992_200025704644 [2,0,0,0,0,0|1,0,1]=4 1536 B13R1.77 CCOc1ccc(cc1)NCC=O 2230a_100000739623_200015260668 [2,0,0,0,0,0|1,0,1]=4 1537 B13R1.77 CCOc1ccc(cc1)NCC=O 34a_100000739623_200009817547 [2,0,0,0,0,0|1,0,1]=4 1538 B13R1.77 CCOc1ccc(cc1)OCC=O 34a_100000185467_200009817547 [2,0,0,0,0,0|1,0,1]=4 1539 B13R1.77 CCOc1ccc(cc1)SCC=O 62a_200015260668_100000171712 [2,0,0,0,0,0|1,0,1]=4 1540 B13R1.77 CCSc1ccc(cc1)CCC=O 62a_100000210202_100011361538 [2,0,0,0,0,0|0,1,1]=4 1541 B13R1.77 CCSc1ccc(cc1)CCC=O 62a_100011361538_100000210202 [2,0,0,0,0,0|0,1,1]=4 1542 B13R1.77 O=CCSc1ccc(cc1)CC=O 62a_100011361690_200015260668 [2,0,0,0,0,0|2,0,0]=4 1543 B13R1.77 O=CCSc1ccc(cc1)CC=O 62a_200015260668_100011361690 [2,0,0,0,0,0|2,0,0]=4 1544 B13R1.142 C=C=Cc1ccc(cc1)OC(=O)C 271570a_100015277604_100000002173 [2,0,0,0,0,0|0,0,2]=4 1545 B13R1.142 CC(=Cc1ccc(cc1)CC=O)C 271570a_100102525489_100011361690 [2,0,0,0,0,0|2,0,0]=4 1546 B13R1.142 CC(=O)Nc1ccc(cc1)CCO 22a_100011204434_100000070787 [2,0,0,0,0,0|1,0,1]=4 1547 B13R1.142 CC(=O)Nc1ccc(cc1)CCO 527a_100011204434_100103153847 [2,0,0,0,0,0|1,0,1]=4 1548 B13R1.142 CC(=O)Nc1ccc(cc1)CN[13CH3] 34a_100000735448_200025704644 [2,0,0,0,0,0|2,0,0]=4 1549 B13R1.142 CC(=O)Nc1ccc(cc1)CO[13CH3] 34a_100000246270_200025704644 [2,0,0,0,0,0|2,0,0]=4 1550 B13R1.142 CC(=O)Nc1ccc(cc1)CO[13CH3] 7a_100000246270_200025704644 [2,0,0,0,0,0|2,0,0]=4 1551 B13R1.142 CC(=O)Nc1ccc(cc1)CS[13CH3] 62a_200025704644_100000731167 [2,0,0,0,0,0|2,0,0]=4 1552 B13R1.142 CC(=O)Oc1ccc(cc1)CS[13CH3] 62a_200025704644_100000033664 [2,0,0,0,0,0|1,0,0]=3 1553 B13R1.142 CC(=O)Oc1ccc(cc1)SCF 62a_100015361967_100000002173 [2,0,0,0,0,0|2,0,0]=4 1554 B13R1.142 CC=Cc1ccc(cc1)CC(=O)C 271570a_100016259895_100000691760 [2,0,0,0,0,0|1,0,1]=4 1555 B13R1.142 CC=Cc1ccc(cc1)NC(=O)C 271570a_100016259895_100000155215 [2,0,0,0,0,0|1,0,1]=4 1556 B13R1.142 CC=Cc1ccc(cc1)OC(=O)C 271570a_100016259895_100000002173 [2,0,0,0,0,0|0,0,1]=3 1557 B13R1.142 CC=Cc1ccc(cc1)OC(=S)C 271570a_100016259895_200009816735 [2,0,0,0,0,0|0,1,1]=4 1558 B13R1.142 CC=Cc1ccc(cc1)SC(=O)C 271570a_100016259895_200009995050 [2,0,0,0,0,0|0,1,1]=4 1559 B13R1.142 CCCc1ccc(cc1)C=C(C)C 271570a_100102525489_100000750032 [2,0,0,0,0,0|2,0,0]=4 1560 B13R1.142 CCCc1ccc(cc1)CC(=O)C 1458a_100000070787_100011982809 [2,0,0,0,0,0|1,0,0]=3 1561 B13R1.142 CCCc1ccc(cc1)CC(=O)C 1458a_100000186164_200000210301 [2,0,0,0,0,0|1,0,0]=3 1562 B13R1.142 CCCc1ccc(cc1)CC(=O)[13CH3] 1458a_100000186164_200025704644 [2,0,0,0,0,0|1,0,0]=3 1563 B13R1.142 CCCc1ccc(cc1)NC(=O)C 11a_100000211780_100015343762 [2,0,0,0,0,0|1,0,0]=3 1564 B13R1.142 CCCc1ccc(cc1)NC(=O)C 1626a_100000211780_100015343762 [2,0,0,0,0,0|1,0,0]=3 1565 B13R1.142 CCCc1ccc(cc1)NC(=O)C 22a_100000211780_100000070787 [2,0,0,0,0,0|1,0,0]=3 1566 B13R1.142 CCCc1ccc(cc1)NC(=O)C 527a_100000211780_100103153847 [2,0,0,0,0,0|1,0,0]=3 1567 B13R1.142 CCCc1ccc(cc1)OC(C)C 34a_100000749406_100000210206 [2,0,0,0,0,0|1,0,1]=4 1568 B13R1.142 CCCc1ccc(cc1)OC(C)C 7a_100000749406_100000210206 [2,0,0,0,0,0|1,0,1]=4 1569 B13R1.142 CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000210202 [2,0,0,0,0,0|2,0,0]=4 1570 B13R1.142 CCOc1ccc(cc1)CC(=O)C 1458a_100000183096_200000210301 [2,0,0,0,0,0|2,0,0]=4 1571 B13R1.142 CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000210202 [2,0,0,0,0,0|2,0,0]=4 1572 B13R1.142 CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000210202 [2,0,0,0,0,0|2,0,0]=4 1573 B13R1.142 CCOc1ccc(cc1)CC(=O)[13CH3] 1458a_100000183096_200025704644 [2,0,0,0,0,0|2,0,0]=4 1574 B13R1.142 CCOc1ccc(cc1)NC(=O)C 11a_100000739623_100015343762 [2,0,0,0,0,0|2,0,0]=4 1575 B13R1.142 CCOc1ccc(cc1)NC(=O)C 1626a_100000739623_100015343762 [2,0,0,0,0,0|2,0,0]=4 1576 B13R1.142 CCOc1ccc(cc1)NC(=O)C 22a_100000739623_100000070787 [2,0,0,0,0,0|2,0,0]=4 1577 B13R1.142 CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000210202 [2,0,0,0,0,0|2,0,0]=4 1578 B13R1.142 CCOc1ccc(cc1)NC(=O)C 527a_100000739623_100103153847 [2,0,0,0,0,0|2,0,0]=4 1579 B13R1.142 CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000210202 [2,0,0,0,0,0|2,0,0]=4 1580 B13R1.142 CCSc1ccc(cc1)CC(=O)C 62a_100000210202_100000691760 [2,0,0,0,0,0|2,0,0]=4 1581 B13R1.142 CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000210202 [2,0,0,0,0,0|2,0,0]=4 1582 B13R1.142 CCSc1ccc(cc1)NC(=O)C 11a_100015187087_100015343762 [2,0,0,0,0,0|2,0,0]=4 1583 B13R1.142 CCSc1ccc(cc1)NC(=O)C 1626a_100015187087_100015343762 [2,0,0,0,0,0|2,0,0]=4 1584 B13R1.142 CCSc1ccc(cc1)NC(=O)C 22a_100015187087_100000070787 [2,0,0,0,0,0|2,0,0]=4 1585 B13R1.142 CCSc1ccc(cc1)NC(=O)C 527a_100015187087_100103153847 [2,0,0,0,0,0|2,0,0]=4 1586 B13R1.142 CCSc1ccc(cc1)NC(=O)C 62a_100000210202_100000155215 [2,0,0,0,0,0|2,0,0]=4 1587 B13R1.142 CCSc1ccc(cc1)OC(=O)C 62a_100000210202_100000002173 [2,0,0,0,0,0|1,0,0]=3 1588 B13R1.142 CCSc1ccc(cc1)OC(=S)C 62a_100000210202_200009816735 [2,0,0,0,0,0|1,1,0]=4 1589 B13R1.142 CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000210202 [2,0,0,0,0,0|1,1,0]=4 1590 B13R1.142 CNCc1ccc(cc1)NC(=O)C 207a_100102657272_100000210072 [2,0,0,0,0,0|2,0,0]=4 1591 B13R1.142 CNCc1ccc(cc1)NC(=O)C 2230a_106832991635_100000731167 [2,0,0,0,0,0|2,0,0]=4 1592 B13R1.142 CNCc1ccc(cc1)NC(=O)C 34a_100000735448_200000210301 [2,0,0,0,0,0|2,0,0]=4 1593 B13R1.142 CNCc1ccc(cc1)NC(=O)C 34a_100102657272_100000731167 [2,0,0,0,0,0|2,0,0]=4 1594 B13R1.142 CNCc1ccc(cc1)NC(=O)C 7a_106832991635_100000731167 [2,0,0,0,0,0|2,0,0]=4 1595 B13R1.142 CNCc1ccc(cc1)OC(=O)C 207a_100102657272_100000014718 [2,0,0,0,0,0|1,0,0]=3 1596 B13R1.142 CNCc1ccc(cc1)OC(=O)C 2230a_106832991635_100000033664 [2,0,0,0,0,0|1,0,0]=3 1597 B13R1.142 CNCc1ccc(cc1)OC(=O)C 270004a_106832991635_100000014718 [2,0,0,0,0,0|1,0,0]=3 1598 B13R1.142 CNCc1ccc(cc1)OC(=O)C 7a_106832991635_100000033664 [2,0,0,0,0,0|1,0,0]=3 1599 B13R1.142 COCc1ccc(cc1)CC(=O)C 1458a_100011290826_200000210301 [2,0,0,0,0,0|2,0,0]=4 1600 B13R1.142 COCc1ccc(cc1)CC(=O)[13CH3] 1458a_100011290826_200025704644 [2,0,0,0,0,0|2,0,0]=4 1601 B13R1.142 COCc1ccc(cc1)NC(=O)C 11a_100000694113_100015343762 [2,0,0,0,0,0|2,0,0]=4 1602 B13R1.142 COCc1ccc(cc1)NC(=O)C 1626a_100000694113_100015343762 [2,0,0,0,0,0|2,0,0]=4 1603 B13R1.142 COCc1ccc(cc1)NC(=O)C 22a_100000694113_100000070787 [2,0,0,0,0,0|2,0,0]=4 1604 B13R1.142 COCc1ccc(cc1)NC(=O)C 34a_100000246270_200000210301 [2,0,0,0,0,0|2,0,0]=4 1605 B13R1.142 COCc1ccc(cc1)NC(=O)C 34a_100138415774_100000731167 [2,0,0,0,0,0|2,0,0]=4 1606 B13R1.142 COCc1ccc(cc1)NC(=O)C 527a_100000694113_100103153847 [2,0,0,0,0,0|2,0,0]=4 1607 B13R1.142 COCc1ccc(cc1)NC(=O)C 7a_100000246270_200000210301 [2,0,0,0,0,0|2,0,0]=4 1608 B13R1.142 CSCc1ccc(cc1)NC(=O)C 11a_106726388226_100015343762 [2,0,0,0,0,0|2,0,0]=4 1609 B13R1.142 CSCc1ccc(cc1)NC(=O)C 1626a_106726388226_100015343762 [2,0,0,0,0,0|2,0,0]=4 1610 B13R1.142 CSCc1ccc(cc1)NC(=O)C 22a_106726388226_100000070787 [2,0,0,0,0,0|2,0,0]=4 1611 B13R1.142 CSCc1ccc(cc1)NC(=O)C 527a_106726388226_100103153847 [2,0,0,0,0,0|2,0,0]=4 1612 B13R1.142 CSCc1ccc(cc1)NC(=O)C 62a_200000210301_100000731167 [2,0,0,0,0,0|2,0,0]=4 1613 B13R1.142 CSCc1ccc(cc1)OC(=O)C 62a_200000210301_100000033664 [2,0,0,0,0,0|1,0,0]=3 1614 B13R1.3 C=C(C)CNc1ccc(cc1)OC 34a_100000184247_100000748629 [2,0,0,0,0,0|2,0,0]=4 1615 B13R1.3 C=C(C)COc1ccc(cc1)OC 34a_100000210503_100000748629 [2,0,0,0,0,0|2,0,0]=4 1616 B13R1.3 C=C(C)CSc1ccc(cc1)C=O 62a_100000188517_100000211660 [2,0,0,0,0,0|2,0,0]=4 1617 B13R1.3 C=C(C)CSc1ccc(cc1)C=O 62a_100000748629_100000188517 [2,0,0,0,0,0|2,0,0]=4 1618 B13R1.3 C=C(C)CSc1ccc(cc1)OC 62a_100000748629_100000171711 [2,0,0,0,0,0|2,0,0]=4 1619 B13R1.3 C=Cc1ccc(cc1)CCC(=O)C 1458a_100000070787_100000142037 [2,0,0,0,0,0|0,0,1]=3 1620 B13R1.3 C=Cc1ccc(cc1)CCC(=O)C 271570a_100011290941_100000723691 [2,0,0,0,0,0|0,0,1]=3 1621 B13R1.3 C=Cc1ccc(cc1)CCC(=O)N 271570a_100011290941_200010110666 [2,0,0,0,0,0|1,0,1]=4 1622 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 11a_200011934891_100015343762 [2,0,0,0,0,0|1,0,1]=4 1623 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 1626a_200011934891_100015343762 [2,0,0,0,0,0|1,0,1]=4 1624 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 240690a_200011934891_100015343762 [2,0,0,0,0,0|1,0,1]=4 1625 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 271570a_100011290941_200000685173 [2,0,0,0,0,0|1,0,1]=4 1626 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 527a_200011934891_100103153847 [2,0,0,0,0,0|1,0,1]=4 1627 B13R1.3 CC(=O)/C=C/c1ccc(cc1)O[13CH3] 34a_100000189429_200025704644 [2,0,0,0,0,0|0,0,2]=4 1628 B13R1.3 CC(=O)CCc1ccc(cc1)C#N 1458a_100000021948_200000210301 [2,0,0,0,0,0|1,0,1]=4 1629 B13R1.3 CC(=O)CCc1ccc(cc1)C#N 1458a_100000070787_100012161189 [2,0,0,0,0,0|1,0,1]=4 1630 B13R1.3 CC(=O)CCc1ccc(cc1)O[13CH3] 34a_100000198047_200025704644 [2,0,0,0,0,0|0,0,0]=2 1631 B13R1.3 CC(=O)CCc1ccc(cc1)O[13CH3] 7a_100000198047_200025704644 [2,0,0,0,0,0|0,0,0]=2 1632 B13R1.3 CC(=O)CCc1ccc(cc1)S[13CH3] 62a_100000723691_200025704644 [2,0,0,0,0,0|0,1,0]=3 1633 B13R1.3 CC(=O)CCc1ccc(cc1)S[13CH3] 62a_200025704644_100000723691 [2,0,0,0,0,0|0,1,0]=3 1634 B13R1.3 CC(=O)NCc1ccc(cc1)N[13CH3] 34a_100000755463_200025704644 [2,0,0,0,0,0|2,0,0]=4 1635 B13R1.3 CC(=O)NCc1ccc(cc1)S[13CH3] 62a_200000685173_200025704644 [2,0,0,0,0,0|1,1,0]=4 1636 B13R1.3 CC(=O)NCc1ccc(cc1)S[13CH3] 62a_200025704644_200000685173 [2,0,0,0,0,0|1,1,0]=4 1637 B13R1.3 CC(O)CCc1ccc(cc1)O[13CH3] 34a_100000189425_200025704644 [2,0,0,0,0,0|0,0,2]=4 1638 B13R1.3 CC(O)CCc1ccc(cc1)O[13CH3] 7a_100000189425_200025704644 [2,0,0,0,0,0|0,0,2]=4 1639 B13R1.3 CCc1ccc(cc1)CCC(=O)C 1458a_100000195522_200000210301 [2,0,0,0,0,0|0,0,1]=3 1640 B13R1.3 CCc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000195522_200025704644 [2,0,0,0,0,0|0,0,1]=3 1641 B13R1.3 CCc1ccc(cc1)CNC(=O)C 11a_100000721222_100015343762 [2,0,0,0,0,0|1,0,1]=4 1642 B13R1.3 CCc1ccc(cc1)CNC(=O)C 1626a_100000721222_100015343762 [2,0,0,0,0,0|1,0,1]=4 1643 B13R1.3 CCc1ccc(cc1)CNC(=O)C 240690a_100000721222_100015343762 [2,0,0,0,0,0|1,0,1]=4 1644 B13R1.3 CCc1ccc(cc1)CNC(=O)C 527a_100000721222_100103153847 [2,0,0,0,0,0|1,0,1]=4 1645 B13R1.3 CCc1ccc(cc1)OCC(=O)C 1458a_100000182499_200000210301 [2,0,0,0,0,0|1,0,1]=4 1646 B13R1.3 CCc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182499_200025704644 [2,0,0,0,0,0|1,0,1]=4 1647 B13R1.3 CNc1ccc(cc1)CNC(=O)C 34a_100000755463_200000210301 [2,0,0,0,0,0|2,0,0]=4 1648 B13R1.3 COc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_200000210301 [2,0,0,0,0,0|0,0,2]=4 1649 B13R1.3 COc1ccc(cc1)C#CC(=O)C 1458a_100000185621_200000210301 [2,0,0,0,0,0|0,0,2]=4 1650 B13R1.3 COc1ccc(cc1)C#CC(=O)[13CH3] 1458a_100000185621_200025704644 [2,0,0,0,0,0|0,0,2]=4 1651 B13R1.3 COc1ccc(cc1)C=CC(=O)C 1458a_100000184205_200000210301 [2,0,0,0,0,0|0,0,2]=4 1652 B13R1.3 COc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000184205_200025704644 [2,0,0,0,0,0|0,0,2]=4 1653 B13R1.3 COc1ccc(cc1)CCC(=O)C 1458a_100000070787_100000184700 [2,0,0,0,0,0|0,0,0]=2 1654 B13R1.3 COc1ccc(cc1)CCC(=O)C 1458a_100000211712_200000210301 [2,0,0,0,0,0|0,0,0]=2 1655 B13R1.3 COc1ccc(cc1)CCC(=O)C 34a_100000198047_200000210301 [2,0,0,0,0,0|0,0,0]=2 1656 B13R1.3 COc1ccc(cc1)CCC(=O)C 7a_100000198047_200000210301 [2,0,0,0,0,0|0,0,0]=2 1657 B13R1.3 COc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000211712_200025704644 [2,0,0,0,0,0|0,0,0]=2 1658 B13R1.3 COc1ccc(cc1)CCC(C)O 34a_100000189425_200000210301 [2,0,0,0,0,0|0,0,2]=4 1659 B13R1.3 COc1ccc(cc1)CCC(C)O 7a_100000189425_200000210301 [2,0,0,0,0,0|0,0,2]=4 1660 B13R1.3 COc1ccc(cc1)CCN(C)C 2230a_100000225672_200000210301 [2,0,0,0,0,0|2,0,0]=4 1661 B13R1.3 COc1ccc(cc1)CCN(C)C 2230a_100102631434_100011713689 [2,0,0,0,0,0|2,0,0]=4 1662 B13R1.3 COc1ccc(cc1)CCN(C)C 269982a_100000225672_200000210301 [2,0,0,0,0,0|2,0,0]=4 1663 B13R1.3 COc1ccc(cc1)CCN(C)C 269982a_100102631434_100000184700 [2,0,0,0,0,0|2,0,0]=4 1664 B13R1.3 COc1ccc(cc1)CCN(C)C 270004a_100102631434_100011242372 [2,0,0,0,0,0|2,0,0]=4 1665 B13R1.3 COc1ccc(cc1)CCN(C)C 34a_100000225672_200000210301 [2,0,0,0,0,0|2,0,0]=4 1666 B13R1.3 COc1ccc(cc1)CCN(C)[13CH3] 2230a_100000225672_200025704644 [2,0,0,0,0,0|2,0,0]=4 1667 B13R1.3 COc1ccc(cc1)CCN(C)[13CH3] 269982a_100000225672_200025704644 [2,0,0,0,0,0|2,0,0]=4 1668 B13R1.3 COc1ccc(cc1)CCN(C)[13CH3] 34a_100000225672_200025704644 [2,0,0,0,0,0|2,0,0]=4 1669 B13R1.3 COc1ccc(cc1)CNC(=O)C 11a_100000185587_100015343762 [2,0,0,0,0,0|1,0,0]=3 1670 B13R1.3 COc1ccc(cc1)CNC(=O)C 1626a_100000185587_100015343762 [2,0,0,0,0,0|1,0,0]=3 1671 B13R1.3 COc1ccc(cc1)CNC(=O)C 240690a_100000185587_100015343762 [2,0,0,0,0,0|1,0,0]=3 1672 B13R1.3 COc1ccc(cc1)CNC(=O)C 527a_100000185587_100103153847 [2,0,0,0,0,0|1,0,0]=3 1673 B13R1.3 COc1ccc(cc1)NCC(=O)N 34a_100000184247_100000187820 [2,0,0,0,0,0|2,0,0]=4 1674 B13R1.3 COc1ccc(cc1)NCC(=O)[O-] 34a_100000184247_100020667443 [2,0,0,0,0,0|2,0,0]=4 1675 B13R1.3 COc1ccc(cc1)NNC(=O)C 22a_100000005221_100000070787 [2,0,0,0,0,0|2,0,0]=4 1676 B13R1.3 COc1ccc(cc1)OCC(=O)C 1458a_100000186439_200000210301 [2,0,0,0,0,0|1,0,0]=3 1677 B13R1.3 COc1ccc(cc1)OCC(=O)N 34a_100000210503_100000187820 [2,0,0,0,0,0|2,0,0]=4 1678 B13R1.3 COc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000186439_200025704644 [2,0,0,0,0,0|1,0,0]=3 1679 B13R1.3 COc1ccc(cc1)OCC(=O)[O-] 34a_100000210503_100020667443 [2,0,0,0,0,0|2,0,0]=4 1680 B13R1.3 COc1ccc(cc1)SCC(=O)C 1458a_100000182033_200000210301 [2,0,0,0,0,0|1,0,0]=3 1681 B13R1.3 COc1ccc(cc1)SCC(=O)N 62a_100000747473_100000171711 [2,0,0,0,0,0|2,0,0]=4 1682 B13R1.3 COc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000182033_200025704644 [2,0,0,0,0,0|1,0,0]=3 1683 B13R1.3 COc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000171711 [2,0,0,0,0,0|2,0,0]=4 1684 B13R1.3 COc1ccc(cn1)CNC(=O)C 11a_100000241975_100015343762 [2,0,0,0,0,0|2,0,0]=4 1685 B13R1.3 COc1ccc(cn1)CNC(=O)C 1626a_100000241975_100015343762 [2,0,0,0,0,0|2,0,0]=4 1686 B13R1.3 COc1ccc(cn1)CNC(=O)C 240690a_100000241975_100015343762 [2,0,0,0,0,0|2,0,0]=4 1687 B13R1.3 COc1ccc(cn1)CNC(=O)C 527a_100000241975_100103153847 [2,0,0,0,0,0|2,0,0]=4 1688 B13R1.3 COc1ccc(nc1)CNC(=O)C 11a_100000703904_100015343762 [2,0,0,0,0,0|2,0,0]=4 1689 B13R1.3 COc1ccc(nc1)CNC(=O)C 1626a_100000703904_100015343762 [2,0,0,0,0,0|2,0,0]=4 1690 B13R1.3 COc1ccc(nc1)CNC(=O)C 240690a_100000703904_100015343762 [2,0,0,0,0,0|2,0,0]=4 1691 B13R1.3 COc1ccc(nc1)CNC(=O)C 527a_100000703904_100103153847 [2,0,0,0,0,0|2,0,0]=4 1692 B13R1.3 CSc1ccc(cc1)CCC(=O)C 1458a_100011252364_200000210301 [2,0,0,0,0,0|0,1,0]=3 1693 B13R1.3 CSc1ccc(cc1)CCC(=O)C 62a_100000723691_200000210301 [2,0,0,0,0,0|0,1,0]=3 1694 B13R1.3 CSc1ccc(cc1)CCC(=O)C 62a_200000210301_100000723691 [2,0,0,0,0,0|0,1,0]=3 1695 B13R1.3 CSc1ccc(cc1)CCC(=O)N 62a_200000210301_200010110666 [2,0,0,0,0,0|1,1,0]=4 1696 B13R1.3 CSc1ccc(cc1)CCC(=O)N 62a_200010110666_200000210301 [2,0,0,0,0,0|1,1,0]=4 1697 B13R1.3 CSc1ccc(cc1)CCC(=O)[13CH3] 1458a_100011252364_200025704644 [2,0,0,0,0,0|0,1,0]=3 1698 B13R1.3 CSc1ccc(cc1)CNC(=O)C 11a_100000174980_100015343762 [2,0,0,0,0,0|1,1,0]=4 1699 B13R1.3 CSc1ccc(cc1)CNC(=O)C 240690a_100000174980_100015343762 [2,0,0,0,0,0|1,1,0]=4 1700 B13R1.3 CSc1ccc(cc1)CNC(=O)C 527a_100000174980_100103153847 [2,0,0,0,0,0|1,1,0]=4 1701 B13R1.3 CSc1ccc(cc1)CNC(=O)C 62a_200000210301_200000685173 [2,0,0,0,0,0|1,1,0]=4 1702 B13R1.3 CSc1ccc(cc1)CNC(=O)C 62a_200000685173_200000210301 [2,0,0,0,0,0|1,1,0]=4 1703 B13R1.3 NC(=O)CSc1ccc(cc1)C=O 62a_100000188517_100000747473 [2,0,0,0,0,0|2,0,0]=4 1704 B13R1.3 NC(=O)CSc1ccc(cc1)C=O 62a_100000747473_100000188517 [2,0,0,0,0,0|2,0,0]=4 1705 B13R1.3 O=Cc1ccc(cc1)SCC(=O)[O-] 62a_100000188517_100020667443 [2,0,0,0,0,0|2,0,0]=4 1706 B13R1.3 O=Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000188517 [2,0,0,0,0,0|2,0,0]=4 1707 B13R1.3 [13CH3]C(=O)CCc1ccc(cc1)C#N 1458a_100000021948_200025704644 [2,0,0,0,0,0|1,0,1]=4 1708 B13R1.3 [13CH3]Sc1ccc(cc1)CCC(=O)N 62a_200010110666_200025704644 [2,0,0,0,0,0|1,1,0]=4 1709 B13R1.3 [13CH3]Sc1ccc(cc1)CCC(=O)N 62a_200025704644_200010110666 [2,0,0,0,0,0|1,1,0]=4 1710 B15R1.54 CC(=O)Cc1ccc(c(c1)Br)OCC=O 34a_100010141077_200009817547 [1,1,0,0,0,0|2,0,0]=4 1711 B15R1.54 CC(=O)Cc1ccc(c(c1)Br)OCC=O 7a_100010141077_200015260668 [1,1,0,0,0,0|2,0,0]=4 1712 B15R1.54 CC(=O)Cc1ccc(c(c1)C)OCC=O 34a_200000080089_200009817547 [1,1,0,0,0,0|2,0,0]=4 1713 B15R1.54 CC(=O)Cc1ccc(c(c1)C)OCC=O 7a_200000080089_200015260668 [1,1,0,0,0,0|2,0,0]=4 1714 B15R1.54 CC(=O)Cc1ccc(c(c1)Cl)OCC=O 34a_200000080078_200009817547 [1,1,0,0,0,0|2,0,0]=4 1715 B15R1.54 CC(=O)Cc1ccc(c(c1)Cl)OCC=O 7a_200000080078_200015260668 [1,1,0,0,0,0|2,0,0]=4 1716 B15R1.54 CC(=O)Nc1ccc(c(c1)C)OCC=O 34a_100012186693_200009817547 [1,1,0,0,0,0|2,0,0]=4 1717 B15R1.54 CC(=O)Nc1ccc(c(c1)C)OCC=O 7a_100012186693_200015260668 [1,1,0,0,0,0|2,0,0]=4 1718 B15R1.54 CC(=O)Nc1ccc(c(c1)C)SCC=O 62a_200015260668_100000155607 [1,1,0,0,0,0|2,0,0]=4 1719 B15R1.54 CC(=O)Nc1ccc(c(c1)Cl)OCC=O 34a_100011215158_200009817547 [1,1,0,0,0,0|2,0,0]=4 1720 B15R1.54 CC(=O)Nc1ccc(c(c1)Cl)OCC=O 7a_100011215158_200015260668 [1,1,0,0,0,0|2,0,0]=4 1721 B15R1.54 CC(=O)Nc1ccc(c(c1)F)SCC=O 62a_200015260668_100011219590 [1,1,0,0,0,0|2,0,0]=4 1722 B15R1.54 CCCCc1ccc(cc1C)NC(=O)C 271570a_100020621405_100000155607 [1,1,0,0,0,0|1,0,1]=4 1723 B15R1.54 CCCCc1ccc(cc1F)NC(=O)C 271570a_100020621405_100011219590 [1,1,0,0,0,0|1,0,1]=4 1724 B15R1.55 CC(=C(C)c1ccc(cc1)CCC=O)C 271570a_200000049429_100011361538 [1,1,0,0,0,0|2,0,0]=4 1725 B15R1.55 CC(=O)N(C)c1ccc(cc1)NCC=O 34a_100000229935_200009817547 [1,1,0,0,0,0|2,0,0]=4 1726 B15R1.55 CC(=O)N(C)c1ccc(cc1)OCC=O 34a_100000743460_200009817547 [1,1,0,0,0,0|2,0,0]=4 1727 B15R1.55 CC(=O)N(C)c1ccc(cc1)SCC=O 62a_200009816415_200015260668 [1,1,0,0,0,0|2,0,0]=4 1728 B15R1.55 CCCCc1ccc(cc1)N(C)C(=O)C 271570a_100020621405_200009816415 [1,1,0,0,0,0|1,0,1]=4 1729 B15R1.104 C=CCSc1ccc(cc1)OC(=O)CC 62a_100000210623_200009811598 [1,1,0,0,0,0|1,0,1]=4 1730 B15R1.104 CCC(=O)Nc1ccc(cc1)CCSC 11a_100000750819_100000210414 [1,1,0,0,0,0|2,0,0]=4 1731 B15R1.104 CCC(=O)Nc1ccc(cc1)CCSC 1626a_100000750819_100000210414 [1,1,0,0,0,0|2,0,0]=4 1732 B15R1.104 CCC(=O)Nc1ccc(cc1)CCSC 22a_100000750819_100000210414 [1,1,0,0,0,0|2,0,0]=4 1733 B15R1.104 CCC(=O)Nc1ccc(cc1)CCSC 527a_100000750819_100000210414 [1,1,0,0,0,0|2,0,0]=4 1734 B15R1.104 CCC(=O)Nc1ccc(cc1)NCC=O 34a_100000186511_200009817547 [1,1,0,0,0,0|2,0,0]=4 1735 B15R1.104 CCC(=O)Nc1ccc(cc1)OCC=O 34a_200000243810_200009817547 [1,1,0,0,0,0|2,0,0]=4 1736 B15R1.104 CCC(=O)Nc1ccc(cc1)OCC=O 7a_200000243810_200015260668 [1,1,0,0,0,0|2,0,0]=4 1737 B15R1.104 CCC(=O)Oc1ccc(cc1)SCC=O 62a_200015260668_200009811598 [1,1,0,0,0,0|1,0,0]=3 1738 B15R1.104 CCC(=O)Oc1ccc(cc1)SCOC 62a_100000766300_200009811598 [1,1,0,0,0,0|2,0,0]=4 1739 B15R1.104 CCC(=O)Oc1ccc(cc1)SCSC 62a_100011218213_200009811598 [1,1,0,0,0,0|2,0,0]=4 1740 B15R1.104 CCCCc1ccc(cc1)CC(=O)CC 1458a_100000185461_100000210202 [1,1,0,0,0,0|1,0,1]=4 1741 B15R1.104 CCCCc1ccc(cc1)CC(=O)CC 1458a_100000210414_100011934885 [1,1,0,0,0,0|1,0,1]=4 1742 B15R1.104 CCCCc1ccc(cc1)CC(=O)CF 1458a_100000185461_100015361967 [1,1,0,0,0,0|1,0,1]=4 1743 B15R1.104 CCCCc1ccc(cc1)CC(=O)CO 1458a_100000210174_100011934885 [1,1,0,0,0,0|1,0,1]=4 1744 B15R1.104 CCCCc1ccc(cc1)CC(=O)NC 11a_106832991635_100000185461 [1,1,0,0,0,0|1,0,1]=4 1745 B15R1.104 CCCCc1ccc(cc1)CC(=O)NC 1626a_100102657272_100000185461 [1,1,0,0,0,0|1,0,1]=4 1746 B15R1.104 CCCCc1ccc(cc1)CC(=O)NC 240690a_100102657272_100000185461 [1,1,0,0,0,0|1,0,1]=4 1747 B15R1.104 CCCCc1ccc(cc1)CC(=O)NC 271570a_100020621405_100000155101 [1,1,0,0,0,0|1,0,1]=4 1748 B15R1.104 CCCCc1ccc(cc1)CC(=O)NC 527a_100102657272_100000185461 [1,1,0,0,0,0|1,0,1]=4 1749 B15R1.104 CCCCc1ccc(cc1)CC(=O)OC 271570a_100020621405_100000149743 [1,1,0,0,0,0|1,0,1]=4 1750 B15R1.104 CCCCc1ccc(cc1)NC(=O)CC 11a_100000210628_100000210414 [1,1,0,0,0,0|1,0,1]=4 1751 B15R1.104 CCCCc1ccc(cc1)NC(=O)CC 1626a_100000210628_100000210414 [1,1,0,0,0,0|1,0,1]=4 1752 B15R1.104 CCCCc1ccc(cc1)NC(=O)CC 22a_100000210628_100000210414 [1,1,0,0,0,0|1,0,1]=4 1753 B15R1.104 CCCCc1ccc(cc1)NC(=O)CC 527a_100000210628_100000210414 [1,1,0,0,0,0|1,0,1]=4 1754 B15R1.104 CCCCc1ccc(cc1)NC(=O)CO 22a_100000210628_100000210174 [1,1,0,0,0,0|1,0,1]=4 1755 B15R1.104 CCCCc1ccc(cc1)NC(=O)CO 527a_100000210628_100000210174 [1,1,0,0,0,0|1,0,1]=4 1756 B15R1.104 CCCCc1ccc(cc1)NC(=O)NC 2430a_100000210628_100102657272 [1,1,0,0,0,0|1,0,1]=4 1757 B15R1.104 CCCCc1ccc(cc1)NC(=O)NC 512a_100000210628_100102657272 [1,1,0,0,0,0|1,0,1]=4 1758 B15R1.104 CCCCc1ccc(cc1)NC(=O)OC 271570a_100020621405_100000181880 [1,1,0,0,0,0|1,0,1]=4 1759 B15R1.104 CCCCc1ccc(cc1)OC(=O)CC 271570a_100020621405_200009811598 [1,1,0,0,0,0|0,0,1]=3 1760 B15R1.104 CCCSc1ccc(cc1)OC(=O)CC 62a_100000210303_200009811598 [1,1,0,0,0,0|1,0,1]=4 1761 B15R1.104 CCNCc1ccc(cc1)OC(=O)CC 270004a_100015525214_200000014686 [1,1,0,0,0,0|1,0,1]=4 1762 B15R1.104 CNC(=O)Cc1ccc(cc1)NCC=O 2230a_100000736799_200015260668 [1,1,0,0,0,0|2,0,0]=4 1763 B15R1.104 CNC(=O)Cc1ccc(cc1)NCC=O 34a_100000736799_200009817547 [1,1,0,0,0,0|2,0,0]=4 1764 B15R1.104 CNC(=O)Cc1ccc(cc1)OCC=O 34a_200000020795_200009817547 [1,1,0,0,0,0|2,0,0]=4 1765 B15R1.104 CNC(=O)Cc1ccc(cc1)SCC=O 62a_100000155101_200015260668 [1,1,0,0,0,0|2,0,0]=4 1766 B15R1.104 CNC(=O)Cc1ccc(cc1)SCC=O 62a_200015260668_100000155101 [1,1,0,0,0,0|2,0,0]=4 1767 B15R1.104 CNC(=O)Nc1ccc(cc1)CCSC 2430a_100000750819_100102657272 [1,1,0,0,0,0|2,0,0]=4 1768 B15R1.104 CNC(=O)Nc1ccc(cc1)CCSC 512a_100000750819_100102657272 [1,1,0,0,0,0|2,0,0]=4 1769 B15R1.104 COC(=O)Cc1ccc(cc1)OCC=O 34a_100000211648_200009817547 [1,1,0,0,0,0|2,0,0]=4 1770 B15R1.104 COC(=O)Cc1ccc(cc1)SCC=O 62a_100000149743_200015260668 [1,1,0,0,0,0|2,0,0]=4 1771 B15R1.104 COC(=O)Cc1ccc(cc1)SCC=O 62a_200015260668_100000149743 [1,1,0,0,0,0|2,0,0]=4 1772 B15R1.104 COC(=O)Nc1ccc(cc1)OCC=O 34a_100011235918_200009817547 [1,1,0,0,0,0|2,0,0]=4 1773 B15R1.104 COC(=O)Nc1ccc(cc1)SCC=O 62a_200015260668_100000181880 [1,1,0,0,0,0|2,0,0]=4 1774 B15R1.104 CSCCc1ccc(cc1)NC(=O)CO 22a_100000750819_100000210174 [1,1,0,0,0,0|2,0,0]=4 1775 B15R1.104 CSCCc1ccc(cc1)NC(=O)CO 527a_100000750819_100000210174 [1,1,0,0,0,0|2,0,0]=4 1776 B15R1.104 NCC(=O)Nc1ccc(cc1)SCC=O 62a_200015260668_100000741985 [1,1,0,0,0,0|2,0,0]=4 1777 B15R1.104 O=CCNc1ccc(cc1)NC(=O)CO 34a_100011269904_200009817547 [1,1,0,0,0,0|2,0,0]=4 1778 B15R1.104 O=CCOc1ccc(cc1)NC(=O)CCl 34a_100000233757_200009817547 [1,1,0,0,0,0|2,0,0]=4 1779 B15R1.560 C#CCCSc1ccc(cc1)OC(=O)C 62a_100000688953_100000002173 [1,1,0,0,0,0|0,0,2]=4 1780 B15R1.560 C#CCSCc1ccc(cc1)OC(=O)C 62a_100000038162_100000033664 [1,1,0,0,0,0|0,0,2]=4 1781 B15R1.560 C/C=C/CNc1ccc(cc1)NC(=O)C 34a_100000184111_100102629194 [1,1,0,0,0,0|1,0,1]=4 1782 B15R1.560 C/C=C/COc1ccc(cc1)CC(=O)C 34a_100011218180_100102629194 [1,1,0,0,0,0|1,0,1]=4 1783 B15R1.560 C/C=C/COc1ccc(cc1)CC(=O)C 7a_100011218180_100102629194 [1,1,0,0,0,0|1,0,1]=4 1784 B15R1.560 C/C=C/COc1ccc(cc1)NC(=O)C 34a_100000184395_100102629194 [1,1,0,0,0,0|1,0,1]=4 1785 B15R1.560 C/C=C/COc1ccc(cc1)NC(=O)C 7a_100000184395_100102629194 [1,1,0,0,0,0|1,0,1]=4 1786 B15R1.560 C/C=C/CSc1ccc(cc1)CC(=O)C 62a_100000691760_100102629194 [1,1,0,0,0,0|1,0,1]=4 1787 B15R1.560 C/C=C/CSc1ccc(cc1)CC(=O)C 62a_100102629194_100000691760 [1,1,0,0,0,0|1,0,1]=4 1788 B15R1.560 C/C=C/CSc1ccc(cc1)NC(=O)C 62a_100102629194_100000155215 [1,1,0,0,0,0|1,0,1]=4 1789 B15R1.560 C/C=C/CSc1ccc(cc1)OC(=O)C 62a_100102629194_100000002173 [1,1,0,0,0,0|0,0,1]=3 1790 B15R1.560 C/C=C/CSc1ccc(cc1)OC(=S)C 62a_100102629194_200009816735 [1,1,0,0,0,0|0,1,1]=4 1791 B15R1.560 C/C=C/CSc1ccc(cc1)SC(=O)C 62a_200009995050_100102629194 [1,1,0,0,0,0|0,1,1]=4 1792 B15R1.560 C=CCCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000754431 [1,1,0,0,0,0|1,0,1]=4 1793 B15R1.560 C=CCCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000754431 [1,1,0,0,0,0|1,0,1]=4 1794 B15R1.560 C=CCCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000754431 [1,1,0,0,0,0|1,0,1]=4 1795 B15R1.560 C=CCCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000754431 [1,1,0,0,0,0|1,0,1]=4 1796 B15R1.560 C=CCCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000754431 [1,1,0,0,0,0|1,0,1]=4 1797 B15R1.560 C=CCCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000754431 [1,1,0,0,0,0|1,0,1]=4 1798 B15R1.560 C=CCCSc1ccc(cc1)CC(=O)C 62a_100000754431_100000691760 [1,1,0,0,0,0|1,0,1]=4 1799 B15R1.560 C=CCCSc1ccc(cc1)NC(=O)C 62a_100000754431_100000155215 [1,1,0,0,0,0|1,0,1]=4 1800 B15R1.560 C=CCCSc1ccc(cc1)OC(=O)C 62a_100000754431_100000002173 [1,1,0,0,0,0|0,0,1]=3 1801 B15R1.560 C=CCCSc1ccc(cc1)OC(=S)C 62a_100000754431_200009816735 [1,1,0,0,0,0|0,1,1]=4 1802 B15R1.560 C=CCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000754431 [1,1,0,0,0,0|0,1,1]=4 1803 B15R1.560 C=CCNCc1ccc(cc1)NC(=O)C 2230a_100020586998_100000731167 [1,1,0,0,0,0|1,0,1]=4 1804 B15R1.560 C=CCNCc1ccc(cc1)NC(=O)C 34a_100000735448_100015514636 [1,1,0,0,0,0|1,0,1]=4 1805 B15R1.560 C=CCNCc1ccc(cc1)OC(=O)C 2230a_100020586998_100000033664 [1,1,0,0,0,0|0,0,1]=3 1806 B15R1.560 C=CCNCc1ccc(cc1)OC(=O)C 270004a_100020586998_100000014718 [1,1,0,0,0,0|0,0,1]=3 1807 B15R1.560 C=CCOCc1ccc(cc1)NC(=O)C 34a_100000246270_100015514636 [1,1,0,0,0,0|1,0,1]=4 1808 B15R1.560 C=CCOCc1ccc(cc1)NC(=O)C 34a_200000210373_100000731167 [1,1,0,0,0,0|1,0,1]=4 1809 B15R1.560 C=CCOCc1ccc(cc1)NC(=O)C 7a_100000246270_100015514636 [1,1,0,0,0,0|1,0,1]=4 1810 B15R1.560 C=CCSCc1ccc(cc1)NC(=O)C 62a_100000210623_100000731167 [1,1,0,0,0,0|1,0,1]=4 1811 B15R1.560 C=CCSCc1ccc(cc1)OC(=O)C 62a_100000210623_100000033664 [1,1,0,0,0,0|0,0,1]=3 1812 B15R1.560 CC#CCSc1ccc(cc1)OC(=O)C 62a_100000748600_100000002173 [1,1,0,0,0,0|0,0,2]=4 1813 B15R1.560 CC(=Cc1ccc(cc1)CCNC=O)C 271570a_100102525489_200012351260 [1,1,0,0,0,0|2,0,0]=4 1814 B15R1.560 CC(=O)Nc1ccc(cc1)CCOCF 34a_100000752260_100015361967 [1,1,0,0,0,0|2,0,0]=4 1815 B15R1.560 CC(=O)Nc1ccc(cc1)CCOCF 7a_100000752260_100015361967 [1,1,0,0,0,0|2,0,0]=4 1816 B15R1.560 CC(=O)Nc1ccc(cc1)CNCC=O 34a_100000735448_200009817547 [1,1,0,0,0,0|1,0,0]=3 1817 B15R1.560 CC(=O)Nc1ccc(cc1)COCC=O 34a_100000246270_200009817547 [1,1,0,0,0,0|1,0,0]=3 1818 B15R1.560 CC(=O)Nc1ccc(cc1)COCC=O 7a_100000246270_200015260668 [1,1,0,0,0,0|1,0,0]=3 1819 B15R1.560 CC(=O)Nc1ccc(cc1)CSCC=O 62a_200015260668_100000731167 [1,1,0,0,0,0|1,0,0]=3 1820 B15R1.560 CC(=O)Oc1ccc(cc1)CNCCO 207a_100000210304_100000014718 [1,1,0,0,0,0|0,0,2]=4 1821 B15R1.560 CC(=O)Oc1ccc(cc1)CNCCO 2230a_100016997473_100000033664 [1,1,0,0,0,0|0,0,2]=4 1822 B15R1.560 CC(=O)Oc1ccc(cc1)CNCCO 270004a_100000210304_100000014718 [1,1,0,0,0,0|0,0,2]=4 1823 B15R1.560 CC(=O)Oc1ccc(cc1)CSCC#N 62a_100011215382_100000033664 [1,1,0,0,0,0|1,0,1]=4 1824 B15R1.560 CC(=O)Oc1ccc(cc1)CSCC=O 62a_200015260668_100000033664 [1,1,0,0,0,0|0,0,0]=2 1825 B15R1.560 CC(=O)Oc1ccc(cc1)CSCCF 62a_100011217306_100000033664 [1,1,0,0,0,0|1,0,1]=4 1826 B15R1.560 CC(=O)Oc1ccc(cc1)CSCCO 62a_100000211926_100000033664 [1,1,0,0,0,0|0,0,2]=4 1827 B15R1.560 CC(=O)Oc1ccc(cc1)SCCC#N 62a_100011215226_100000002173 [1,1,0,0,0,0|1,0,1]=4 1828 B15R1.560 CC(=O)Oc1ccc(cc1)SCCCF 62a_100011934791_100000002173 [1,1,0,0,0,0|1,0,1]=4 1829 B15R1.560 CC(=O)Oc1ccc(cc1)SCCCO 62a_100011215043_100000002173 [1,1,0,0,0,0|0,0,2]=4 1830 B15R1.560 CC(C)Oc1ccc(cc1)CNCC=O 2230a_100020586559_200015260668 [1,1,0,0,0,0|1,0,1]=4 1831 B15R1.560 CC(C)Oc1ccc(cc1)CNCC=O 34a_100020586559_200009817547 [1,1,0,0,0,0|1,0,1]=4 1832 B15R1.560 CC(C)Oc1ccc(cc1)COCC=O 34a_100000173089_200009817547 [1,1,0,0,0,0|1,0,1]=4 1833 B15R1.560 CC(C)Oc1ccc(cc1)COCC=O 7a_100000173089_200015260668 [1,1,0,0,0,0|1,0,1]=4 1834 B15R1.560 CC=CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000070051 [1,1,0,0,0,0|1,0,1]=4 1835 B15R1.560 CC=CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000070051 [1,1,0,0,0,0|1,0,1]=4 1836 B15R1.560 CC=CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000070051 [1,1,0,0,0,0|1,0,1]=4 1837 B15R1.560 CC=CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000070051 [1,1,0,0,0,0|1,0,1]=4 1838 B15R1.560 CC=CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000070051 [1,1,0,0,0,0|1,0,1]=4 1839 B15R1.560 CC=CCSc1ccc(cc1)CC(=O)C 62a_100000070051_100000691760 [1,1,0,0,0,0|1,0,1]=4 1840 B15R1.560 CC=CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000070051 [1,1,0,0,0,0|1,0,1]=4 1841 B15R1.560 CC=CCSc1ccc(cc1)NC(=O)C 62a_100000070051_100000155215 [1,1,0,0,0,0|1,0,1]=4 1842 B15R1.560 CC=CCSc1ccc(cc1)OC(=O)C 62a_100000070051_100000002173 [1,1,0,0,0,0|0,0,1]=3 1843 B15R1.560 CC=CCSc1ccc(cc1)OC(=S)C 62a_100000070051_200009816735 [1,1,0,0,0,0|0,1,1]=4 1844 B15R1.560 CC=CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000070051 [1,1,0,0,0,0|0,1,1]=4 1845 B15R1.560 CCCC=Cc1ccc(cc1)OC(=O)C 271570a_100016258520_100000002173 [1,1,0,0,0,0|0,0,2]=4 1846 B15R1.560 CCCCCc1ccc(cc1)CC(=O)C 1458a_100000011233_200000210301 [1,1,0,0,0,0|1,0,1]=4 1847 B15R1.560 CCCCCc1ccc(cc1)CC(=O)[13CH3] 1458a_100000011233_200025704644 [1,1,0,0,0,0|1,0,1]=4 1848 B15R1.560 CCCCCc1ccc(cc1)NC(=O)C 11a_100000211775_100015343762 [1,1,0,0,0,0|1,0,1]=4 1849 B15R1.560 CCCCCc1ccc(cc1)NC(=O)C 1626a_100000211775_100015343762 [1,1,0,0,0,0|1,0,1]=4 1850 B15R1.560 CCCCCc1ccc(cc1)NC(=O)C 22a_100000211775_100000070787 [1,1,0,0,0,0|1,0,1]=4 1851 B15R1.560 CCCCCc1ccc(cc1)NC(=O)C 527a_100000211775_100103153847 [1,1,0,0,0,0|1,0,1]=4 1852 B15R1.560 CCCCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000210210 [1,1,0,0,0,0|1,0,1]=4 1853 B15R1.560 CCCCOc1ccc(cc1)CC(=O)C 1458a_100000230829_200000210301 [1,1,0,0,0,0|1,0,1]=4 1854 B15R1.560 CCCCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000210210 [1,1,0,0,0,0|1,0,1]=4 1855 B15R1.560 CCCCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000210211 [1,1,0,0,0,0|1,0,1]=4 1856 B15R1.560 CCCCOc1ccc(cc1)CC(=O)[13CH3] 1458a_100000230829_200025704644 [1,1,0,0,0,0|1,0,1]=4 1857 B15R1.560 CCCCOc1ccc(cc1)NC(=O)C 11a_100011194258_100015343762 [1,1,0,0,0,0|1,0,1]=4 1858 B15R1.560 CCCCOc1ccc(cc1)NC(=O)C 1626a_100011194258_100015343762 [1,1,0,0,0,0|1,0,1]=4 1859 B15R1.560 CCCCOc1ccc(cc1)NC(=O)C 22a_100011194258_100000070787 [1,1,0,0,0,0|1,0,1]=4 1860 B15R1.560 CCCCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000210210 [1,1,0,0,0,0|1,0,1]=4 1861 B15R1.560 CCCCOc1ccc(cc1)NC(=O)C 527a_100011194258_100103153847 [1,1,0,0,0,0|1,0,1]=4 1862 B15R1.560 CCCCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000210211 [1,1,0,0,0,0|1,0,1]=4 1863 B15R1.560 CCCCSc1ccc(cc1)CC(=O)C 62a_100000210211_100000691760 [1,1,0,0,0,0|1,0,1]=4 1864 B15R1.560 CCCCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000210210 [1,1,0,0,0,0|1,0,1]=4 1865 B15R1.560 CCCCSc1ccc(cc1)NC(=O)C 62a_100000210211_100000155215 [1,1,0,0,0,0|1,0,1]=4 1866 B15R1.560 CCCCSc1ccc(cc1)OC(=O)C 62a_100000210211_100000002173 [1,1,0,0,0,0|0,0,1]=3 1867 B15R1.560 CCCCSc1ccc(cc1)OC(=S)C 62a_100000210211_200009816735 [1,1,0,0,0,0|0,1,1]=4 1868 B15R1.560 CCCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000210210 [1,1,0,0,0,0|0,1,1]=4 1869 B15R1.560 CCCNCc1ccc(cc1)NC(=O)C 207a_100020643023_100000210072 [1,1,0,0,0,0|1,0,1]=4 1870 B15R1.560 CCCNCc1ccc(cc1)NC(=O)C 34a_100000735448_100000210303 [1,1,0,0,0,0|1,0,1]=4 1871 B15R1.560 CCCNCc1ccc(cc1)OC(=O)C 207a_100020643023_100000014718 [1,1,0,0,0,0|0,0,1]=3 1872 B15R1.560 CCCNCc1ccc(cc1)OC(=O)C 270004a_100020643023_100000014718 [1,1,0,0,0,0|0,0,1]=3 1873 B15R1.560 CCCOCc1ccc(cc1)NC(=O)C 34a_100000210258_100000731167 [1,1,0,0,0,0|1,0,1]=4 1874 B15R1.560 CCCOCc1ccc(cc1)NC(=O)C 34a_100000246270_100000210303 [1,1,0,0,0,0|1,0,1]=4 1875 B15R1.560 CCCOCc1ccc(cc1)NC(=O)C 7a_100000246270_100000210303 [1,1,0,0,0,0|1,0,1]=4 1876 B15R1.560 CCCSCc1ccc(cc1)NC(=O)C 62a_100000210303_100000731167 [1,1,0,0,0,0|1,0,1]=4 1877 B15R1.560 CCCSCc1ccc(cc1)OC(=O)C 62a_100000210303_100000033664 [1,1,0,0,0,0|0,0,1]=3 1878 B15R1.560 CCOCCc1ccc(cc1)NC(=O)C 34a_100000752260_100000210202 [1,1,0,0,0,0|1,0,1]=4 1879 B15R1.560 CCOCCc1ccc(cc1)NC(=O)C 7a_100000752260_100000210202 [1,1,0,0,0,0|1,0,1]=4 1880 B15R1.560 CCOCSc1ccc(cc1)OC(=O)C 62a_100000739092_100000002173 [1,1,0,0,0,0|1,0,1]=4 1881 B15R1.560 COCC=Cc1ccc(cc1)OC(=O)C 271570a_100016286323_100000002173 [1,1,0,0,0,0|1,0,1]=4 1882 B15R1.560 COCCNc1ccc(cc1)NC(=O)C 34a_100000184111_100011201679 [1,1,0,0,0,0|2,0,0]=4 1883 B15R1.560 COCCOc1ccc(cc1)CC(=O)C 1458a_100000070787_100011242488 [1,1,0,0,0,0|2,0,0]=4 1884 B15R1.560 COCCOc1ccc(cc1)CC(=O)C 34a_100011218180_100011201679 [1,1,0,0,0,0|2,0,0]=4 1885 B15R1.560 COCCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000233755 [1,1,0,0,0,0|2,0,0]=4 1886 B15R1.560 COCCOc1ccc(cc1)NC(=O)C 11a_100000739146_100015343762 [1,1,0,0,0,0|2,0,0]=4 1887 B15R1.560 COCCOc1ccc(cc1)NC(=O)C 1626a_100000739146_100015343762 [1,1,0,0,0,0|2,0,0]=4 1888 B15R1.560 COCCOc1ccc(cc1)NC(=O)C 22a_100000739146_100000070787 [1,1,0,0,0,0|2,0,0]=4 1889 B15R1.560 COCCOc1ccc(cc1)NC(=O)C 34a_100000184395_100011201679 [1,1,0,0,0,0|2,0,0]=4 1890 B15R1.560 COCCOc1ccc(cc1)NC(=O)C 527a_100000739146_100103153847 [1,1,0,0,0,0|2,0,0]=4 1891 B15R1.560 COCCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000233755 [1,1,0,0,0,0|2,0,0]=4 1892 B15R1.560 COCCSc1ccc(cc1)CC(=O)C 62a_100000233755_100000691760 [1,1,0,0,0,0|2,0,0]=4 1893 B15R1.560 COCCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000233755 [1,1,0,0,0,0|2,0,0]=4 1894 B15R1.560 COCCSc1ccc(cc1)NC(=O)C 62a_100000233755_100000155215 [1,1,0,0,0,0|2,0,0]=4 1895 B15R1.560 COCCSc1ccc(cc1)OC(=O)C 62a_100000233755_100000002173 [1,1,0,0,0,0|1,0,0]=3 1896 B15R1.560 COCCSc1ccc(cc1)OC(=S)C 62a_100000233755_200009816735 [1,1,0,0,0,0|1,1,0]=4 1897 B15R1.560 COCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000233755 [1,1,0,0,0,0|1,1,0]=4 1898 B15R1.560 COCSCc1ccc(cc1)NC(=O)C 62a_100000766300_100000731167 [1,1,0,0,0,0|2,0,0]=4 1899 B15R1.560 COCSCc1ccc(cc1)OC(=O)C 62a_100000766300_100000033664 [1,1,0,0,0,0|1,0,0]=3 1900 B15R1.560 CSCCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000212216 [1,1,0,0,0,0|2,0,0]=4 1901 B15R1.560 CSCCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000212216 [1,1,0,0,0,0|2,0,0]=4 1902 B15R1.560 CSCCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000212216 [1,1,0,0,0,0|2,0,0]=4 1903 B15R1.560 CSCCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000212216 [1,1,0,0,0,0|2,0,0]=4 1904 B15R1.560 CSCCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000212216 [1,1,0,0,0,0|2,0,0]=4 1905 B15R1.560 CSCCSc1ccc(cc1)CC(=O)C 62a_100000212216_100000691760 [1,1,0,0,0,0|2,0,0]=4 1906 B15R1.560 CSCCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000751147 [1,1,0,0,0,0|2,0,0]=4 1907 B15R1.560 CSCCSc1ccc(cc1)NC(=O)C 62a_100000212216_100000155215 [1,1,0,0,0,0|2,0,0]=4 1908 B15R1.560 CSCCSc1ccc(cc1)OC(=O)C 62a_100000212216_100000002173 [1,1,0,0,0,0|1,0,0]=3 1909 B15R1.560 CSCCSc1ccc(cc1)OC(=S)C 62a_100000212216_200009816735 [1,1,0,0,0,0|1,1,0]=4 1910 B15R1.560 CSCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000751147 [1,1,0,0,0,0|1,1,0]=4 1911 B15R1.560 CSCNCc1ccc(cc1)NC(=O)C 34a_100000735448_100011218213 [1,1,0,0,0,0|2,0,0]=4 1912 B15R1.560 CSCOCc1ccc(cc1)NC(=O)C 34a_100000246270_100011218213 [1,1,0,0,0,0|2,0,0]=4 1913 B15R1.560 CSCSCc1ccc(cc1)NC(=O)C 62a_100011218213_100000731167 [1,1,0,0,0,0|2,0,0]=4 1914 B15R1.560 CSCSCc1ccc(cc1)OC(=O)C 62a_100011218213_100000033664 [1,1,0,0,0,0|1,0,0]=3 1915 B15R1.560 O=CCNCc1ccc(cc1)CC(=O)O 269956a_100016989728_200015260668 [1,1,0,0,0,0|2,0,0]=4 1916 B15R1.779 CC(=O)Nc1ccc(cc1)N(C)CC=O 2230a_100000219403_200015260668 [1,1,0,0,0,0|2,0,0]=4 1917 B15R1.779 CC(=O)Nc1ccc(cc1)N(C)CC=O 269982a_100000219403_200015260668 [1,1,0,0,0,0|2,0,0]=4 1918 B15R1.779 CC(=O)Nc1ccc(cc1)N(C)CC=O 34a_100000219403_200009817547 [1,1,0,0,0,0|2,0,0]=4 1919 B15R1.779 CC(=O)Oc1ccc(cc1)C(=O)CS[13CH3] 62a_100010246728_200025704644 [1,1,0,0,0,0|1,0,1]=4 1920 B15R1.779 CC(=O)Oc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100010246728 [1,1,0,0,0,0|1,0,1]=4 1921 B15R1.779 CCNC(C)c1ccc(cc1)OC(=O)C 269862a_100015525214_100000001828 [1,1,0,0,0,0|1,0,1]=4 1922 B15R1.779 CNCC(=O)c1ccc(cc1)OC(=O)C 2230a_106832991635_100010246728 [1,1,0,0,0,0|1,0,1]=4 1923 B15R1.779 CSCC(=O)c1ccc(cc1)OC(=O)C 62a_100010246728_200000210301 [1,1,0,0,0,0|1,0,1]=4 1924 B15R1.779 CSCC(=O)c1ccc(cc1)OC(=O)C 62a_200000210301_100010246728 [1,1,0,0,0,0|1,0,1]=4 1925 B15R1.1059 C=CCSc1ccc(c(c1)F)OC(=O)C 62a_100000210623_100009811628 [1,1,0,0,0,0|1,0,1]=4 1926 B15R1.1059 C=CCSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000210623 [1,1,0,0,0,0|1,0,1]=4 1927 B15R1.1059 CC(=O)Cc1ccc(cc1Cl)OCC=O 34a_200000084595_200009817547 [1,1,0,0,0,0|2,0,0]=4 1928 B15R1.1059 CC(=O)Cc1ccc(cc1Cl)OCC=O 7a_200000084595_200015260668 [1,1,0,0,0,0|2,0,0]=4 1929 B15R1.1059 CC(=O)Nc1ccc(cc1C)NCC=O 34a_100000736504_200009817547 [1,1,0,0,0,0|2,0,0]=4 1930 B15R1.1059 CC(=O)Nc1ccc(cc1C)NCC=O 7a_100000736504_200015260668 [1,1,0,0,0,0|2,0,0]=4 1931 B15R1.1059 CC(=O)Nc1ccc(cc1C)SCC=O 62a_200015260668_100000152120 [1,1,0,0,0,0|2,0,0]=4 1932 B15R1.1059 CC(=O)Nc1ccc(cc1Cl)NCC=O 34a_100000244014_200009817547 [1,1,0,0,0,0|2,0,0]=4 1933 B15R1.1059 CC(=O)Nc1ccc(cc1Cl)NCC=O 7a_100000244014_200015260668 [1,1,0,0,0,0|2,0,0]=4 1934 B15R1.1059 CC(=O)Nc1ccc(cc1Cl)SCC=O 62a_200015260668_100011273303 [1,1,0,0,0,0|2,0,0]=4 1935 B15R1.1059 CC(=O)Nc1ccc(cc1F)SCC=O 62a_200015260668_100000155584 [1,1,0,0,0,0|2,0,0]=4 1936 B15R1.1059 CC(=O)Oc1ccc(cc1F)SCC=O 62a_100009811628_200015260668 [1,1,0,0,0,0|1,0,0]=3 1937 B15R1.1059 CC(=O)Oc1ccc(cc1F)SCC=O 62a_200015260668_100009811628 [1,1,0,0,0,0|1,0,0]=3 1938 B15R1.1059 CCCCc1ccc(c(c1)C)NC(=O)C 11a_200011219056_100015343762 [1,1,0,0,0,0|1,0,1]=4 1939 B15R1.1059 CCCCc1ccc(c(c1)C)NC(=O)C 1626a_200011219056_100015343762 [1,1,0,0,0,0|1,0,1]=4 1940 B15R1.1059 CCCCc1ccc(c(c1)C)NC(=O)C 22a_200011219056_100000070787 [1,1,0,0,0,0|1,0,1]=4 1941 B15R1.1059 CCCCc1ccc(c(c1)C)NC(=O)C 271570a_100020621405_100000152120 [1,1,0,0,0,0|1,0,1]=4 1942 B15R1.1059 CCCCc1ccc(c(c1)C)NC(=O)C 527a_200011219056_100103153847 [1,1,0,0,0,0|1,0,1]=4 1943 B15R1.1059 CCCCc1ccc(c(c1)Cl)NC(=O)C 271570a_100020621405_100011273303 [1,1,0,0,0,0|1,0,1]=4 1944 B15R1.1059 CCCCc1ccc(c(c1)F)NC(=O)C 271570a_100020621405_100000155584 [1,1,0,0,0,0|1,0,1]=4 1945 B15R1.1059 CCCCc1ccc(c(c1)F)OC(=O)C 271570a_100020621405_100009811628 [1,1,0,0,0,0|0,0,1]=3 1946 B15R1.1059 CCCCc1ccc(c(c1)N)NC(=O)C 271570a_100020621405_100000749274 [1,1,0,0,0,0|1,0,1]=4 1947 B15R1.1059 CCCSc1ccc(c(c1)F)OC(=O)C 62a_100000210303_100009811628 [1,1,0,0,0,0|1,0,1]=4 1948 B15R1.1059 CCCSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000210303 [1,1,0,0,0,0|1,0,1]=4 1949 B15R1.1059 COCSc1ccc(c(c1)F)OC(=O)C 62a_100000766300_100009811628 [1,1,0,0,0,0|2,0,0]=4 1950 B15R1.1059 COCSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000766300 [1,1,0,0,0,0|2,0,0]=4 1951 B15R1.1059 CSCSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100011218213 [1,1,0,0,0,0|2,0,0]=4 1952 B15R1.1059 CSCSc1ccc(c(c1)F)OC(=O)C 62a_100011218213_100009811628 [1,1,0,0,0,0|2,0,0]=4 1953 B15R1.2997 C=CC(C)Sc1ccc(cc1)OC(=O)C 62a_100011215867_100000002173 [1,1,0,0,0,0|1,0,1]=4 1954 B15R1.2997 CCC(C)Sc1ccc(cc1)OC(=O)C 62a_100000758301_100000002173 [1,1,0,0,0,0|1,0,1]=4 1955 B15R1.2997 CCN(C)Cc1ccc(cc1)OC(=O)C 2230a_100000225621_100000033664 [1,1,0,0,0,0|1,0,1]=4 1956 B15R1.2997 CCN(C)Cc1ccc(cc1)OC(=O)C 269982a_100000225621_100000033664 [1,1,0,0,0,0|1,0,1]=4 1957 B15R1.2997 CNC(C)Cc1ccc(cc1)NC(=O)C 270004a_106832991635_200000079293 [1,1,0,0,0,0|2,0,0]=4 1958 B15R1.2997 COC(C)Sc1ccc(cc1)OC(=O)C 62a_100009879195_100000002173 [1,1,0,0,0,0|2,0,0]=4 1959 B15R1.15 CC=Cc1ccc(cc1)C(=O)CC(=O)C 271570a_100016259895_100000184285 [1,1,0,0,0,0|1,0,1]=4 1960 B15R1.15 CC=Cc1ccc(cc1)C(C)NC(=O)C 271570a_100016259895_100000153805 [1,1,0,0,0,0|2,0,0]=4 1961 B15R1.15 CCOc1ccc(cc1)C(=O)CC(=O)C 1458a_100000070787_100000203716 [1,1,0,0,0,0|0,0,2]=4 1962 B15R1.15 CCOc1ccc(cc1)C(C)NC(=O)C 11a_100000740525_100015343762 [1,1,0,0,0,0|1,0,1]=4 1963 B15R1.15 CCOc1ccc(cc1)C(C)NC(=O)C 1626a_100000740525_100015343762 [1,1,0,0,0,0|1,0,1]=4 1964 B15R1.15 CCOc1ccc(cc1)C(C)NC(=O)C 240690a_100000740525_100015343762 [1,1,0,0,0,0|1,0,1]=4 1965 B15R1.15 CCOc1ccc(cc1)C(C)NC(=O)C 527a_100000740525_100103153847 [1,1,0,0,0,0|1,0,1]=4 1966 B15R1.16 C/C=C/c1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100016259036 [1,1,0,0,0,0|2,0,0]=4 1967 B15R1.16 C/C=C/c1ccc(cc1)SC(C)C(=O)C 62a_100016259036_100009814033 [1,1,0,0,0,0|2,0,0]=4 1968 B15R1.16 C=COc1ccc(cc1)SC(C)C(=O)C 62a_100000704263_100009814033 [1,1,0,0,0,0|1,0,1]=4 1969 B15R1.16 C=COc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000704263 [1,1,0,0,0,0|1,0,1]=4 1970 B15R1.16 CC(=O)C(C)Sc1ccc(cc1)CC=O 62a_100009814033_100011361690 [1,1,0,0,0,0|2,0,0]=4 1971 B15R1.16 CC(=O)C(C)Sc1ccc(cc1)CC=O 62a_100011361690_100009814033 [1,1,0,0,0,0|2,0,0]=4 1972 B15R1.16 CCOc1ccc(cc1)CN(C)C(=O)C 11a_100000180828_100015343762 [1,1,0,0,0,0|1,0,1]=4 1973 B15R1.16 CCOc1ccc(cc1)CN(C)C(=O)C 1626a_100000180828_100015343762 [1,1,0,0,0,0|1,0,1]=4 1974 B15R1.16 CCOc1ccc(cc1)CN(C)C(=O)C 240690a_100000180828_100015343762 [1,1,0,0,0,0|1,0,1]=4 1975 B15R1.16 CCOc1ccc(cc1)CN(C)C(=O)C 527a_100000180828_100103153847 [1,1,0,0,0,0|1,0,1]=4 1976 B15R1.16 CCOc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_100000210202 [1,1,0,0,0,0|1,0,1]=4 1977 B15R1.16 CCOc1ccc(cc1)NC(C)C(=O)C 2230a_100000739623_100009814033 [1,1,0,0,0,0|1,0,1]=4 1978 B15R1.16 CCOc1ccc(cc1)OC(C)C(=O)C 1458a_100000246031_200000210301 [1,1,0,0,0,0|1,0,1]=4 1979 B15R1.16 CCOc1ccc(cc1)OC(C)C(=O)[13CH3] 1458a_100000246031_200025704644 [1,1,0,0,0,0|1,0,1]=4 1980 B15R1.16 CCOc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000171712 [1,1,0,0,0,0|1,0,1]=4 1981 B15R1.18 C/C=C/c1ccc(cc1)SCC(=O)CC 62a_100000747405_100016259036 [1,1,0,0,0,0|2,0,0]=4 1982 B15R1.18 C/C=C/c1ccc(cc1)SCC(=O)CC 62a_100016259036_100000747405 [1,1,0,0,0,0|2,0,0]=4 1983 B15R1.18 C/C=C/c1ccc(cc1)SCC(=O)NC 62a_100000183359_100016259036 [1,1,0,0,0,0|2,0,0]=4 1984 B15R1.18 C/C=C/c1ccc(cc1)SCC(=O)NC 62a_100016259036_100000183359 [1,1,0,0,0,0|2,0,0]=4 1985 B15R1.18 C/C=C/c1ccc(cc1)SCC(=O)OC 62a_100000747449_100016259036 [1,1,0,0,0,0|2,0,0]=4 1986 B15R1.18 C/C=C/c1ccc(cc1)SCC(=O)OC 62a_100016259036_100000747449 [1,1,0,0,0,0|2,0,0]=4 1987 B15R1.18 C=COc1ccc(cc1)SCC(=O)CC 62a_100000704263_100000747405 [1,1,0,0,0,0|1,0,1]=4 1988 B15R1.18 C=COc1ccc(cc1)SCC(=O)CC 62a_100000747405_100000704263 [1,1,0,0,0,0|1,0,1]=4 1989 B15R1.18 C=COc1ccc(cc1)SCC(=O)NC 62a_100000183359_100000704263 [1,1,0,0,0,0|1,0,1]=4 1990 B15R1.18 C=COc1ccc(cc1)SCC(=O)NC 62a_100000704263_100000183359 [1,1,0,0,0,0|1,0,1]=4 1991 B15R1.18 C=COc1ccc(cc1)SCC(=O)OC 62a_100000704263_100000747449 [1,1,0,0,0,0|1,0,1]=4 1992 B15R1.18 C=COc1ccc(cc1)SCC(=O)OC 62a_100000747449_100000704263 [1,1,0,0,0,0|1,0,1]=4 1993 B15R1.18 CC=Cc1ccc(cc1)CCC(=O)NC 271570a_100016259895_200010273138 [1,1,0,0,0,0|1,0,0]=3 1994 B15R1.18 CC=Cc1ccc(cc1)CCC(=O)OC 271570a_100016259895_100012357364 [1,1,0,0,0,0|1,0,0]=3 1995 B15R1.18 CC=Cc1ccc(cc1)OCC(=O)NC 271570a_100016259895_200000150405 [1,1,0,0,0,0|2,0,0]=4 1996 B15R1.18 CC=Cc1ccc(cc1)OCC(=O)OC 271570a_100016259895_100000149925 [1,1,0,0,0,0|2,0,0]=4 1997 B15R1.18 CCC(=O)CSc1ccc(cc1)CC=O 62a_100000747405_100011361690 [1,1,0,0,0,0|2,0,0]=4 1998 B15R1.18 CCC(=O)CSc1ccc(cc1)CC=O 62a_100011361690_100000747405 [1,1,0,0,0,0|2,0,0]=4 1999 B15R1.18 CCOc1ccc(cc1)CCC(=O)CC 1458a_100000743745_100000210202 [1,1,0,0,0,0|0,0,1]=3 2000 B15R1.18 CCOc1ccc(cc1)CCC(=O)CF 1458a_100000743745_100015361967 [1,1,0,0,0,0|0,0,1]=3 2001 B15R1.18 CCOc1ccc(cc1)CCC(=O)NC 11a_106832991635_100000743745 [1,1,0,0,0,0|0,0,1]=3 2002 B15R1.18 CCOc1ccc(cc1)CCC(=O)NC 1626a_100102657272_100000743745 [1,1,0,0,0,0|0,0,1]=3 2003 B15R1.18 CCOc1ccc(cc1)CCC(=O)NC 240690a_100102657272_100000743745 [1,1,0,0,0,0|0,0,1]=3 2004 B15R1.18 CCOc1ccc(cc1)CCC(=O)NC 527a_100102657272_100000743745 [1,1,0,0,0,0|0,0,1]=3 2005 B15R1.18 CCOc1ccc(cc1)CCC(=O)NN 34a_100000048474_100000210202 [1,1,0,0,0,0|1,0,1]=4 2006 B15R1.18 CCOc1ccc(cc1)CCC(=O)OC 34a_100000032826_100000210202 [1,1,0,0,0,0|0,0,1]=3 2007 B15R1.18 CCOc1ccc(cc1)CCC(=O)OC 7a_100000032826_100000210202 [1,1,0,0,0,0|0,0,1]=3 2008 B15R1.18 CCOc1ccc(cc1)CNC(=O)CC 11a_100000185588_100000210414 [1,1,0,0,0,0|1,0,1]=4 2009 B15R1.18 CCOc1ccc(cc1)CNC(=O)CC 1626a_100000185588_100000210414 [1,1,0,0,0,0|1,0,1]=4 2010 B15R1.18 CCOc1ccc(cc1)CNC(=O)CC 240690a_100000185588_100000210414 [1,1,0,0,0,0|1,0,1]=4 2011 B15R1.18 CCOc1ccc(cc1)CNC(=O)CC 527a_100000185588_100000210414 [1,1,0,0,0,0|1,0,1]=4 2012 B15R1.18 CCOc1ccc(cc1)CNC(=O)CO 240690a_100000185588_100000210174 [1,1,0,0,0,0|1,0,1]=4 2013 B15R1.18 CCOc1ccc(cc1)CNC(=O)CO 527a_100000185588_100000210174 [1,1,0,0,0,0|1,0,1]=4 2014 B15R1.18 CCOc1ccc(cc1)CNC(=O)NC 2708a_100000185588_106832991635 [1,1,0,0,0,0|1,0,1]=4 2015 B15R1.18 CCOc1ccc(cc1)CNC(=O)NC 2708a_100102657272_100000185588 [1,1,0,0,0,0|1,0,1]=4 2016 B15R1.18 CCOc1ccc(cc1)CNC(=O)NC 273464a_100000185588_100102657272 [1,1,0,0,0,0|1,0,1]=4 2017 B15R1.18 CCOc1ccc(cc1)CNC(=O)NC 273464a_100102657272_100000185588 [1,1,0,0,0,0|1,0,1]=4 2018 B15R1.18 CCOc1ccc(cc1)CNC(=O)NC 512a_106832991638_100000185588 [1,1,0,0,0,0|1,0,1]=4 2019 B15R1.18 CCOc1ccc(cc1)NCC(=O)NC 2230a_100000739623_100000183359 [1,1,0,0,0,0|1,0,1]=4 2020 B15R1.18 CCOc1ccc(cc1)NCC(=O)NC 34a_100000739623_100000183359 [1,1,0,0,0,0|1,0,1]=4 2021 B15R1.18 CCOc1ccc(cc1)NCC(=O)OC 2230a_100000739623_100000747449 [1,1,0,0,0,0|1,0,1]=4 2022 B15R1.18 CCOc1ccc(cc1)NCC(=O)OC 34a_100000739623_100000747449 [1,1,0,0,0,0|1,0,1]=4 2023 B15R1.18 CCOc1ccc(cc1)NCC(=O)OC 34a_100016989482_100000210202 [1,1,0,0,0,0|1,0,1]=4 2024 B15R1.18 CCOc1ccc(cc1)OCC(=O)CC 1458a_100000183567_100000210202 [1,1,0,0,0,0|1,0,1]=4 2025 B15R1.18 CCOc1ccc(cc1)OCC(=O)CF 1458a_100000183567_100015361967 [1,1,0,0,0,0|1,0,1]=4 2026 B15R1.18 CCOc1ccc(cc1)OCC(=O)NC 11a_106832991635_100000183567 [1,1,0,0,0,0|1,0,1]=4 2027 B15R1.18 CCOc1ccc(cc1)OCC(=O)NC 1626a_100102657272_100000183567 [1,1,0,0,0,0|1,0,1]=4 2028 B15R1.18 CCOc1ccc(cc1)OCC(=O)NC 240690a_100102657272_100000183567 [1,1,0,0,0,0|1,0,1]=4 2029 B15R1.18 CCOc1ccc(cc1)OCC(=O)NC 34a_100000185467_100000183359 [1,1,0,0,0,0|1,0,1]=4 2030 B15R1.18 CCOc1ccc(cc1)OCC(=O)NC 527a_100102657272_100000183567 [1,1,0,0,0,0|1,0,1]=4 2031 B15R1.18 CCOc1ccc(cc1)OCC(=O)OC 34a_100000185467_100000747449 [1,1,0,0,0,0|1,0,1]=4 2032 B15R1.18 CCOc1ccc(cc1)SCC(=O)CC 1458a_100000016182_100000210202 [1,1,0,0,0,0|1,0,1]=4 2033 B15R1.18 CCOc1ccc(cc1)SCC(=O)CC 62a_100000747405_100000171712 [1,1,0,0,0,0|1,0,1]=4 2034 B15R1.18 CCOc1ccc(cc1)SCC(=O)CF 1458a_100000016182_100015361967 [1,1,0,0,0,0|1,0,1]=4 2035 B15R1.18 CCOc1ccc(cc1)SCC(=O)NC 11a_106832991635_100000016182 [1,1,0,0,0,0|1,0,1]=4 2036 B15R1.18 CCOc1ccc(cc1)SCC(=O)NC 1626a_100102657272_100000016182 [1,1,0,0,0,0|1,0,1]=4 2037 B15R1.18 CCOc1ccc(cc1)SCC(=O)NC 240690a_100102657272_100000016182 [1,1,0,0,0,0|1,0,1]=4 2038 B15R1.18 CCOc1ccc(cc1)SCC(=O)NC 527a_100102657272_100000016182 [1,1,0,0,0,0|1,0,1]=4 2039 B15R1.18 CCOc1ccc(cc1)SCC(=O)NC 62a_100000183359_100000171712 [1,1,0,0,0,0|1,0,1]=4 2040 B15R1.18 CCOc1ccc(cc1)SCC(=O)OC 62a_100000747449_100000171712 [1,1,0,0,0,0|1,0,1]=4 2041 B15R1.18 CCSc1ccc(cc1)CCC(=O)NC 62a_100000210202_200010273138 [1,1,0,0,0,0|0,1,1]=4 2042 B15R1.18 CCSc1ccc(cc1)CCC(=O)NC 62a_200010273138_100000210202 [1,1,0,0,0,0|0,1,1]=4 2043 B15R1.18 CCSc1ccc(cc1)CCC(=O)OC 62a_100000210202_100012357364 [1,1,0,0,0,0|0,1,1]=4 2044 B15R1.18 CCSc1ccc(cc1)CCC(=O)OC 62a_100012357364_100000210202 [1,1,0,0,0,0|0,1,1]=4 2045 B15R1.18 CNC(=O)CSc1ccc(cc1)CC=O 62a_100000183359_100011361690 [1,1,0,0,0,0|2,0,0]=4 2046 B15R1.18 CNC(=O)CSc1ccc(cc1)CC=O 62a_100011361690_100000183359 [1,1,0,0,0,0|2,0,0]=4 2047 B15R1.18 COC(=O)CCc1ccc(cc1)OCF 34a_100000032826_100015361967 [1,1,0,0,0,0|1,0,1]=4 2048 B15R1.18 COC(=O)CCc1ccc(cc1)OCF 7a_100000032826_100015361967 [1,1,0,0,0,0|1,0,1]=4 2049 B15R1.18 COC(=O)CSc1ccc(cc1)CC=O 62a_100000747449_100011361690 [1,1,0,0,0,0|2,0,0]=4 2050 B15R1.18 COC(=O)CSc1ccc(cc1)CC=O 62a_100011361690_100000747449 [1,1,0,0,0,0|2,0,0]=4 2051 B15R1.56 C#CCOc1ccc(cc1)CCC(=O)C 34a_100000198047_100000184674 [1,1,0,0,0,0|0,0,2]=4 2052 B15R1.56 C#CCOc1ccc(cc1)CCC(=O)C 7a_100000198047_100000038162 [1,1,0,0,0,0|0,0,2]=4 2053 B15R1.56 C=CCOc1ccc(cc1)CCC(=O)C 34a_100000198047_100015514636 [1,1,0,0,0,0|0,0,1]=3 2054 B15R1.56 C=CCOc1ccc(cc1)CCC(=O)C 7a_100000198047_100015514636 [1,1,0,0,0,0|0,0,1]=3 2055 B15R1.56 C=CCSc1ccc(cc1)CCC(=O)C 62a_100000210623_100000723691 [1,1,0,0,0,0|0,1,1]=4 2056 B15R1.56 C=CCSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000210623 [1,1,0,0,0,0|0,1,1]=4 2057 B15R1.56 CC(=O)/C=C/c1ccc(cc1)OCC=O 34a_100000189429_200009817547 [1,1,0,0,0,0|0,0,2]=4 2058 B15R1.56 CC(=O)CCc1ccc(cc1)OCC#N 7a_100000198047_100011215382 [1,1,0,0,0,0|0,0,2]=4 2059 B15R1.56 CC(=O)CCc1ccc(cc1)OCC=O 34a_100000198047_200009817547 [1,1,0,0,0,0|0,0,0]=2 2060 B15R1.56 CC(=O)CCc1ccc(cc1)OCC=O 7a_100000198047_200015260668 [1,1,0,0,0,0|0,0,0]=2 2061 B15R1.56 CC(=O)CCc1ccc(cc1)OCCF 34a_100000198047_100011217306 [1,1,0,0,0,0|0,0,1]=3 2062 B15R1.56 CC(=O)CCc1ccc(cc1)OCCF 7a_100000198047_100011217306 [1,1,0,0,0,0|0,0,1]=3 2063 B15R1.56 CC(=O)CCc1ccc(cc1)OCCO 34a_100000198047_100000211926 [1,1,0,0,0,0|0,0,1]=3 2064 B15R1.56 CC(=O)CCc1ccc(cc1)OCCO 7a_100000198047_100000211926 [1,1,0,0,0,0|0,0,1]=3 2065 B15R1.56 CC(=O)CCc1ccc(cc1)SCC=O 62a_100000723691_200015260668 [1,1,0,0,0,0|0,1,0]=3 2066 B15R1.56 CC(=O)CCc1ccc(cc1)SCC=O 62a_200015260668_100000723691 [1,1,0,0,0,0|0,1,0]=3 2067 B15R1.56 CC(=O)CCc1ccc(cc1)SCCF 62a_100000723691_100011217306 [1,1,0,0,0,0|0,1,1]=4 2068 B15R1.56 CC(=O)CCc1ccc(cc1)SCCF 62a_100011217306_100000723691 [1,1,0,0,0,0|0,1,1]=4 2069 B15R1.56 CC(=O)CCc1ccc(cc1)SCCO 62a_100000211926_100000723691 [1,1,0,0,0,0|0,1,1]=4 2070 B15R1.56 CC(=O)CCc1ccc(cc1)SCCO 62a_100000723691_100000211926 [1,1,0,0,0,0|0,1,1]=4 2071 B15R1.56 CC(=O)NCc1ccc(cc1)NCC=O 34a_100000755463_200009817547 [1,1,0,0,0,0|2,0,0]=4 2072 B15R1.56 CC(=O)NCc1ccc(cc1)SCC=O 62a_200000685173_200015260668 [1,1,0,0,0,0|1,1,0]=4 2073 B15R1.56 CC(=O)NCc1ccc(cc1)SCC=O 62a_200015260668_200000685173 [1,1,0,0,0,0|1,1,0]=4 2074 B15R1.56 CC(O)CCc1ccc(cc1)OCC=O 34a_100000189425_200009817547 [1,1,0,0,0,0|0,0,2]=4 2075 B15R1.56 CC(O)CCc1ccc(cc1)OCC=O 7a_100000189425_200015260668 [1,1,0,0,0,0|0,0,2]=4 2076 B15R1.56 CCCCc1ccc(cc1)CCC(=O)C 271570a_100020621405_100000723691 [1,1,0,0,0,0|1,0,1]=4 2077 B15R1.56 CCCOc1ccc(cc1)CCC(=O)C 1458a_100000764288_200000210301 [1,1,0,0,0,0|0,0,1]=3 2078 B15R1.56 CCCOc1ccc(cc1)CCC(=O)C 34a_100000198047_100000210303 [1,1,0,0,0,0|0,0,1]=3 2079 B15R1.56 CCCOc1ccc(cc1)CCC(=O)C 7a_100000198047_100000210303 [1,1,0,0,0,0|0,0,1]=3 2080 B15R1.56 CCCOc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000764288_200025704644 [1,1,0,0,0,0|0,0,1]=3 2081 B15R1.56 CCCOc1ccc(cc1)OCC(=O)C 1458a_100000203797_200000210301 [1,1,0,0,0,0|1,0,1]=4 2082 B15R1.56 CCCOc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000203797_200025704644 [1,1,0,0,0,0|1,0,1]=4 2083 B15R1.56 CCCSc1ccc(cc1)CCC(=O)C 62a_100000210303_100000723691 [1,1,0,0,0,0|0,1,1]=4 2084 B15R1.56 CCCSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000210303 [1,1,0,0,0,0|0,1,1]=4 2085 B15R1.56 CCOCc1ccc(cc1)CNC(=O)C 11a_100000737407_100015343762 [1,1,0,0,0,0|1,0,1]=4 2086 B15R1.56 CCOCc1ccc(cc1)CNC(=O)C 1626a_100000737407_100015343762 [1,1,0,0,0,0|1,0,1]=4 2087 B15R1.56 CCOCc1ccc(cc1)CNC(=O)C 240690a_100000737407_100015343762 [1,1,0,0,0,0|1,0,1]=4 2088 B15R1.56 CCOCc1ccc(cc1)CNC(=O)C 527a_100000737407_100103153847 [1,1,0,0,0,0|1,0,1]=4 2089 B15R1.56 COCSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000766300 [1,1,0,0,0,0|0,1,1]=4 2090 B15R1.56 COCSc1ccc(cc1)CCC(=O)C 62a_100000766300_100000723691 [1,1,0,0,0,0|0,1,1]=4 2091 B15R1.56 CSCOc1ccc(cc1)CCC(=O)C 34a_100000198047_100011218213 [1,1,0,0,0,0|0,0,1]=3 2092 B15R1.56 CSCSc1ccc(cc1)CCC(=O)C 62a_100000723691_100011218213 [1,1,0,0,0,0|0,1,1]=4 2093 B15R1.56 CSCSc1ccc(cc1)CCC(=O)C 62a_100011218213_100000723691 [1,1,0,0,0,0|0,1,1]=4 2094 B15R1.56 NC(=O)CCc1ccc(cc1)SCC=O 62a_200010110666_200015260668 [1,1,0,0,0,0|1,1,0]=4 2095 B15R1.56 NC(=O)CCc1ccc(cc1)SCC=O 62a_200015260668_200010110666 [1,1,0,0,0,0|1,1,0]=4 2096 B15R1.944 COC(=O)c1ccc(cc1)CCC(=O)C 1458a_100000070787_100010192280 [1,1,0,0,0,0|2,0,0]=4 2097 B15R1.944 COC(=O)c1ccc(cc1)CCC(=O)C 1458a_100000070832_200000210301 [1,1,0,0,0,0|2,0,0]=4 2098 B15R1.944 COC(=O)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000070832_200025704644 [1,1,0,0,0,0|2,0,0]=4 2099 B15R1.495 C=C(C)C(=O)Cc1ccc(cc1)C(=O)C 1458a_100000185857_100000756337 [0,1,0,0,1,0|1,0,1]=4 2100 B15R1.495 C=C(C)c1ccc(cc1)OC(C)C(=O)C 7a_100009880102_100000179758 [0,1,0,0,1,0|2,0,0]=4 2101 B15R1.495 C=C(C)c1ccc(cc1)SC(C)C(=O)C 62a_100000185454_100009814033 [0,1,0,0,1,0|2,0,0]=4 2102 B15R1.495 C=C(C)c1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000185454 [0,1,0,0,1,0|2,0,0]=4 2103 B15R1.495 CC(=O)C(C)Oc1ccc(cc1)C(=O)N 7a_100000746352_100000179758 [0,1,0,0,1,0|2,0,0]=4 2104 B15R1.495 CC(=O)C(C)Oc1ccc(cc1)S(=O)C 7a_200000064373_100000179758 [0,1,0,0,1,0|2,0,0]=4 2105 B15R1.495 CC(=O)C(C)Sc1ccc(cc1)C(=O)N 62a_100000162191_100009814033 [0,1,0,0,1,0|2,0,0]=4 2106 B15R1.495 CC(=O)C(C)Sc1ccc(cc1)C(=O)N 62a_100009814033_100000162191 [0,1,0,0,1,0|2,0,0]=4 2107 B15R1.495 CC(=O)C(C)Sc1ccc(cc1)S(=O)C 62a_100009816266_100009814033 [0,1,0,0,1,0|2,0,0]=4 2108 B15R1.495 CC(=O)c1ccc(cc1)OC(C)C(=O)C 7a_100000185113_100000179758 [0,1,0,0,1,0|1,0,0]=3 2109 B15R1.495 CC(=O)c1ccc(cc1)OC(C)C(=O)N 34a_100000185113_100000702099 [0,1,0,0,1,0|2,0,0]=4 2110 B15R1.495 CC(=O)c1ccc(cc1)OC(C)C(=O)N 7a_100000185113_100000702099 [0,1,0,0,1,0|2,0,0]=4 2111 B15R1.495 CC(=O)c1ccc(cc1)OC(F)C(=O)N 34a_100000185113_100009813875 [0,1,0,0,1,0|2,0,0]=4 2112 B15R1.495 CC(=O)c1ccc(cc1)OC(F)C(=O)N 7a_100000185113_100009813875 [0,1,0,0,1,0|2,0,0]=4 2113 B15R1.495 CC(=O)c1ccc(cc1)OC(F)C(=O)[O-] 34a_100000185113_100020610796 [0,1,0,0,1,0|2,0,0]=4 2114 B15R1.495 CC(=O)c1ccc(cc1)SC(C)C(=O)C 62a_100000185465_100009814033 [0,1,0,0,1,0|1,0,0]=3 2115 B15R1.495 CC(=O)c1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000185465 [0,1,0,0,1,0|1,0,0]=3 2116 B15R1.495 CC(=O)c1ccc(cc1)SC(C)C(=O)N 62a_100000185465_100000702099 [0,1,0,0,1,0|2,0,0]=4 2117 B15R1.495 CC(=O)c1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000185465 [0,1,0,0,1,0|2,0,0]=4 2118 B15R1.495 CC(=O)c1ccc(cc1)SC(F)C(=O)N 62a_100000185465_100009813875 [0,1,0,0,1,0|2,0,0]=4 2119 B15R1.495 CC(=O)c1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100000185465 [0,1,0,0,1,0|2,0,0]=4 2120 B15R1.495 CC(=O)c1ccc(cc1)SC(F)C(=O)[O-] 62a_100000185465_100020610796 [0,1,0,0,1,0|2,0,0]=4 2121 B15R1.495 CC(=O)c1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100000185465 [0,1,0,0,1,0|2,0,0]=4 2122 B15R1.495 CC(=O)c1ccc(cn1)OC(C)C(=O)C 7a_100012001710_100000179758 [0,1,0,0,1,0|2,0,0]=4 2123 B15R1.495 CC(=O)c1ccc(cn1)SC(C)C(=O)C 62a_100000686046_100009814033 [0,1,0,0,1,0|2,0,0]=4 2124 B15R1.495 CC(=O)c1ccc(cn1)SC(C)C(=O)C 62a_100009814033_100000686046 [0,1,0,0,1,0|2,0,0]=4 2125 B15R1.495 CC(=O)c1ccc(nc1)SC(C)C(=O)C 62a_100000684857_100009814033 [0,1,0,0,1,0|2,0,0]=4 2126 B15R1.495 CC(=O)c1ccc(nc1)SC(C)C(=O)C 62a_100009814033_100000684857 [0,1,0,0,1,0|2,0,0]=4 2127 B15R1.498 CC(=O)CCc1ccc(cc1)C(C)(C)C 1458a_100000198556_200000210301 [0,1,0,0,1,0|1,0,1]=4 2128 B15R1.498 CC(=O)CCc1ccc(cc1)S(=O)(=O)C 1458a_100011217083_200000210301 [0,1,0,0,1,0|1,0,0]=3 2129 B15R1.498 CC(=O)CCc1ccc(cc1)S(=O)(=O)N 1458a_100000191195_200000210301 [0,1,0,0,1,0|2,0,0]=4 2130 B15R1.498 CC(=O)CCc1ccc(cc1)S(=O)(=O)[O-] 1458a_100000070787_100010175982 [0,1,0,0,1,0|2,0,0]=4 2131 B15R1.498 CC(=O)COc1ccc(cc1)S(=O)(=O)C 1458a_100000695947_200000210301 [0,1,0,0,1,0|2,0,0]=4 2132 B15R1.498 CC(=O)NCc1ccc(cc1)S(=O)(=O)C 11a_100000745609_100015343762 [0,1,0,0,1,0|2,0,0]=4 2133 B15R1.498 CC(=O)NCc1ccc(cc1)S(=O)(=O)C 1626a_100000745609_100015343762 [0,1,0,0,1,0|2,0,0]=4 2134 B15R1.498 CC(=O)NCc1ccc(cc1)S(=O)(=O)C 240690a_100000745609_100015343762 [0,1,0,0,1,0|2,0,0]=4 2135 B15R1.498 CC(=O)NCc1ccc(cc1)S(=O)(=O)C 527a_100000745609_100103153847 [0,1,0,0,1,0|2,0,0]=4 2136 B15R1.498 CC(C)(C)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000198556_200025704644 [0,1,0,0,1,0|1,0,1]=4 2137 B15R1.498 CS(=O)(=O)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100011217083_200025704644 [0,1,0,0,1,0|1,0,0]=3 2138 B15R1.498 CS(=O)(=O)c1ccc(cc1)OCC(=O)[13CH3] 1458a_100000695947_200025704644 [0,1,0,0,1,0|2,0,0]=4 2139 B15R1.498 [13CH3]C(=O)CCc1ccc(cc1)S(=O)(=O)N 1458a_100000191195_200025704644 [0,1,0,0,1,0|2,0,0]=4 2140 B15R1.956 C#CC(=O)CCc1ccc(cc1)C(=O)C 1458a_100000211873_200000038727 [0,1,0,0,1,0|0,0,1]=3 2141 B15R1.956 C=C(C)c1ccc(cc1)CCC(=O)NC 271570a_100000694244_200010273138 [0,1,0,0,1,0|1,0,0]=3 2142 B15R1.956 C=C(C)c1ccc(cc1)CCC(=O)OC 271570a_100000694244_100012357364 [0,1,0,0,1,0|1,0,0]=3 2143 B15R1.956 C=C(C)c1ccc(cc1)OCC(=O)CC 7a_100009880102_100000747405 [0,1,0,0,1,0|2,0,0]=4 2144 B15R1.956 C=C(C)c1ccc(cc1)OCC(=O)NC 271570a_100000694244_200000150405 [0,1,0,0,1,0|2,0,0]=4 2145 B15R1.956 C=C(C)c1ccc(cc1)OCC(=O)NC 34a_100009880102_100000183359 [0,1,0,0,1,0|2,0,0]=4 2146 B15R1.956 C=C(C)c1ccc(cc1)OCC(=O)NC 7a_100009880102_100000183359 [0,1,0,0,1,0|2,0,0]=4 2147 B15R1.956 C=C(C)c1ccc(cc1)OCC(=O)OC 271570a_100000694244_100000149925 [0,1,0,0,1,0|2,0,0]=4 2148 B15R1.956 C=C(C)c1ccc(cc1)OCC(=O)OC 34a_100009880102_100000747449 [0,1,0,0,1,0|2,0,0]=4 2149 B15R1.956 C=C(C)c1ccc(cc1)OCC(=O)OC 7a_100009880102_100000747449 [0,1,0,0,1,0|2,0,0]=4 2150 B15R1.956 C=C(C)c1ccc(cc1)SCC(=O)CC 62a_100000185454_100000747405 [0,1,0,0,1,0|2,0,0]=4 2151 B15R1.956 C=C(C)c1ccc(cc1)SCC(=O)CC 62a_100000747405_100000185454 [0,1,0,0,1,0|2,0,0]=4 2152 B15R1.956 C=C(C)c1ccc(cc1)SCC(=O)NC 62a_100000183359_100000185454 [0,1,0,0,1,0|2,0,0]=4 2153 B15R1.956 C=C(C)c1ccc(cc1)SCC(=O)NC 62a_100000185454_100000183359 [0,1,0,0,1,0|2,0,0]=4 2154 B15R1.956 C=C(C)c1ccc(cc1)SCC(=O)OC 62a_100000185454_100000747449 [0,1,0,0,1,0|2,0,0]=4 2155 B15R1.956 C=C(C)c1ccc(cc1)SCC(=O)OC 62a_100000747449_100000185454 [0,1,0,0,1,0|2,0,0]=4 2156 B15R1.956 C=CC(=O)CCc1ccc(cc1)C(=O)C 1458a_100000185746_200000038727 [0,1,0,0,1,0|0,0,1]=3 2157 B15R1.956 C=CC(=O)NCc1ccc(cc1)C(=O)C 1458a_100000743446_200000210301 [0,1,0,0,1,0|1,0,1]=4 2158 B15R1.956 C=CC(=O)NCc1ccc(cc1)C(=O)[13CH3] 1458a_100000743446_200025704644 [0,1,0,0,1,0|1,0,1]=4 2159 B15R1.956 CC(=O)c1ccc(cc1)CCC(=O)CO 1458a_100000210174_200000038727 [0,1,0,0,1,0|0,0,0]=2 2160 B15R1.956 CC(C)c1ccc(cc1)CCC(=O)CF 1458a_100000234928_100015361967 [0,1,0,0,1,0|1,0,1]=4 2161 B15R1.956 CCC(=O)CCc1ccc(cc1)C(=O)C 1458a_100000210414_200000038727 [0,1,0,0,1,0|0,0,0]=2 2162 B15R1.956 CCC(=O)CCc1ccc(cc1)C(C)C 1458a_100000234928_100000210202 [0,1,0,0,1,0|1,0,1]=4 2163 B15R1.956 CCC(=O)CCc1ccc(cc1)N(C)C 1458a_100000205957_100000210202 [0,1,0,0,1,0|2,0,0]=4 2164 B15R1.956 CCC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000210414_100000736421 [0,1,0,0,1,0|2,0,0]=4 2165 B15R1.956 CCC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_100000210202 [0,1,0,0,1,0|2,0,0]=4 2166 B15R1.956 CCC(=O)COc1ccc(cc1)C(=O)C 7a_100000185113_100000747405 [0,1,0,0,1,0|1,0,0]=3 2167 B15R1.956 CCC(=O)COc1ccc(cc1)C(=O)N 7a_100000746352_100000747405 [0,1,0,0,1,0|2,0,0]=4 2168 B15R1.956 CCC(=O)COc1ccc(cc1)S(=O)C 7a_200000064373_100000747405 [0,1,0,0,1,0|2,0,0]=4 2169 B15R1.956 CCC(=O)COc1ccc(nc1)C(=O)C 7a_100012001710_100000747405 [0,1,0,0,1,0|2,0,0]=4 2170 B15R1.956 CCC(=O)CSc1ccc(cc1)C(=O)C 62a_100000185465_100000747405 [0,1,0,0,1,0|1,0,0]=3 2171 B15R1.956 CCC(=O)CSc1ccc(cc1)C(=O)C 62a_100000747405_100000185465 [0,1,0,0,1,0|1,0,0]=3 2172 B15R1.956 CCC(=O)CSc1ccc(cc1)C(=O)N 62a_100000162191_100000747405 [0,1,0,0,1,0|2,0,0]=4 2173 B15R1.956 CCC(=O)CSc1ccc(cc1)C(=O)N 62a_100000747405_100000162191 [0,1,0,0,1,0|2,0,0]=4 2174 B15R1.956 CCC(=O)CSc1ccc(cc1)S(=O)C 62a_100009816266_100000747405 [0,1,0,0,1,0|2,0,0]=4 2175 B15R1.956 CCC(=O)CSc1ccc(cn1)C(=O)C 62a_100000684857_100000747405 [0,1,0,0,1,0|2,0,0]=4 2176 B15R1.956 CCC(=O)CSc1ccc(cn1)C(=O)C 62a_100000747405_100000684857 [0,1,0,0,1,0|2,0,0]=4 2177 B15R1.956 CCC(=O)CSc1ccc(nc1)C(=O)C 62a_100000686046_100000747405 [0,1,0,0,1,0|2,0,0]=4 2178 B15R1.956 CCC(=O)CSc1ccc(nc1)C(=O)C 62a_100000747405_100000686046 [0,1,0,0,1,0|2,0,0]=4 2179 B15R1.956 CCC(=O)NCc1ccc(cc1)C(=O)N 11a_100000185037_100000210414 [0,1,0,0,1,0|2,0,0]=4 2180 B15R1.956 CCC(=O)NCc1ccc(cc1)C(=O)N 1626a_100000185037_100000210414 [0,1,0,0,1,0|2,0,0]=4 2181 B15R1.956 CCC(=O)NCc1ccc(cc1)C(=O)N 240690a_100000185037_100000210414 [0,1,0,0,1,0|2,0,0]=4 2182 B15R1.956 CCC(=O)NCc1ccc(cc1)C(=O)N 527a_100000185037_100000210414 [0,1,0,0,1,0|2,0,0]=4 2183 B15R1.956 CCN(C)CCc1ccc(cc1)C(=O)C 2230a_100000225621_200000038727 [0,1,0,0,1,0|2,0,0]=4 2184 B15R1.956 CCN(C)CCc1ccc(cc1)C(=O)C 269982a_100000225621_200000038727 [0,1,0,0,1,0|2,0,0]=4 2185 B15R1.956 CN(C)c1ccc(cc1)CCC(=O)CF 1458a_100000205957_100015361967 [0,1,0,0,1,0|2,0,0]=4 2186 B15R1.956 CNC(=O)CCc1ccc(cc1)C(C)C 11a_106832991635_100000234928 [0,1,0,0,1,0|1,0,1]=4 2187 B15R1.956 CNC(=O)CCc1ccc(cc1)C(C)C 1626a_100102657272_100000234928 [0,1,0,0,1,0|1,0,1]=4 2188 B15R1.956 CNC(=O)CCc1ccc(cc1)C(C)C 240690a_100102657272_100000234928 [0,1,0,0,1,0|1,0,1]=4 2189 B15R1.956 CNC(=O)CCc1ccc(cc1)C(C)C 527a_100102657272_100000234928 [0,1,0,0,1,0|1,0,1]=4 2190 B15R1.956 CNC(=O)CCc1ccc(cc1)N(C)C 11a_106832991635_100000205957 [0,1,0,0,1,0|2,0,0]=4 2191 B15R1.956 CNC(=O)CCc1ccc(cc1)N(C)C 1626a_100102657272_100000205957 [0,1,0,0,1,0|2,0,0]=4 2192 B15R1.956 CNC(=O)CCc1ccc(cc1)N(C)C 240690a_100102657272_100000205957 [0,1,0,0,1,0|2,0,0]=4 2193 B15R1.956 CNC(=O)CCc1ccc(cc1)N(C)C 527a_100102657272_100000205957 [0,1,0,0,1,0|2,0,0]=4 2194 B15R1.956 CNC(=O)CCc1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000741710 [0,1,0,0,1,0|2,0,0]=4 2195 B15R1.956 CNC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000741710 [0,1,0,0,1,0|2,0,0]=4 2196 B15R1.956 CNC(=O)CCc1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000741710 [0,1,0,0,1,0|2,0,0]=4 2197 B15R1.956 CNC(=O)CCc1ccc(cc1)[N+](=O)[O-] 527a_100102657272_100000741710 [0,1,0,0,1,0|2,0,0]=4 2198 B15R1.956 CNC(=O)CNc1ccc(cc1)C(=O)N 27a_100000693194_100000162191 [0,1,0,0,1,0|2,0,0]=4 2199 B15R1.956 CNC(=O)CNc1ccc(cc1)C(=O)N 34a_100000210537_100000183359 [0,1,0,0,1,0|2,0,0]=4 2200 B15R1.956 CNC(=O)CNc1ccc(cn1)C(=O)C 27a_100000693194_100000690552 [0,1,0,0,1,0|2,0,0]=4 2201 B15R1.956 CNC(=O)COc1ccc(cc1)C(=O)C 34a_100000185113_100000183359 [0,1,0,0,1,0|1,0,0]=3 2202 B15R1.956 CNC(=O)COc1ccc(cc1)C(=O)C 7a_100000185113_100000183359 [0,1,0,0,1,0|1,0,0]=3 2203 B15R1.956 CNC(=O)COc1ccc(cc1)C(=O)N 34a_100000746352_100000183359 [0,1,0,0,1,0|2,0,0]=4 2204 B15R1.956 CNC(=O)COc1ccc(cc1)C(=O)N 7a_100000746352_100000183359 [0,1,0,0,1,0|2,0,0]=4 2205 B15R1.956 CNC(=O)COc1ccc(cc1)S(=O)C 34a_200000064373_100000183359 [0,1,0,0,1,0|2,0,0]=4 2206 B15R1.956 CNC(=O)COc1ccc(cc1)S(=O)C 7a_200000064373_100000183359 [0,1,0,0,1,0|2,0,0]=4 2207 B15R1.956 CNC(=O)COc1ccc(nc1)C(=O)C 34a_100012001710_100000183359 [0,1,0,0,1,0|2,0,0]=4 2208 B15R1.956 CNC(=O)COc1ccc(nc1)C(=O)C 7a_100012001710_100000183359 [0,1,0,0,1,0|2,0,0]=4 2209 B15R1.956 CNC(=O)CSc1ccc(cc1)C(=O)C 62a_100000183359_100000185465 [0,1,0,0,1,0|1,0,0]=3 2210 B15R1.956 CNC(=O)CSc1ccc(cc1)C(=O)C 62a_100000185465_100000183359 [0,1,0,0,1,0|1,0,0]=3 2211 B15R1.956 CNC(=O)CSc1ccc(cc1)C(=O)N 62a_100000162191_100000183359 [0,1,0,0,1,0|2,0,0]=4 2212 B15R1.956 CNC(=O)CSc1ccc(cc1)C(=O)N 62a_100000183359_100000162191 [0,1,0,0,1,0|2,0,0]=4 2213 B15R1.956 CNC(=O)CSc1ccc(cc1)S(=O)C 62a_100009816266_100000183359 [0,1,0,0,1,0|2,0,0]=4 2214 B15R1.956 CNC(=O)CSc1ccc(cn1)C(=O)C 62a_100000183359_100000684857 [0,1,0,0,1,0|2,0,0]=4 2215 B15R1.956 CNC(=O)CSc1ccc(cn1)C(=O)C 62a_100000684857_100000183359 [0,1,0,0,1,0|2,0,0]=4 2216 B15R1.956 CNC(=O)CSc1ccc(nc1)C(=O)C 62a_100000183359_100000686046 [0,1,0,0,1,0|2,0,0]=4 2217 B15R1.956 CNC(=O)CSc1ccc(nc1)C(=O)C 62a_100000686046_100000183359 [0,1,0,0,1,0|2,0,0]=4 2218 B15R1.956 CNC(=O)NCc1ccc(cc1)C(=O)N 2708a_100000185037_106832991635 [0,1,0,0,1,0|2,0,0]=4 2219 B15R1.956 CNC(=O)NCc1ccc(cc1)C(=O)N 2708a_100102657272_100000185037 [0,1,0,0,1,0|2,0,0]=4 2220 B15R1.956 CNC(=O)NCc1ccc(cc1)C(=O)N 273464a_100000185037_100102657272 [0,1,0,0,1,0|2,0,0]=4 2221 B15R1.956 CNC(=O)NCc1ccc(cc1)C(=O)N 273464a_100102657272_100000185037 [0,1,0,0,1,0|2,0,0]=4 2222 B15R1.956 CNC(=O)NCc1ccc(cc1)C(=O)N 512a_106832991638_100000185037 [0,1,0,0,1,0|2,0,0]=4 2223 B15R1.956 COC(=O)CNc1ccc(cc1)C(=O)N 34a_100000210537_100000747449 [0,1,0,0,1,0|2,0,0]=4 2224 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)C 34a_100000185113_100000747449 [0,1,0,0,1,0|1,0,0]=3 2225 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)C 7a_100000185113_100000747449 [0,1,0,0,1,0|1,0,0]=3 2226 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)N 34a_100000746352_100000747449 [0,1,0,0,1,0|2,0,0]=4 2227 B15R1.956 COC(=O)COc1ccc(cc1)C(=O)N 7a_100000746352_100000747449 [0,1,0,0,1,0|2,0,0]=4 2228 B15R1.956 COC(=O)COc1ccc(cc1)S(=O)C 34a_200000064373_100000747449 [0,1,0,0,1,0|2,0,0]=4 2229 B15R1.956 COC(=O)COc1ccc(cc1)S(=O)C 7a_200000064373_100000747449 [0,1,0,0,1,0|2,0,0]=4 2230 B15R1.956 COC(=O)COc1ccc(nc1)C(=O)C 34a_100012001710_100000747449 [0,1,0,0,1,0|2,0,0]=4 2231 B15R1.956 COC(=O)COc1ccc(nc1)C(=O)C 7a_100012001710_100000747449 [0,1,0,0,1,0|2,0,0]=4 2232 B15R1.956 COC(=O)CSc1ccc(cc1)C(=O)C 62a_100000185465_100000747449 [0,1,0,0,1,0|1,0,0]=3 2233 B15R1.956 COC(=O)CSc1ccc(cc1)C(=O)C 62a_100000747449_100000185465 [0,1,0,0,1,0|1,0,0]=3 2234 B15R1.956 COC(=O)CSc1ccc(cc1)C(=O)N 62a_100000162191_100000747449 [0,1,0,0,1,0|2,0,0]=4 2235 B15R1.956 COC(=O)CSc1ccc(cc1)C(=O)N 62a_100000747449_100000162191 [0,1,0,0,1,0|2,0,0]=4 2236 B15R1.956 COC(=O)CSc1ccc(cc1)S(=O)C 62a_100009816266_100000747449 [0,1,0,0,1,0|2,0,0]=4 2237 B15R1.956 COC(=O)CSc1ccc(cn1)C(=O)C 62a_100000684857_100000747449 [0,1,0,0,1,0|2,0,0]=4 2238 B15R1.956 COC(=O)CSc1ccc(cn1)C(=O)C 62a_100000747449_100000684857 [0,1,0,0,1,0|2,0,0]=4 2239 B15R1.956 COC(=O)CSc1ccc(nc1)C(=O)C 62a_100000686046_100000747449 [0,1,0,0,1,0|2,0,0]=4 2240 B15R1.956 COC(=O)CSc1ccc(nc1)C(=O)C 62a_100000747449_100000686046 [0,1,0,0,1,0|2,0,0]=4 2241 B15R1.956 NC(=O)c1ccc(cc1)CNC(=O)CO 240690a_100000185037_100000210174 [0,1,0,0,1,0|2,0,0]=4 2242 B15R1.956 NC(=O)c1ccc(cc1)CNC(=O)CO 527a_100000185037_100000210174 [0,1,0,0,1,0|2,0,0]=4 2243 B15R1.956 O=C(CF)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_100015361967 [0,1,0,0,1,0|2,0,0]=4 2244 B15R1.956 O=C(CO)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000210174_100000736421 [0,1,0,0,1,0|2,0,0]=4 2245 B15R1.5380 C=C(C)CNc1ccc(c(c1)F)C(=O)C 27a_100000765925_100000690205 [0,1,0,0,1,0|2,0,0]=4 2246 B15R1.5380 C=C(C)COc1ccc(c(c1)Br)C(=O)C 34a_100012340537_100000748629 [0,1,0,0,1,0|2,0,0]=4 2247 B15R1.5380 C=C(C)COc1ccc(c(c1)Br)C(=O)C 7a_100012340537_100000748629 [0,1,0,0,1,0|2,0,0]=4 2248 B15R1.5380 C=C(C)COc1ccc(c(c1)C)C(=O)C 34a_100000702595_100000748629 [0,1,0,0,1,0|2,0,0]=4 2249 B15R1.5380 C=C(C)COc1ccc(c(c1)C)C(=O)C 7a_100000702595_100000748629 [0,1,0,0,1,0|2,0,0]=4 2250 B15R1.5380 C=C(C)COc1ccc(c(c1)Cl)C(=O)C 34a_100011933989_100000748629 [0,1,0,0,1,0|2,0,0]=4 2251 B15R1.5380 C=C(C)COc1ccc(c(c1)Cl)C(=O)C 7a_100011933989_100000748629 [0,1,0,0,1,0|2,0,0]=4 2252 B15R1.5380 C=C(C)COc1ccc(c(c1)F)C(=O)C 34a_100000752407_100000748629 [0,1,0,0,1,0|2,0,0]=4 2253 B15R1.5380 C=C(C)COc1ccc(c(c1)F)C(=O)C 7a_100000752407_100000748629 [0,1,0,0,1,0|2,0,0]=4 2254 B15R1.5380 C=C(C)CSc1ccc(c(c1)C)C(=O)C 62a_100000748629_100012360112 [0,1,0,0,1,0|2,0,0]=4 2255 B15R1.5380 C=C(C)CSc1ccc(c(c1)C)C(=O)C 62a_100012360112_100000211660 [0,1,0,0,1,0|2,0,0]=4 2256 B15R1.5380 C=C(C)CSc1ccc(c(c1)F)C(=O)C 62a_100000690205_100000211660 [0,1,0,0,1,0|2,0,0]=4 2257 B15R1.5380 C=C(C)CSc1ccc(c(c1)N)C(=O)C 62a_100011590516_100000211660 [0,1,0,0,1,0|2,0,0]=4 2258 B15R1.5380 CC(=O)c1ccc(cc1Br)OCC(=O)N 34a_100012340537_100000187820 [0,1,0,0,1,0|2,0,0]=4 2259 B15R1.5380 CC(=O)c1ccc(cc1Br)OCC(=O)N 7a_100012340537_100000187820 [0,1,0,0,1,0|2,0,0]=4 2260 B15R1.5380 CC(=O)c1ccc(cc1Br)OCC(=O)[O-] 34a_100012340537_100020667443 [0,1,0,0,1,0|2,0,0]=4 2261 B15R1.5380 CC(=O)c1ccc(cc1C)OCC(=O)N 34a_100000702595_100000187820 [0,1,0,0,1,0|2,0,0]=4 2262 B15R1.5380 CC(=O)c1ccc(cc1C)OCC(=O)N 7a_100000702595_100000187820 [0,1,0,0,1,0|2,0,0]=4 2263 B15R1.5380 CC(=O)c1ccc(cc1C)OCC(=O)[O-] 34a_100000702595_100020667443 [0,1,0,0,1,0|2,0,0]=4 2264 B15R1.5380 CC(=O)c1ccc(cc1C)SCC(=O)N 62a_100000747473_100012360112 [0,1,0,0,1,0|2,0,0]=4 2265 B15R1.5380 CC(=O)c1ccc(cc1C)SCC(=O)N 62a_100012360112_100000747473 [0,1,0,0,1,0|2,0,0]=4 2266 B15R1.5380 CC(=O)c1ccc(cc1C)SCC(=O)[O-] 62a_100012360112_100020667443 [0,1,0,0,1,0|2,0,0]=4 2267 B15R1.5380 CC(=O)c1ccc(cc1C)SCC(=O)[O-] 62a_100020667443_100012360112 [0,1,0,0,1,0|2,0,0]=4 2268 B15R1.5380 CC(=O)c1ccc(cc1Cl)OCC(=O)N 34a_100011933989_100000187820 [0,1,0,0,1,0|2,0,0]=4 2269 B15R1.5380 CC(=O)c1ccc(cc1Cl)OCC(=O)N 7a_100011933989_100000187820 [0,1,0,0,1,0|2,0,0]=4 2270 B15R1.5380 CC(=O)c1ccc(cc1Cl)OCC(=O)[O-] 34a_100011933989_100020667443 [0,1,0,0,1,0|2,0,0]=4 2271 B15R1.5380 CC(=O)c1ccc(cc1F)OCC(=O)N 34a_100000752407_100000187820 [0,1,0,0,1,0|2,0,0]=4 2272 B15R1.5380 CC(=O)c1ccc(cc1F)OCC(=O)N 7a_100000752407_100000187820 [0,1,0,0,1,0|2,0,0]=4 2273 B15R1.5380 CC(=O)c1ccc(cc1F)OCC(=O)[O-] 34a_100000752407_100020667443 [0,1,0,0,1,0|2,0,0]=4 2274 B15R1.5380 CC(=O)c1ccc(cc1F)SCC(=O)N 62a_100000690205_100000747473 [0,1,0,0,1,0|2,0,0]=4 2275 B15R1.5380 CC(=O)c1ccc(cc1F)SCC(=O)[O-] 62a_100000690205_100020667443 [0,1,0,0,1,0|2,0,0]=4 2276 B15R1.5380 CC(=O)c1ccc(cc1N)SCC(=O)N 62a_100011590516_100000747473 [0,1,0,0,1,0|2,0,0]=4 2277 B15R1.5380 CC(=O)c1ccc(cc1N)SCC(=O)[O-] 62a_100011590516_100020667443 [0,1,0,0,1,0|2,0,0]=4 2278 B15R1.5504 C=C(C)c1ccc(cc1)C(=O)CC(=O)C 271570a_100000694244_100000184285 [0,1,0,0,1,0|1,0,1]=4 2279 B15R1.5504 C=C(C)c1ccc(cc1)C(C)NC(=O)C 271570a_100000694244_100000153805 [0,1,0,0,1,0|2,0,0]=4 2280 B15R1.5504 CC(=O)c1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000185465 [0,1,0,0,1,0|1,0,1]=4 2281 B15R1.8014 C=C(C)COc1ccc(cc1Br)C(=O)C 34a_100011772453_100000748629 [0,1,0,0,1,0|2,0,0]=4 2282 B15R1.8014 C=C(C)COc1ccc(cc1Br)C(=O)C 7a_100011772453_100000748629 [0,1,0,0,1,0|2,0,0]=4 2283 B15R1.8014 C=C(C)COc1ccc(cc1C)C(=O)C 34a_100000188726_100000748629 [0,1,0,0,1,0|2,0,0]=4 2284 B15R1.8014 C=C(C)COc1ccc(cc1C)C(=O)C 7a_100000188726_100000748629 [0,1,0,0,1,0|2,0,0]=4 2285 B15R1.8014 C=C(C)COc1ccc(cc1Cl)C(=O)C 34a_100000188625_100000748629 [0,1,0,0,1,0|2,0,0]=4 2286 B15R1.8014 C=C(C)COc1ccc(cc1Cl)C(=O)C 7a_100000188625_100000748629 [0,1,0,0,1,0|2,0,0]=4 2287 B15R1.8014 C=C(C)COc1ccc(cc1F)C(=O)C 34a_100000751691_100000748629 [0,1,0,0,1,0|2,0,0]=4 2288 B15R1.8014 C=C(C)COc1ccc(cc1F)C(=O)C 7a_100000751691_100000748629 [0,1,0,0,1,0|2,0,0]=4 2289 B15R1.8014 C=C(C)COc1ccc(cc1N)C(=O)C 34a_100000117292_100000748629 [0,1,0,0,1,0|2,0,0]=4 2290 B15R1.8014 C=C(C)COc1ccc(cc1N)C(=O)C 7a_100000117292_100000748629 [0,1,0,0,1,0|2,0,0]=4 2291 B15R1.8014 C=C(C)CSc1ccc(cc1Br)C(=O)C 62a_100000748629_100010146554 [0,1,0,0,1,0|2,0,0]=4 2292 B15R1.8014 C=C(C)CSc1ccc(cc1Br)C(=O)C 62a_100010146554_100000211660 [0,1,0,0,1,0|2,0,0]=4 2293 B15R1.8014 C=C(C)CSc1ccc(cc1C)C(=O)C 62a_100000697869_100000211660 [0,1,0,0,1,0|2,0,0]=4 2294 B15R1.8014 C=C(C)CSc1ccc(cc1C)C(=O)C 62a_100000748629_100000697869 [0,1,0,0,1,0|2,0,0]=4 2295 B15R1.8014 C=C(C)CSc1ccc(cc1F)C(=O)C 62a_100000690002_100000211660 [0,1,0,0,1,0|2,0,0]=4 2296 B15R1.8014 C=C(C)CSc1ccc(cc1F)C(=O)C 62a_100000748629_100000690002 [0,1,0,0,1,0|2,0,0]=4 2297 B15R1.8014 C=C(C)CSc1ccc(cc1N)C(=O)C 62a_100009816534_100000211660 [0,1,0,0,1,0|2,0,0]=4 2298 B15R1.8014 CC(=O)c1ccc(c(c1)Br)OCC(=O)N 34a_100011772453_100000187820 [0,1,0,0,1,0|2,0,0]=4 2299 B15R1.8014 CC(=O)c1ccc(c(c1)Br)OCC(=O)N 7a_100011772453_100000187820 [0,1,0,0,1,0|2,0,0]=4 2300 B15R1.8014 CC(=O)c1ccc(c(c1)Br)OCC(=O)[O-] 34a_100011772453_100020667443 [0,1,0,0,1,0|2,0,0]=4 2301 B15R1.8014 CC(=O)c1ccc(c(c1)Br)SCC(=O)N 62a_100000747473_100010146554 [0,1,0,0,1,0|2,0,0]=4 2302 B15R1.8014 CC(=O)c1ccc(c(c1)Br)SCC(=O)N 62a_100010146554_100000747473 [0,1,0,0,1,0|2,0,0]=4 2303 B15R1.8014 CC(=O)c1ccc(c(c1)Br)SCC(=O)[O-] 62a_100010146554_100020667443 [0,1,0,0,1,0|2,0,0]=4 2304 B15R1.8014 CC(=O)c1ccc(c(c1)Br)SCC(=O)[O-] 62a_100020667443_100010146554 [0,1,0,0,1,0|2,0,0]=4 2305 B15R1.8014 CC(=O)c1ccc(c(c1)C)OCC(=O)N 34a_100000188726_100000187820 [0,1,0,0,1,0|2,0,0]=4 2306 B15R1.8014 CC(=O)c1ccc(c(c1)C)OCC(=O)N 7a_100000188726_100000187820 [0,1,0,0,1,0|2,0,0]=4 2307 B15R1.8014 CC(=O)c1ccc(c(c1)C)OCC(=O)[O-] 34a_100000188726_100020667443 [0,1,0,0,1,0|2,0,0]=4 2308 B15R1.8014 CC(=O)c1ccc(c(c1)C)SCC(=O)N 62a_100000697869_100000747473 [0,1,0,0,1,0|2,0,0]=4 2309 B15R1.8014 CC(=O)c1ccc(c(c1)C)SCC(=O)N 62a_100000747473_100000697869 [0,1,0,0,1,0|2,0,0]=4 2310 B15R1.8014 CC(=O)c1ccc(c(c1)C)SCC(=O)[O-] 62a_100000697869_100020667443 [0,1,0,0,1,0|2,0,0]=4 2311 B15R1.8014 CC(=O)c1ccc(c(c1)C)SCC(=O)[O-] 62a_100020667443_100000697869 [0,1,0,0,1,0|2,0,0]=4 2312 B15R1.8014 CC(=O)c1ccc(c(c1)Cl)OCC(=O)N 34a_100000188625_100000187820 [0,1,0,0,1,0|2,0,0]=4 2313 B15R1.8014 CC(=O)c1ccc(c(c1)Cl)OCC(=O)N 7a_100000188625_100000187820 [0,1,0,0,1,0|2,0,0]=4 2314 B15R1.8014 CC(=O)c1ccc(c(c1)Cl)OCC(=O)[O-] 34a_100000188625_100020667443 [0,1,0,0,1,0|2,0,0]=4 2315 B15R1.8014 CC(=O)c1ccc(c(c1)F)OCC(=O)N 34a_100000751691_100000187820 [0,1,0,0,1,0|2,0,0]=4 2316 B15R1.8014 CC(=O)c1ccc(c(c1)F)OCC(=O)N 7a_100000751691_100000187820 [0,1,0,0,1,0|2,0,0]=4 2317 B15R1.8014 CC(=O)c1ccc(c(c1)F)OCC(=O)[O-] 34a_100000751691_100020667443 [0,1,0,0,1,0|2,0,0]=4 2318 B15R1.8014 CC(=O)c1ccc(c(c1)F)SCC(=O)N 62a_100000690002_100000747473 [0,1,0,0,1,0|2,0,0]=4 2319 B15R1.8014 CC(=O)c1ccc(c(c1)F)SCC(=O)N 62a_100000747473_100000690002 [0,1,0,0,1,0|2,0,0]=4 2320 B15R1.8014 CC(=O)c1ccc(c(c1)F)SCC(=O)[O-] 62a_100000690002_100020667443 [0,1,0,0,1,0|2,0,0]=4 2321 B15R1.8014 CC(=O)c1ccc(c(c1)F)SCC(=O)[O-] 62a_100020667443_100000690002 [0,1,0,0,1,0|2,0,0]=4 2322 B15R1.8014 CC(=O)c1ccc(c(c1)N)OCC(=O)N 34a_100000117292_100000187820 [0,1,0,0,1,0|2,0,0]=4 2323 B15R1.8014 CC(=O)c1ccc(c(c1)N)OCC(=O)N 7a_100000117292_100000187820 [0,1,0,0,1,0|2,0,0]=4 2324 B15R1.8014 CC(=O)c1ccc(c(c1)N)OCC(=O)[O-] 34a_100000117292_100020667443 [0,1,0,0,1,0|2,0,0]=4 2325 B15R1.8014 CC(=O)c1ccc(c(c1)N)SCC(=O)N 62a_100009816534_100000747473 [0,1,0,0,1,0|2,0,0]=4 2326 B15R1.8014 CC(=O)c1ccc(c(c1)N)SCC(=O)[O-] 62a_100009816534_100020667443 [0,1,0,0,1,0|2,0,0]=4 2327 B15R1.1075 CC(=O)Cc1ccc(cc1)NS(=O)(=O)C 1458a_200000165989_200000210301 [0,1,0,0,1,0|2,0,0]=4 2328 B15R1.1075 CC(=O)Cc1ccc(cc1)OC(C)(C)C 34a_100011218180_100000210625 [0,1,0,0,1,0|1,0,1]=4 2329 B15R1.1075 CC(=O)Cc1ccc(cc1)OS(=O)(=O)C 1458a_100000069511_200000210301 [0,1,0,0,1,0|1,0,0]=3 2330 B15R1.1075 CC(=O)Nc1ccc(cc1)CS(=O)(=O)C 11a_100000747337_100015343762 [0,1,0,0,1,0|2,0,0]=4 2331 B15R1.1075 CC(=O)Nc1ccc(cc1)CS(=O)(=O)C 1626a_100000747337_100015343762 [0,1,0,0,1,0|2,0,0]=4 2332 B15R1.1075 CC(=O)Nc1ccc(cc1)CS(=O)(=O)C 22a_100000747337_100000070787 [0,1,0,0,1,0|2,0,0]=4 2333 B15R1.1075 CC(=O)Nc1ccc(cc1)CS(=O)(=O)C 527a_100000747337_100103153847 [0,1,0,0,1,0|2,0,0]=4 2334 B15R1.1075 CS(=O)(=O)Nc1ccc(cc1)CC(=O)[13CH3] 1458a_200000165989_200025704644 [0,1,0,0,1,0|2,0,0]=4 2335 B15R1.1075 CS(=O)(=O)Oc1ccc(cc1)CC(=O)[13CH3] 1458a_100000069511_200025704644 [0,1,0,0,1,0|1,0,0]=3 2336 B15R1.5387 CC(=O)Cc1ccc(c(c1)Br)OC(C)C 34a_100010141077_100000210206 [0,1,0,0,1,0|1,0,1]=4 2337 B15R1.5387 CC(=O)Cc1ccc(c(c1)Br)OC(C)C 7a_100010141077_100000210206 [0,1,0,0,1,0|1,0,1]=4 2338 B15R1.5387 CC(=O)Cc1ccc(c(c1)C)OC(C)C 34a_200000080089_100000210206 [0,1,0,0,1,0|1,0,1]=4 2339 B15R1.5387 CC(=O)Cc1ccc(c(c1)C)OC(C)C 7a_200000080089_100000210206 [0,1,0,0,1,0|1,0,1]=4 2340 B15R1.5387 CC(=O)Cc1ccc(c(c1)Cl)OC(C)C 34a_200000080078_100000210206 [0,1,0,0,1,0|1,0,1]=4 2341 B15R1.5387 CC(=O)Cc1ccc(c(c1)Cl)OC(C)C 7a_200000080078_100000210206 [0,1,0,0,1,0|1,0,1]=4 2342 B15R1.5387 CC(=O)Cc1ccc(cc1Cl)OC(C)C 34a_200000084595_100000210206 [0,1,0,0,1,0|1,0,1]=4 2343 B15R1.5387 CC(=O)Cc1ccc(cc1Cl)OC(C)C 7a_200000084595_100000210206 [0,1,0,0,1,0|1,0,1]=4 2344 B15R1.5387 CC(=O)Nc1ccc(c(c1)C)NC(=O)C 11a_100000736504_100015343762 [0,1,0,0,1,0|2,0,0]=4 2345 B15R1.5387 CC(=O)Nc1ccc(c(c1)C)NC(=O)C 1626a_100000736504_100015343762 [0,1,0,0,1,0|2,0,0]=4 2346 B15R1.5387 CC(=O)Nc1ccc(c(c1)C)NC(=O)C 22a_100000736504_100000070787 [0,1,0,0,1,0|2,0,0]=4 2347 B15R1.5387 CC(=O)Nc1ccc(c(c1)C)NC(=O)C 527a_100000736504_100103153847 [0,1,0,0,1,0|2,0,0]=4 2348 B15R1.5387 CC(=O)Nc1ccc(c(c1)Cl)NC(=O)C 11a_100000244014_100015343762 [0,1,0,0,1,0|2,0,0]=4 2349 B15R1.5387 CC(=O)Nc1ccc(c(c1)Cl)NC(=O)C 1626a_100000244014_100015343762 [0,1,0,0,1,0|2,0,0]=4 2350 B15R1.5387 CC(=O)Nc1ccc(c(c1)Cl)NC(=O)C 22a_100000244014_100000070787 [0,1,0,0,1,0|2,0,0]=4 2351 B15R1.5387 CC(=O)Nc1ccc(c(c1)Cl)NC(=O)C 527a_100000244014_100103153847 [0,1,0,0,1,0|2,0,0]=4 2352 B15R1.5387 CC(=O)Oc1ccc(c(c1)O)OC(=O)C 271570a_203496583355_100009828021 [0,1,0,0,1,0|1,0,0]=3 2353 B15R1.5387 CC(=O)Oc1ccc(cc1F)C=C(C)C 271570a_100102525489_100009811628 [0,1,0,0,1,0|1,0,1]=4 2354 B15R1.12250 CC(=O)Cc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100000691760 [0,1,0,0,1,0|2,0,0]=4 2355 B15R1.12250 CC(=O)Nc1ccc(cc1)N(C)C(=O)C 11a_100000219403_100015343762 [0,1,0,0,1,0|2,0,0]=4 2356 B15R1.12250 CC(=O)Nc1ccc(cc1)N(C)C(=O)C 11a_100000229935_100015343762 [0,1,0,0,1,0|2,0,0]=4 2357 B15R1.12250 CC(=O)Nc1ccc(cc1)N(C)C(=O)C 1626a_100000219403_100015343762 [0,1,0,0,1,0|2,0,0]=4 2358 B15R1.12250 CC(=O)Nc1ccc(cc1)N(C)C(=O)C 1626a_100000229935_100015343762 [0,1,0,0,1,0|2,0,0]=4 2359 B15R1.12250 CC(=O)Nc1ccc(cc1)N(C)C(=O)C 22a_100000219403_100000070787 [0,1,0,0,1,0|2,0,0]=4 2360 B15R1.12250 CC(=O)Nc1ccc(cc1)N(C)C(=O)C 22a_100000229935_100000070787 [0,1,0,0,1,0|2,0,0]=4 2361 B15R1.12250 CC(=O)Nc1ccc(cc1)N(C)C(=O)C 527a_100000219403_100103153847 [0,1,0,0,1,0|2,0,0]=4 2362 B15R1.12250 CC(=O)Nc1ccc(cc1)N(C)C(=O)C 527a_100000229935_100103153847 [0,1,0,0,1,0|2,0,0]=4 2363 B15R1.12250 CC(=O)Oc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100000002173 [0,1,0,0,1,0|1,0,1]=4 2364 B17R1.1191 C=C(C#N)COc1ccc(cc1)CCC(=O)C 34a_100000198047_100000694840 [0,1,0,0,0,1|1,0,1]=4 2365 B17R1.1191 C=C(C)CNc1ccc(cc1)OCC(=O)NC 2230a_100000752409_100000748629 [0,1,0,0,0,1|2,0,0]=4 2366 B17R1.1191 C=C(C)CNc1ccc(cc1)OCC(=O)NC 34a_100000752409_100000748629 [0,1,0,0,0,1|2,0,0]=4 2367 B17R1.1191 C=C(C)COc1ccc(cc1)CCC(=O)NN 34a_100000048474_100000748629 [0,1,0,0,0,1|2,0,0]=4 2368 B17R1.1191 C=C(C)COc1ccc(cc1)CCC(=O)OC 34a_100000032826_100000748629 [0,1,0,0,0,1|1,0,0]=3 2369 B17R1.1191 C=C(C)COc1ccc(cc1)CCC(=O)OC 7a_100000032826_100000748629 [0,1,0,0,0,1|1,0,0]=3 2370 B17R1.1191 C=C(C)COc1ccc(cc1)NCC(=O)NC 2230a_200015186533_100000183359 [0,1,0,0,0,1|2,0,0]=4 2371 B17R1.1191 C=C(C)COc1ccc(cc1)NCC(=O)NC 34a_200015186533_100000183359 [0,1,0,0,0,1|2,0,0]=4 2372 B17R1.1191 C=C(C)COc1ccc(cc1)NCC(=O)OC 2230a_200015186533_100000747449 [0,1,0,0,0,1|2,0,0]=4 2373 B17R1.1191 C=C(C)COc1ccc(cc1)NCC(=O)OC 34a_100016989482_100000748629 [0,1,0,0,0,1|2,0,0]=4 2374 B17R1.1191 C=C(C)COc1ccc(cc1)NCC(=O)OC 34a_200015186533_100000747449 [0,1,0,0,0,1|2,0,0]=4 2375 B17R1.1191 C=C(C)CSc1ccc(cc1)CCC(=O)NC 62a_100000748629_200010273138 [0,1,0,0,0,1|1,1,0]=4 2376 B17R1.1191 C=C(C)CSc1ccc(cc1)CCC(=O)NC 62a_200010273138_100000211660 [0,1,0,0,0,1|1,1,0]=4 2377 B17R1.1191 C=C(C)CSc1ccc(cc1)CCC(=O)OC 62a_100000748629_100012357364 [0,1,0,0,0,1|1,1,0]=4 2378 B17R1.1191 C=C(C)CSc1ccc(cc1)CCC(=O)OC 62a_100012357364_100000211660 [0,1,0,0,0,1|1,1,0]=4 2379 B17R1.1191 C=C(C)CSc1ccc(cc1)OCC(=O)NC 62a_100000748629_200000150405 [0,1,0,0,0,1|2,0,0]=4 2380 B17R1.1191 C=C(C)CSc1ccc(cc1)OCC(=O)NC 62a_200000150405_100000211660 [0,1,0,0,0,1|2,0,0]=4 2381 B17R1.1191 C=C(C)CSc1ccc(cc1)OCC(=O)OC 62a_100000149925_100000211660 [0,1,0,0,0,1|2,0,0]=4 2382 B17R1.1191 C=C(C)CSc1ccc(cc1)OCC(=O)OC 62a_100000748629_100000149925 [0,1,0,0,0,1|2,0,0]=4 2383 B17R1.1191 C=C(F)COc1ccc(cc1)CCC(=O)OC 34a_100000032826_100009893438 [0,1,0,0,0,1|1,0,1]=4 2384 B17R1.1191 C=C(F)COc1ccc(cc1)CCC(=O)OC 7a_100000032826_100000042424 [0,1,0,0,0,1|1,0,1]=4 2385 B17R1.1191 CC(=O)CCc1ccc(cc1)OCC(O)CO 34a_100000198047_100011219619 [0,1,0,0,0,1|0,0,2]=4 2386 B17R1.1191 CC(=O)CCc1ccc(cc1)OCC(O)CO 7a_100000198047_100011219619 [0,1,0,0,0,1|0,0,2]=4 2387 B17R1.1191 CC(=O)CCc1ccc(cc1)OC[C@@H](C)CO 34a_100000198047_100000059175 [0,1,0,0,0,1|0,0,2]=4 2388 B17R1.1191 CC(=O)CCc1ccc(cc1)OC[C@@H](C)CO 7a_100000198047_100000059175 [0,1,0,0,0,1|0,0,2]=4 2389 B17R1.1191 CC(=O)CCc1ccc(cc1)OC[C@@H](O)CF 34a_100000198047_100015614560 [0,1,0,0,0,1|0,0,2]=4 2390 B17R1.1191 CC(=O)CCc1ccc(cc1)OC[C@@H](O)CF 7a_100000198047_100015614560 [0,1,0,0,0,1|0,0,2]=4 2391 B17R1.1191 CC(=O)CCc1ccc(cc1)OC[C@@H](O)CO 34a_100000198047_100009815848 [0,1,0,0,0,1|0,0,2]=4 2392 B17R1.1191 CC(=O)CCc1ccc(cc1)OC[C@@H](O)CO 7a_100000198047_100009815848 [0,1,0,0,0,1|0,0,2]=4 2393 B17R1.1191 CCC(=O)COc1ccc(cc1)CCC(=O)C 7a_100000198047_100000747405 [0,1,0,0,0,1|0,0,0]=2 2394 B17R1.1191 CCC(=O)COc1ccc(cc1)CCC(C)O 7a_100000189425_100000747405 [0,1,0,0,0,1|0,0,2]=4 2395 B17R1.1191 CCC(=O)CSc1ccc(cc1)/C=C/C(=O)C 62a_100000747405_200016259395 [0,1,0,0,0,1|2,0,0]=4 2396 B17R1.1191 CCC(=O)CSc1ccc(cc1)/C=C/C(=O)C 62a_200016259395_100000747405 [0,1,0,0,0,1|2,0,0]=4 2397 B17R1.1191 CCC(=O)CSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000747405 [0,1,0,0,0,1|0,1,0]=3 2398 B17R1.1191 CCC(=O)CSc1ccc(cc1)CCC(=O)C 62a_100000747405_100000723691 [0,1,0,0,0,1|0,1,0]=3 2399 B17R1.1191 CCC(=O)CSc1ccc(cc1)CCC(=O)N 62a_100000747405_200010110666 [0,1,0,0,0,1|1,1,0]=4 2400 B17R1.1191 CCC(=O)CSc1ccc(cc1)CCC(=O)N 62a_200010110666_100000747405 [0,1,0,0,0,1|1,1,0]=4 2401 B17R1.1191 CCC(=O)CSc1ccc(cc1)CNC(=O)C 62a_100000747405_200000685173 [0,1,0,0,0,1|1,1,0]=4 2402 B17R1.1191 CCC(=O)CSc1ccc(cc1)CNC(=O)C 62a_200000685173_100000747405 [0,1,0,0,0,1|1,1,0]=4 2403 B17R1.1191 CCC(=O)CSc1ccc(cc1)NNC(=O)C 62a_100000747405_200009815283 [0,1,0,0,0,1|2,0,0]=4 2404 B17R1.1191 CCC(=O)CSc1ccc(cc1)NNC(=O)C 62a_200009815283_100000747405 [0,1,0,0,0,1|2,0,0]=4 2405 B17R1.1191 CCC(=O)NCc1ccc(cc1)OCC(=O)N 1626a_100000244766_100000210414 [0,1,0,0,0,1|2,0,0]=4 2406 B17R1.1191 CCC(=O)NCc1ccc(cc1)OCC(=O)N 240690a_100000244766_100000210414 [0,1,0,0,0,1|2,0,0]=4 2407 B17R1.1191 CCC(=O)NCc1ccc(cc1)OCC(=O)N 527a_100000244766_100000210414 [0,1,0,0,0,1|2,0,0]=4 2408 B17R1.1191 CCC(C)COc1ccc(cc1)CCC(=O)C 34a_100000198047_100000748023 [0,1,0,0,0,1|1,0,1]=4 2409 B17R1.1191 CCC(C)COc1ccc(cc1)CCC(=O)C 7a_100000198047_100000748023 [0,1,0,0,0,1|1,0,1]=4 2410 B17R1.1191 CCC(O)COc1ccc(cc1)CCC(=O)C 34a_100000198047_100011218378 [0,1,0,0,0,1|0,0,2]=4 2411 B17R1.1191 CCC(O)COc1ccc(cc1)CCC(=O)C 7a_100000198047_100011218378 [0,1,0,0,0,1|0,0,2]=4 2412 B17R1.1191 CC[C@H](C)COc1ccc(cc1)CCC(=O)C 34a_100000198047_100009816398 [0,1,0,0,0,1|1,0,1]=4 2413 B17R1.1191 CC[C@H](C)COc1ccc(cc1)CCC(=O)C 7a_100000198047_100009816398 [0,1,0,0,0,1|1,0,1]=4 2414 B17R1.1191 CNC(=O)CCc1ccc(cc1)SCC(=O)N 62a_100000747473_200010273138 [0,1,0,0,0,1|1,1,0]=4 2415 B17R1.1191 CNC(=O)CCc1ccc(cc1)SCC(=O)N 62a_200010273138_100000747473 [0,1,0,0,0,1|1,1,0]=4 2416 B17R1.1191 CNC(=O)CCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200010273138 [0,1,0,0,0,1|1,1,0]=4 2417 B17R1.1191 CNC(=O)CCc1ccc(cc1)SCC(=O)[O-] 62a_200010273138_100020667443 [0,1,0,0,0,1|1,1,0]=4 2418 B17R1.1191 CNC(=O)CNc1ccc(cc1)CNC(=O)C 34a_100000755463_100000183359 [0,1,0,0,0,1|2,0,0]=4 2419 B17R1.1191 CNC(=O)CNc1ccc(cc1)OCC(=O)N 2230a_100000238760_100000183359 [0,1,0,0,0,1|2,0,0]=4 2420 B17R1.1191 CNC(=O)CNc1ccc(cc1)OCC(=O)N 34a_100000238760_100000183359 [0,1,0,0,0,1|2,0,0]=4 2421 B17R1.1191 CNC(=O)COc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_100000183359 [0,1,0,0,0,1|0,0,2]=4 2422 B17R1.1191 CNC(=O)COc1ccc(cc1)CCC(=O)C 34a_100000198047_100000183359 [0,1,0,0,0,1|0,0,0]=2 2423 B17R1.1191 CNC(=O)COc1ccc(cc1)CCC(=O)C 7a_100000198047_100000183359 [0,1,0,0,0,1|0,0,0]=2 2424 B17R1.1191 CNC(=O)COc1ccc(cc1)CCC(C)O 34a_100000189425_100000183359 [0,1,0,0,0,1|0,0,2]=4 2425 B17R1.1191 CNC(=O)COc1ccc(cc1)CCC(C)O 7a_100000189425_100000183359 [0,1,0,0,0,1|0,0,2]=4 2426 B17R1.1191 CNC(=O)COc1ccc(cc1)NCC(=O)N 2230a_100000752409_100000747473 [0,1,0,0,0,1|2,0,0]=4 2427 B17R1.1191 CNC(=O)COc1ccc(cc1)NCC(=O)N 34a_100000752409_100000187820 [0,1,0,0,0,1|2,0,0]=4 2428 B17R1.1191 CNC(=O)COc1ccc(cc1)NCC(=O)[O-] 34a_100000752409_100020667443 [0,1,0,0,0,1|2,0,0]=4 2429 B17R1.1191 CNC(=O)COc1ccc(cc1)SCC(=O)N 62a_100000747473_200000150405 [0,1,0,0,0,1|2,0,0]=4 2430 B17R1.1191 CNC(=O)COc1ccc(cc1)SCC(=O)N 62a_200000150405_100000747473 [0,1,0,0,0,1|2,0,0]=4 2431 B17R1.1191 CNC(=O)COc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200000150405 [0,1,0,0,0,1|2,0,0]=4 2432 B17R1.1191 CNC(=O)COc1ccc(cc1)SCC(=O)[O-] 62a_200000150405_100020667443 [0,1,0,0,0,1|2,0,0]=4 2433 B17R1.1191 CNC(=O)CSc1ccc(cc1)/C=C/C(=O)C 62a_100000183359_200016259395 [0,1,0,0,0,1|2,0,0]=4 2434 B17R1.1191 CNC(=O)CSc1ccc(cc1)/C=C/C(=O)C 62a_200016259395_100000183359 [0,1,0,0,0,1|2,0,0]=4 2435 B17R1.1191 CNC(=O)CSc1ccc(cc1)CCC(=O)C 62a_100000183359_100000723691 [0,1,0,0,0,1|0,1,0]=3 2436 B17R1.1191 CNC(=O)CSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000183359 [0,1,0,0,0,1|0,1,0]=3 2437 B17R1.1191 CNC(=O)CSc1ccc(cc1)CCC(=O)N 62a_100000183359_200010110666 [0,1,0,0,0,1|1,1,0]=4 2438 B17R1.1191 CNC(=O)CSc1ccc(cc1)CCC(=O)N 62a_200010110666_100000183359 [0,1,0,0,0,1|1,1,0]=4 2439 B17R1.1191 CNC(=O)CSc1ccc(cc1)CNC(=O)C 62a_100000183359_200000685173 [0,1,0,0,0,1|1,1,0]=4 2440 B17R1.1191 CNC(=O)CSc1ccc(cc1)CNC(=O)C 62a_200000685173_100000183359 [0,1,0,0,0,1|1,1,0]=4 2441 B17R1.1191 CNC(=O)CSc1ccc(cc1)NNC(=O)C 62a_100000183359_200009815283 [0,1,0,0,0,1|2,0,0]=4 2442 B17R1.1191 CNC(=O)CSc1ccc(cc1)NNC(=O)C 62a_200009815283_100000183359 [0,1,0,0,0,1|2,0,0]=4 2443 B17R1.1191 CNC(=O)NCc1ccc(cc1)OCC(=O)N 2708a_100000244766_106832991635 [0,1,0,0,0,1|2,0,0]=4 2444 B17R1.1191 CNC(=O)NCc1ccc(cc1)OCC(=O)N 2708a_100102657272_100000244766 [0,1,0,0,0,1|2,0,0]=4 2445 B17R1.1191 CNC(=O)NCc1ccc(cc1)OCC(=O)N 273464a_100000244766_100102657272 [0,1,0,0,0,1|2,0,0]=4 2446 B17R1.1191 CNC(=O)NCc1ccc(cc1)OCC(=O)N 273464a_100102657272_100000244766 [0,1,0,0,0,1|2,0,0]=4 2447 B17R1.1191 CNC(=O)NCc1ccc(cc1)OCC(=O)N 512a_106832991638_100000244766 [0,1,0,0,0,1|2,0,0]=4 2448 B17R1.1191 COC(=O)CCc1ccc(cc1)CNC(=O)C 188690a_100016994961_100015343762 [0,1,0,0,0,1|1,0,0]=3 2449 B17R1.1191 COC(=O)CCc1ccc(cc1)OCC(=O)N 34a_100000032826_100000187820 [0,1,0,0,0,1|1,0,0]=3 2450 B17R1.1191 COC(=O)CCc1ccc(cc1)OCC(=O)N 7a_100000032826_100000187820 [0,1,0,0,0,1|1,0,0]=3 2451 B17R1.1191 COC(=O)CCc1ccc(cc1)OCC(=O)[O-] 34a_100000032826_100020667443 [0,1,0,0,0,1|1,0,0]=3 2452 B17R1.1191 COC(=O)CCc1ccc(cc1)OCC(C)C 34a_100000032826_100000210624 [0,1,0,0,0,1|1,0,1]=4 2453 B17R1.1191 COC(=O)CCc1ccc(cc1)OCC(C)C 7a_100000032826_100000210760 [0,1,0,0,0,1|1,0,1]=4 2454 B17R1.1191 COC(=O)CCc1ccc(cc1)OCC(C)O 34a_100000032826_100011218427 [0,1,0,0,0,1|0,0,2]=4 2455 B17R1.1191 COC(=O)CCc1ccc(cc1)OCC(C)O 7a_100000032826_100011218427 [0,1,0,0,0,1|0,0,2]=4 2456 B17R1.1191 COC(=O)CCc1ccc(cc1)OC[C@@H](C)O 34a_100000032826_100009817552 [0,1,0,0,0,1|0,0,2]=4 2457 B17R1.1191 COC(=O)CCc1ccc(cc1)OC[C@@H](C)O 7a_100000032826_100009817552 [0,1,0,0,0,1|0,0,2]=4 2458 B17R1.1191 COC(=O)CCc1ccc(cc1)OC[N+](=O)[O-] 34a_100000032826_100000761209 [0,1,0,0,0,1|2,0,0]=4 2459 B17R1.1191 COC(=O)CCc1ccc(cc1)SCC(=O)N 62a_100000747473_100012357364 [0,1,0,0,0,1|1,1,0]=4 2460 B17R1.1191 COC(=O)CCc1ccc(cc1)SCC(=O)N 62a_100012357364_100000747473 [0,1,0,0,0,1|1,1,0]=4 2461 B17R1.1191 COC(=O)CCc1ccc(cc1)SCC(=O)[O-] 62a_100012357364_100020667443 [0,1,0,0,0,1|1,1,0]=4 2462 B17R1.1191 COC(=O)CCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100012357364 [0,1,0,0,0,1|1,1,0]=4 2463 B17R1.1191 COC(=O)CNc1ccc(cc1)CNC(=O)C 34a_100000755463_100000747449 [0,1,0,0,0,1|2,0,0]=4 2464 B17R1.1191 COC(=O)CNc1ccc(cc1)OCC(=O)N 2230a_100000238760_100000747449 [0,1,0,0,0,1|2,0,0]=4 2465 B17R1.1191 COC(=O)CNc1ccc(cc1)OCC(=O)N 34a_100000238760_100000747449 [0,1,0,0,0,1|2,0,0]=4 2466 B17R1.1191 COC(=O)CNc1ccc(cc1)OCC(=O)N 34a_100016989482_100000187820 [0,1,0,0,0,1|2,0,0]=4 2467 B17R1.1191 COC(=O)CNc1ccc(cc1)OCC(=O)[O-] 34a_100016989482_100020667443 [0,1,0,0,0,1|2,0,0]=4 2468 B17R1.1191 COC(=O)COc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_100000747449 [0,1,0,0,0,1|0,0,2]=4 2469 B17R1.1191 COC(=O)COc1ccc(cc1)CCC(=O)C 34a_100000198047_100000747449 [0,1,0,0,0,1|0,0,0]=2 2470 B17R1.1191 COC(=O)COc1ccc(cc1)CCC(=O)C 7a_100000198047_100000747449 [0,1,0,0,0,1|0,0,0]=2 2471 B17R1.1191 COC(=O)COc1ccc(cc1)CCC(C)O 34a_100000189425_100000747449 [0,1,0,0,0,1|0,0,2]=4 2472 B17R1.1191 COC(=O)COc1ccc(cc1)CCC(C)O 7a_100000189425_100000747449 [0,1,0,0,0,1|0,0,2]=4 2473 B17R1.1191 COC(=O)COc1ccc(cc1)SCC(=O)N 62a_100000149925_100000747473 [0,1,0,0,0,1|2,0,0]=4 2474 B17R1.1191 COC(=O)COc1ccc(cc1)SCC(=O)N 62a_100000747473_100000149925 [0,1,0,0,0,1|2,0,0]=4 2475 B17R1.1191 COC(=O)COc1ccc(cc1)SCC(=O)[O-] 62a_100000149925_100020667443 [0,1,0,0,0,1|2,0,0]=4 2476 B17R1.1191 COC(=O)COc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000149925 [0,1,0,0,0,1|2,0,0]=4 2477 B17R1.1191 COC(=O)CSc1ccc(cc1)/C=C/C(=O)C 62a_100000747449_200016259395 [0,1,0,0,0,1|2,0,0]=4 2478 B17R1.1191 COC(=O)CSc1ccc(cc1)/C=C/C(=O)C 62a_200016259395_100000747449 [0,1,0,0,0,1|2,0,0]=4 2479 B17R1.1191 COC(=O)CSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000747449 [0,1,0,0,0,1|0,1,0]=3 2480 B17R1.1191 COC(=O)CSc1ccc(cc1)CCC(=O)C 62a_100000747449_100000723691 [0,1,0,0,0,1|0,1,0]=3 2481 B17R1.1191 COC(=O)CSc1ccc(cc1)CCC(=O)N 62a_100000747449_200010110666 [0,1,0,0,0,1|1,1,0]=4 2482 B17R1.1191 COC(=O)CSc1ccc(cc1)CCC(=O)N 62a_200010110666_100000747449 [0,1,0,0,0,1|1,1,0]=4 2483 B17R1.1191 COC(=O)CSc1ccc(cc1)CNC(=O)C 62a_100000747449_200000685173 [0,1,0,0,0,1|1,1,0]=4 2484 B17R1.1191 COC(=O)CSc1ccc(cc1)CNC(=O)C 62a_200000685173_100000747449 [0,1,0,0,0,1|1,1,0]=4 2485 B17R1.1191 COC(=O)CSc1ccc(cc1)NNC(=O)C 62a_100000747449_200009815283 [0,1,0,0,0,1|2,0,0]=4 2486 B17R1.1191 COC(=O)CSc1ccc(cc1)NNC(=O)C 62a_200009815283_100000747449 [0,1,0,0,0,1|2,0,0]=4 2487 B17R1.1191 NC(=O)COc1ccc(cc1)CNC(=O)CO 240690a_100000244766_100000210174 [0,1,0,0,0,1|2,0,0]=4 2488 B17R1.1191 NC(=O)COc1ccc(cc1)CNC(=O)CO 527a_100000244766_100000210174 [0,1,0,0,0,1|2,0,0]=4 2489 B17R1.1191 NNC(=O)CCc1ccc(cc1)OCC(=O)N 34a_100000048474_100000187820 [0,1,0,0,0,1|2,0,0]=4 2490 B17R1.1191 NNC(=O)CCc1ccc(cc1)OCC(=O)[O-] 34a_100000048474_100020667443 [0,1,0,0,0,1|2,0,0]=4 2491 B17R1.9287 C=C(C)CC(=O)c1ccc(cc1)COC(=O)C 1458a_100000006716_100000748629 [0,1,0,0,0,1|1,0,1]=4 2492 B17R1.9287 CC(=O)OCc1ccc(cc1)C(=O)CC(=O)N 1458a_100000006716_100000187820 [0,1,0,0,0,1|1,0,1]=4 2493 B17R1.9287 CC(=O)OCc1ccc(cc1)C(=O)CC(=O)[O-] 1458a_100000006716_100020667443 [0,1,0,0,0,1|1,0,1]=4 2494 B17R1.9288 C=C(C)COc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_100000748629 [0,1,0,0,0,1|2,0,0]=4 2495 B17R1.9288 C=C(C)COc1ccc(cc1)NC(C)C(=O)C 2230a_200015186533_100009814033 [0,1,0,0,0,1|2,0,0]=4 2496 B17R1.9288 CC(=O)/C=C/c1ccc(cc1)SC(C)C(=O)C 62a_100009814033_200016259395 [0,1,0,0,0,1|2,0,0]=4 2497 B17R1.9288 CC(=O)/C=C/c1ccc(cc1)SC(C)C(=O)C 62a_200016259395_100009814033 [0,1,0,0,0,1|2,0,0]=4 2498 B17R1.9288 CC(=O)C(C)Nc1ccc(cc1)OCC(=O)N 2230a_100000238760_100009814033 [0,1,0,0,0,1|2,0,0]=4 2499 B17R1.9288 CC(=O)C(C)Oc1ccc(cc1)CCC(C)O 7a_100000189425_100000179758 [0,1,0,0,0,1|0,0,2]=4 2500 B17R1.9288 CC(=O)C(C)Sc1ccc(cc1)CCC(=O)N 62a_100009814033_200010110666 [0,1,0,0,0,1|1,1,0]=4 2501 B17R1.9288 CC(=O)C(C)Sc1ccc(cc1)CCC(=O)N 62a_200010110666_100009814033 [0,1,0,0,0,1|1,1,0]=4 2502 B17R1.9288 CC(=O)CCc1ccc(cc1)OC(C)C(=O)C 7a_100000198047_100000179758 [0,1,0,0,0,1|0,0,0]=2 2503 B17R1.9288 CC(=O)CCc1ccc(cc1)OC(C)C(=O)N 34a_100000198047_100000702099 [0,1,0,0,0,1|1,0,0]=3 2504 B17R1.9288 CC(=O)CCc1ccc(cc1)OC(C)C(=O)N 7a_100000198047_100000702099 [0,1,0,0,0,1|1,0,0]=3 2505 B17R1.9288 CC(=O)CCc1ccc(cc1)OC(F)C(=O)N 34a_100000198047_100009813875 [0,1,0,0,0,1|1,0,0]=3 2506 B17R1.9288 CC(=O)CCc1ccc(cc1)OC(F)C(=O)N 7a_100000198047_100009813875 [0,1,0,0,0,1|1,0,0]=3 2507 B17R1.9288 CC(=O)CCc1ccc(cc1)OC(F)C(=O)[O-] 34a_100000198047_100020610796 [0,1,0,0,0,1|1,0,0]=3 2508 B17R1.9288 CC(=O)CCc1ccc(cc1)SC(C)C(=O)C 62a_100000723691_100009814033 [0,1,0,0,0,1|0,1,0]=3 2509 B17R1.9288 CC(=O)CCc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000723691 [0,1,0,0,0,1|0,1,0]=3 2510 B17R1.9288 CC(=O)CCc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000723691 [0,1,0,0,0,1|1,1,0]=4 2511 B17R1.9288 CC(=O)CCc1ccc(cc1)SC(C)C(=O)N 62a_100000723691_100000702099 [0,1,0,0,0,1|1,1,0]=4 2512 B17R1.9288 CC(=O)CCc1ccc(cc1)SC(F)C(=O)N 62a_100000723691_100009813875 [0,1,0,0,0,1|1,1,0]=4 2513 B17R1.9288 CC(=O)CCc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100000723691 [0,1,0,0,0,1|1,1,0]=4 2514 B17R1.9288 CC(=O)CCc1ccc(cc1)SC(F)C(=O)[O-] 62a_100000723691_100020610796 [0,1,0,0,0,1|1,1,0]=4 2515 B17R1.9288 CC(=O)CCc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100000723691 [0,1,0,0,0,1|1,1,0]=4 2516 B17R1.9288 CC(=O)NCc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_200000685173 [0,1,0,0,0,1|1,1,0]=4 2517 B17R1.9288 CC(=O)NCc1ccc(cc1)SC(C)C(=O)C 62a_200000685173_100009814033 [0,1,0,0,0,1|1,1,0]=4 2518 B17R1.9288 CC(=O)NNc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_200009815283 [0,1,0,0,0,1|2,0,0]=4 2519 B17R1.9288 CC(=O)NNc1ccc(cc1)SC(C)C(=O)C 62a_200009815283_100009814033 [0,1,0,0,0,1|2,0,0]=4 2520 B17R1.9288 NC(=O)COc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_100000187820 [0,1,0,0,0,1|2,0,0]=4 2521 B17R1.9288 NC(=O)[C@@H](N)Cc1ccc(cc1)OCC(=O)[O-] 34a_100011423149_100020667443 [0,1,0,0,0,1|2,0,0]=4 2522 B17R1.16364 CC(=O)CCc1ccc(cc1)OCC(C)(C)C 34a_100000198047_100011219605 [0,1,0,0,0,1|1,0,1]=4 2523 B17R1.16364 CC(=O)CCc1ccc(cc1)OCC(C)(C)F 34a_100000198047_100011997219 [0,1,0,0,0,1|1,0,1]=4 2524 B17R1.16364 CC(=O)CCc1ccc(cc1)OCC(C)(C)O 34a_100000198047_100000764493 [0,1,0,0,0,1|0,0,2]=4 2525 B17R1.16364 CC(=O)CCc1ccc(cc1)OCC(C)(C)O 7a_100000198047_100000764493 [0,1,0,0,0,1|0,0,2]=4 2526 B17R1.16364 CC(=O)CCc1ccc(cc1)OCS(=O)(=O)[O-] 34a_100000198047_100009817235 [0,1,0,0,0,1|2,0,0]=4 2527 B17R1.16364 CC(=O)CCc1ccc(cc1)OC[Si](C)(C)C 7a_100000198047_100000233785 [0,1,0,0,0,1|1,1,0]=4 2528 B17R1.673 CC(=O)CCOc1ccc(cc1)OC(C)(C)C 7a_100000061920_100000053229 [0,1,0,0,0,1|1,0,1]=4 2529 B17R1.673 CC(=O)CCSc1ccc(cc1)CS(=O)(=O)C 62a_100000053229_100009814647 [0,1,0,0,0,1|2,0,0]=4 2530 B17R1.673 CC(=O)CCSc1ccc(cc1)CS(=O)(=O)C 62a_100009814647_100000053229 [0,1,0,0,0,1|2,0,0]=4 2531 B17R1.673 CC(=O)CCSc1ccc(cc1)NS(=O)(=O)C 62a_100000053229_200000165602 [0,1,0,0,0,1|2,0,0]=4 2532 B17R1.673 CC(=O)CCSc1ccc(cc1)NS(=O)(=O)C 62a_200000165602_100000053229 [0,1,0,0,0,1|2,0,0]=4 2533 B17R1.673 CC(=O)CCSc1ccc(cc1)OC(C)(C)C 62a_100000053229_100000701926 [0,1,0,0,0,1|1,0,1]=4 2534 B17R1.673 CC(=O)CCSc1ccc(cc1)OC(C)(C)C 62a_100000701926_100000053229 [0,1,0,0,0,1|1,0,1]=4 2535 B17R1.673 CC(=O)CCSc1ccc(cc1)O[Si](C)(C)C 62a_100000053229_100009813852 [0,1,0,0,0,1|1,1,0]=4 2536 B17R1.673 CC(=O)CCSc1ccc(cc1)O[Si](C)(C)C 62a_100009813852_100000053229 [0,1,0,0,0,1|1,1,0]=4 2537 B17R1.673 CC(=O)NCCc1ccc(cc1)OC(C)(C)C 34a_100011395907_100000210625 [0,1,0,0,0,1|1,0,1]=4 2538 B17R1.1154 C=CC(C)COCc1ccc(cc1)OC(=O)C 7a_100011215527_100000033664 [0,1,0,0,0,1|1,0,1]=4 2539 B17R1.1154 CC(=O)Oc1ccc(cc1)CNCC(C)CO 207a_100000744482_100000014718 [0,1,0,0,0,1|0,0,2]=4 2540 B17R1.1154 CC(=O)Oc1ccc(cc1)CNC[C@@H](F)CO 207a_100015665980_100000014718 [0,1,0,0,0,1|1,0,1]=4 2541 B17R1.1154 CC(=O)Oc1ccc(cc1)CNC[C@@H](F)CO 270004a_100015665980_100000014718 [0,1,0,0,0,1|1,0,1]=4 2542 B17R1.1154 CC(=O)Oc1ccc(cc1)CNC[C@H](O)CO 207a_100020644852_100000014718 [0,1,0,0,0,1|0,0,2]=4 2543 B17R1.1154 CC(=O)Oc1ccc(cc1)CNC[C@H](O)CO 2230a_100020644852_100000033664 [0,1,0,0,0,1|0,0,2]=4 2544 B17R1.1154 CC(=O)Oc1ccc(cc1)CSCC(O)CO 62a_100011219619_100000033664 [0,1,0,0,0,1|0,0,2]=4 2545 B17R1.1154 CC(=O)Oc1ccc(cc1)CSC[C@@H](C)CO 62a_100000059175_100000033664 [0,1,0,0,0,1|0,0,2]=4 2546 B17R1.1154 CC(=O)Oc1ccc(cc1)CSC[C@@H](O)CF 62a_100015614560_100000033664 [0,1,0,0,0,1|0,0,2]=4 2547 B17R1.1154 CC(=O)Oc1ccc(cc1)CSC[C@@H](O)CO 62a_100009815848_100000033664 [0,1,0,0,0,1|0,0,2]=4 2548 B17R1.1154 CC(C)Oc1ccc(cc1)CCNC(=O)CO 240690a_100015183000_100000210174 [0,1,0,0,0,1|1,0,1]=4 2549 B17R1.1154 CC(C)Oc1ccc(cc1)CCNC(=O)CO 527a_100015183000_100000210174 [0,1,0,0,0,1|1,0,1]=4 2550 B17R1.1154 CC(C)Oc1ccc(cc1)OCCC(=O)CO 1458a_100000210174_100000069049 [0,1,0,0,0,1|1,0,1]=4 2551 B17R1.1154 CCC(=O)CCOc1ccc(cc1)OC(C)C 1458a_100000210414_100000069049 [0,1,0,0,0,1|1,0,1]=4 2552 B17R1.1154 CCC(=O)CNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100000747405 [0,1,0,0,0,1|2,0,0]=4 2553 B17R1.1154 CCC(=O)COCc1ccc(cc1)NC(=O)C 34a_100000725409_100000731167 [0,1,0,0,0,1|1,0,0]=3 2554 B17R1.1154 CCC(=O)COCc1ccc(cc1)NC(=O)C 7a_100000246270_100000747405 [0,1,0,0,0,1|1,0,0]=3 2555 B17R1.1154 CCC(=O)COCc1ccc(cc1)OC(C)C 7a_100000173089_100000747405 [0,1,0,0,0,1|1,0,1]=4 2556 B17R1.1154 CCC(=O)CSCc1ccc(cc1)NC(=O)C 62a_100000747405_100000731167 [0,1,0,0,0,1|1,0,0]=3 2557 B17R1.1154 CCC(=O)CSCc1ccc(cc1)OC(=O)C 62a_100000747405_100000033664 [0,1,0,0,0,1|0,0,0]=2 2558 B17R1.1154 CCC(=O)NCCc1ccc(cc1)OC(C)C 11a_100015183000_100000210414 [0,1,0,0,0,1|1,0,1]=4 2559 B17R1.1154 CCC(=O)NCCc1ccc(cc1)OC(C)C 1626a_100015183000_100000210414 [0,1,0,0,0,1|1,0,1]=4 2560 B17R1.1154 CCC(=O)NCCc1ccc(cc1)OC(C)C 240690a_100015183000_100000210414 [0,1,0,0,0,1|1,0,1]=4 2561 B17R1.1154 CCC(=O)NCCc1ccc(cc1)OC(C)C 527a_100015183000_100000210414 [0,1,0,0,0,1|1,0,1]=4 2562 B17R1.1154 CCC(C)CNCc1ccc(cc1)OC(=O)C 207a_100020588543_100000014718 [0,1,0,0,0,1|1,0,1]=4 2563 B17R1.1154 CCC(C)CNCc1ccc(cc1)OC(=O)C 2230a_100020588543_100000033664 [0,1,0,0,0,1|1,0,1]=4 2564 B17R1.1154 CCC(C)CNCc1ccc(cc1)OC(=O)C 270004a_100020588543_100000014718 [0,1,0,0,0,1|1,0,1]=4 2565 B17R1.1154 CCC(C)CSCc1ccc(cc1)OC(=O)C 62a_100000748023_100000033664 [0,1,0,0,0,1|1,0,1]=4 2566 B17R1.1154 CCC(O)CNCc1ccc(cc1)OC(=O)C 207a_100011218483_100000014718 [0,1,0,0,0,1|0,0,2]=4 2567 B17R1.1154 CCC(O)CNCc1ccc(cc1)OC(=O)C 2230a_100011218483_100000033664 [0,1,0,0,0,1|0,0,2]=4 2568 B17R1.1154 CCC(O)CNCc1ccc(cc1)OC(=O)C 270004a_100011218483_100000014718 [0,1,0,0,0,1|0,0,2]=4 2569 B17R1.1154 CCC(O)CSCc1ccc(cc1)OC(=O)C 62a_100011218378_100000033664 [0,1,0,0,0,1|0,0,2]=4 2570 B17R1.1154 CC[C@H](C)COCc1ccc(cc1)OC(=O)C 7a_100009816381_100000033664 [0,1,0,0,0,1|1,0,1]=4 2571 B17R1.1154 CC[C@H](C)CSCc1ccc(cc1)OC(=O)C 62a_100009816398_100000033664 [0,1,0,0,0,1|1,0,1]=4 2572 B17R1.1154 CNC(=O)CCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000737683 [0,1,0,0,0,1|2,0,0]=4 2573 B17R1.1154 CNC(=O)CCNc1ccc(cc1)CC(=O)N 34a_100000738315_100012179268 [0,1,0,0,0,1|2,0,0]=4 2574 B17R1.1154 CNC(=O)CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100012179268 [0,1,0,0,0,1|1,0,0]=3 2575 B17R1.1154 CNC(=O)CCNc1ccc(cc1)OC(C)C 2230a_100011194259_100000737683 [0,1,0,0,0,1|1,0,1]=4 2576 B17R1.1154 CNC(=O)CCNc1ccc(cc1)OC(C)C 34a_100011194259_100012179268 [0,1,0,0,0,1|1,0,1]=4 2577 B17R1.1154 CNC(=O)CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100012179268 [0,1,0,0,0,1|1,0,0]=3 2578 B17R1.1154 CNC(=O)CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000737683 [0,1,0,0,0,1|1,0,0]=3 2579 B17R1.1154 CNC(=O)CCOc1ccc(cc1)CC(=O)N 34a_100000020825_100012179268 [0,1,0,0,0,1|2,0,0]=4 2580 B17R1.1154 CNC(=O)CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100012179268 [0,1,0,0,0,1|1,0,0]=3 2581 B17R1.1154 CNC(=O)CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000737683 [0,1,0,0,0,1|1,0,0]=3 2582 B17R1.1154 CNC(=O)CCOc1ccc(cc1)OC(C)C 34a_100000757185_100012179268 [0,1,0,0,0,1|1,0,1]=4 2583 B17R1.1154 CNC(=O)CCOc1ccc(cc1)OC(C)C 7a_100000757185_100000737683 [0,1,0,0,0,1|1,0,1]=4 2584 B17R1.1154 CNC(=O)CCOc1ccc(nc1)NC(=O)C 34a_200000094647_100012179268 [0,1,0,0,0,1|2,0,0]=4 2585 B17R1.1154 CNC(=O)CCOc1ccc(nc1)NC(=O)C 7a_200000094647_100000737683 [0,1,0,0,0,1|2,0,0]=4 2586 B17R1.1154 CNC(=O)CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000737683 [0,1,0,0,0,1|1,0,0]=3 2587 B17R1.1154 CNC(=O)CCSc1ccc(cc1)CC(=O)C 62a_100000737683_100000691760 [0,1,0,0,0,1|1,0,0]=3 2588 B17R1.1154 CNC(=O)CCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000737683 [0,1,0,0,0,1|2,0,0]=4 2589 B17R1.1154 CNC(=O)CCSc1ccc(cc1)CC(=O)N 62a_100000737683_100000162331 [0,1,0,0,0,1|2,0,0]=4 2590 B17R1.1154 CNC(=O)CCSc1ccc(cc1)NC(=O)C 62a_100000737683_100000155215 [0,1,0,0,0,1|1,0,0]=3 2591 B17R1.1154 CNC(=O)CCSc1ccc(cc1)NC(=O)N 62a_100000737683_100000198584 [0,1,0,0,0,1|2,0,0]=4 2592 B17R1.1154 CNC(=O)CCSc1ccc(cc1)OC(=O)C 62a_100000737683_100000002173 [0,1,0,0,0,1|0,0,0]=2 2593 B17R1.1154 CNC(=O)CCSc1ccc(cc1)OC(=S)C 62a_100000737683_200009816735 [0,1,0,0,0,1|0,1,0]=3 2594 B17R1.1154 CNC(=O)CCSc1ccc(cc1)OC(C)C 62a_100000169947_100000737683 [0,1,0,0,0,1|1,0,1]=4 2595 B17R1.1154 CNC(=O)CCSc1ccc(cc1)OC(C)C 62a_100000737683_100000169947 [0,1,0,0,0,1|1,0,1]=4 2596 B17R1.1154 CNC(=O)CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000737683 [0,1,0,0,0,1|0,1,0]=3 2597 B17R1.1154 CNC(=O)CCSc1ccc(cn1)NC(=O)C 62a_100000737683_100011934715 [0,1,0,0,0,1|2,0,0]=4 2598 B17R1.1154 CNC(=O)CCSc1ccc(nc1)NC(=O)C 62a_100000737683_100000193312 [0,1,0,0,0,1|2,0,0]=4 2599 B17R1.1154 CNC(=O)CNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100000183359 [0,1,0,0,0,1|2,0,0]=4 2600 B17R1.1154 CNC(=O)CNCc1ccc(cc1)NC(=O)C 207a_100000693194_100000210072 [0,1,0,0,0,1|1,0,0]=3 2601 B17R1.1154 CNC(=O)CNCc1ccc(cc1)NC(=O)C 2230a_100000693194_100000731167 [0,1,0,0,0,1|1,0,0]=3 2602 B17R1.1154 CNC(=O)CNCc1ccc(cc1)NC(=O)C 34a_100000735448_100000183359 [0,1,0,0,0,1|1,0,0]=3 2603 B17R1.1154 CNC(=O)CNCc1ccc(cc1)OC(=O)C 207a_100000693194_100000014718 [0,1,0,0,0,1|0,0,0]=2 2604 B17R1.1154 CNC(=O)CNCc1ccc(cc1)OC(=O)C 2230a_100000693194_100000033664 [0,1,0,0,0,1|0,0,0]=2 2605 B17R1.1154 CNC(=O)CNCc1ccc(cc1)OC(=O)C 270004a_100000693194_100000014718 [0,1,0,0,0,1|0,0,0]=2 2606 B17R1.1154 CNC(=O)CNCc1ccc(cc1)OC(C)C 207a_100000693194_100000169837 [0,1,0,0,0,1|1,0,1]=4 2607 B17R1.1154 CNC(=O)CNCc1ccc(cc1)OC(C)C 2230a_100020586559_100000183359 [0,1,0,0,0,1|1,0,1]=4 2608 B17R1.1154 CNC(=O)CNCc1ccc(cc1)OC(C)C 270004a_100000693194_100000169837 [0,1,0,0,0,1|1,0,1]=4 2609 B17R1.1154 CNC(=O)CNCc1ccc(cc1)OC(C)C 34a_100020586559_100000183359 [0,1,0,0,0,1|1,0,1]=4 2610 B17R1.1154 CNC(=O)COCc1ccc(cc1)NC(=O)C 34a_100000246270_100000183359 [0,1,0,0,0,1|1,0,0]=3 2611 B17R1.1154 CNC(=O)COCc1ccc(cc1)NC(=O)C 34a_100000750040_100000731167 [0,1,0,0,0,1|1,0,0]=3 2612 B17R1.1154 CNC(=O)COCc1ccc(cc1)NC(=O)C 7a_100000246270_100000183359 [0,1,0,0,0,1|1,0,0]=3 2613 B17R1.1154 CNC(=O)COCc1ccc(cc1)OC(C)C 34a_100000173089_100000183359 [0,1,0,0,0,1|1,0,1]=4 2614 B17R1.1154 CNC(=O)COCc1ccc(cc1)OC(C)C 7a_100000173089_100000183359 [0,1,0,0,0,1|1,0,1]=4 2615 B17R1.1154 CNC(=O)CSCc1ccc(cc1)NC(=O)C 62a_100000183359_100000731167 [0,1,0,0,0,1|1,0,0]=3 2616 B17R1.1154 CNC(=O)CSCc1ccc(cc1)OC(=O)C 62a_100000183359_100000033664 [0,1,0,0,0,1|0,0,0]=2 2617 B17R1.1154 CNC(=O)NCCc1ccc(cc1)OC(C)C 2708a_100015183000_106832991635 [0,1,0,0,0,1|1,0,1]=4 2618 B17R1.1154 CNC(=O)NCCc1ccc(cc1)OC(C)C 2708a_100102657272_100015183000 [0,1,0,0,0,1|1,0,1]=4 2619 B17R1.1154 CNC(=O)NCCc1ccc(cc1)OC(C)C 273464a_100015183000_100102657272 [0,1,0,0,0,1|1,0,1]=4 2620 B17R1.1154 CNC(=O)NCCc1ccc(cc1)OC(C)C 273464a_100102657272_100015183000 [0,1,0,0,0,1|1,0,1]=4 2621 B17R1.1154 CNC(=O)NCCc1ccc(cc1)OC(C)C 512a_100015183000_100102657272 [0,1,0,0,0,1|1,0,1]=4 2622 B17R1.1154 CNC(=O)NCCc1ccc(cc1)OC(C)C 512a_106832991638_100015183000 [0,1,0,0,0,1|1,0,1]=4 2623 B17R1.1154 COC(=O)CCCc1ccc(cc1)C=C(C)C 271570a_100102525489_100010209878 [0,1,0,0,0,1|2,0,0]=4 2624 B17R1.1154 COC(=O)CCCc1ccc(cc1)NC(=O)C 188690a_100000085249_100015343762 [0,1,0,0,0,1|1,0,0]=3 2625 B17R1.1154 COC(=O)CCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000204255 [0,1,0,0,0,1|2,0,0]=4 2626 B17R1.1154 COC(=O)CCNc1ccc(cc1)CC(=O)N 34a_100000738315_100000742370 [0,1,0,0,0,1|2,0,0]=4 2627 B17R1.1154 COC(=O)CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000742370 [0,1,0,0,0,1|1,0,0]=3 2628 B17R1.1154 COC(=O)CCNc1ccc(cc1)OC(C)C 2230a_100011194259_100000204255 [0,1,0,0,0,1|1,0,1]=4 2629 B17R1.1154 COC(=O)CCNc1ccc(cc1)OC(C)C 34a_100009933425_100000210206 [0,1,0,0,0,1|1,0,1]=4 2630 B17R1.1154 COC(=O)CCNc1ccc(cc1)OC(C)C 34a_100011194259_100000742370 [0,1,0,0,0,1|1,0,1]=4 2631 B17R1.1154 COC(=O)CCNc1ccc(cc1)OC(C)C 7a_100009933425_100000210206 [0,1,0,0,0,1|1,0,1]=4 2632 B17R1.1154 COC(=O)CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000742370 [0,1,0,0,0,1|1,0,0]=3 2633 B17R1.1154 COC(=O)CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000204255 [0,1,0,0,0,1|1,0,0]=3 2634 B17R1.1154 COC(=O)CCOc1ccc(cc1)CC(=O)N 34a_100000020825_100000742370 [0,1,0,0,0,1|2,0,0]=4 2635 B17R1.1154 COC(=O)CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000742370 [0,1,0,0,0,1|1,0,0]=3 2636 B17R1.1154 COC(=O)CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000204255 [0,1,0,0,0,1|1,0,0]=3 2637 B17R1.1154 COC(=O)CCOc1ccc(cc1)OC(C)C 34a_100000757185_100000742370 [0,1,0,0,0,1|1,0,1]=4 2638 B17R1.1154 COC(=O)CCOc1ccc(cc1)OC(C)C 7a_100000757185_100000204255 [0,1,0,0,0,1|1,0,1]=4 2639 B17R1.1154 COC(=O)CCOc1ccc(nc1)NC(=O)C 34a_200000094647_100000742370 [0,1,0,0,0,1|2,0,0]=4 2640 B17R1.1154 COC(=O)CCOc1ccc(nc1)NC(=O)C 7a_200000094647_100000204255 [0,1,0,0,0,1|2,0,0]=4 2641 B17R1.1154 COC(=O)CCSc1ccc(cc1)CC(=O)C 62a_100000204255_100000691760 [0,1,0,0,0,1|1,0,0]=3 2642 B17R1.1154 COC(=O)CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000204255 [0,1,0,0,0,1|1,0,0]=3 2643 B17R1.1154 COC(=O)CCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000204255 [0,1,0,0,0,1|2,0,0]=4 2644 B17R1.1154 COC(=O)CCSc1ccc(cc1)CC(=O)N 62a_100000204255_100000162331 [0,1,0,0,0,1|2,0,0]=4 2645 B17R1.1154 COC(=O)CCSc1ccc(cc1)NC(=O)C 62a_100000204255_100000155215 [0,1,0,0,0,1|1,0,0]=3 2646 B17R1.1154 COC(=O)CCSc1ccc(cc1)NC(=O)N 62a_100000204255_100000198584 [0,1,0,0,0,1|2,0,0]=4 2647 B17R1.1154 COC(=O)CCSc1ccc(cc1)OC(=O)C 62a_100000204255_100000002173 [0,1,0,0,0,1|0,0,0]=2 2648 B17R1.1154 COC(=O)CCSc1ccc(cc1)OC(=S)C 62a_100000204255_200009816735 [0,1,0,0,0,1|0,1,0]=3 2649 B17R1.1154 COC(=O)CCSc1ccc(cc1)OC(C)C 62a_100000169947_100000204255 [0,1,0,0,0,1|1,0,1]=4 2650 B17R1.1154 COC(=O)CCSc1ccc(cc1)OC(C)C 62a_100000204255_100000169947 [0,1,0,0,0,1|1,0,1]=4 2651 B17R1.1154 COC(=O)CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000204255 [0,1,0,0,0,1|0,1,0]=3 2652 B17R1.1154 COC(=O)CCSc1ccc(cn1)NC(=O)C 62a_100000204255_100011934715 [0,1,0,0,0,1|2,0,0]=4 2653 B17R1.1154 COC(=O)CCSc1ccc(nc1)NC(=O)C 62a_100000204255_100000193312 [0,1,0,0,0,1|2,0,0]=4 2654 B17R1.1154 COC(=O)CNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100000747449 [0,1,0,0,0,1|2,0,0]=4 2655 B17R1.1154 COC(=O)CNCc1ccc(cc1)NC(=O)C 34a_100000735448_100000747449 [0,1,0,0,0,1|1,0,0]=3 2656 B17R1.1154 COC(=O)CNCc1ccc(cc1)OC(C)C 2230a_100020586559_100000747449 [0,1,0,0,0,1|1,0,1]=4 2657 B17R1.1154 COC(=O)CNCc1ccc(cc1)OC(C)C 34a_100020586559_100000747449 [0,1,0,0,0,1|1,0,1]=4 2658 B17R1.1154 COC(=O)COCc1ccc(cc1)NC(=O)C 34a_100000246270_100000747449 [0,1,0,0,0,1|1,0,0]=3 2659 B17R1.1154 COC(=O)COCc1ccc(cc1)NC(=O)C 7a_100000246270_100000747449 [0,1,0,0,0,1|1,0,0]=3 2660 B17R1.1154 COC(=O)COCc1ccc(cc1)OC(C)C 34a_100000173089_100000747449 [0,1,0,0,0,1|1,0,1]=4 2661 B17R1.1154 COC(=O)COCc1ccc(cc1)OC(C)C 7a_100000173089_100000747449 [0,1,0,0,0,1|1,0,1]=4 2662 B17R1.1154 COC(=O)CSCc1ccc(cc1)NC(=O)C 62a_100000747449_100000731167 [0,1,0,0,0,1|1,0,0]=3 2663 B17R1.1154 COC(=O)CSCc1ccc(cc1)OC(=O)C 62a_100000747449_100000033664 [0,1,0,0,0,1|0,0,0]=2 2664 B17R1.1154 COC(=O)OCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000139417 [0,1,0,0,0,1|2,0,0]=4 2665 B17R1.1154 COC(=O)OCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000139417 [0,1,0,0,0,1|1,1,0]=4 2666 B17R1.1154 CO[C@H](C)CNCc1ccc(cc1)OC(=O)C 207a_100020591295_100000014718 [0,1,0,0,0,1|0,0,2]=4 2667 B17R1.1154 CO[C@H](C)CNCc1ccc(cc1)OC(=O)C 2230a_100020591295_100000033664 [0,1,0,0,0,1|0,0,2]=4 2668 B17R1.1154 CO[C@H](C)CNCc1ccc(cc1)OC(=O)C 270004a_100020591295_100000014718 [0,1,0,0,0,1|0,0,2]=4 2669 B17R1.1313 CC(=O)Cc1ccc(cc1)OCCS(=O)(=O)C 34a_100011218180_100000731031 [0,1,0,0,0,1|2,0,0]=4 2670 B17R1.1313 CC(=O)Cc1ccc(cc1)OCCS(=O)(=O)C 7a_100011218180_100000230027 [0,1,0,0,0,1|2,0,0]=4 2671 B17R1.1313 CC(=O)Cc1ccc(cc1)SCCS(=O)(=O)C 62a_100000691760_100000230027 [0,1,0,0,0,1|2,0,0]=4 2672 B17R1.1313 CC(=O)Cc1ccc(cc1)SCCS(=O)(=O)C 62a_100000731031_100000691760 [0,1,0,0,0,1|2,0,0]=4 2673 B17R1.1313 CC(=O)Nc1ccc(cc1)NCCS(=O)(=O)C 34a_100000184111_100000731031 [0,1,0,0,0,1|2,0,0]=4 2674 B17R1.1313 CC(=O)Nc1ccc(cc1)OCCS(=O)(=O)C 34a_100000184395_100000731031 [0,1,0,0,0,1|2,0,0]=4 2675 B17R1.1313 CC(=O)Nc1ccc(cc1)OCCS(=O)(=O)C 7a_100000184395_100000230027 [0,1,0,0,0,1|2,0,0]=4 2676 B17R1.1313 CC(=O)Nc1ccc(cc1)SCCS(=O)(=O)C 62a_100000731031_100000155215 [0,1,0,0,0,1|2,0,0]=4 2677 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)C 207a_100000743828_100000014718 [0,1,0,0,0,1|1,0,1]=4 2678 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)C 2230a_100000743828_100000033664 [0,1,0,0,0,1|1,0,1]=4 2679 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)C 270004a_100000743828_100000014718 [0,1,0,0,0,1|1,0,1]=4 2680 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)F 207a_100020643315_100000014718 [0,1,0,0,0,1|1,0,1]=4 2681 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)F 2230a_100020643315_100000033664 [0,1,0,0,0,1|1,0,1]=4 2682 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)F 270004a_100020643315_100000014718 [0,1,0,0,0,1|1,0,1]=4 2683 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)O 207a_100000751335_100000014718 [0,1,0,0,0,1|0,0,2]=4 2684 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)O 2230a_100000751335_100000033664 [0,1,0,0,0,1|0,0,2]=4 2685 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(C)O 270004a_100000751335_100000014718 [0,1,0,0,0,1|0,0,2]=4 2686 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(F)F 207a_100000731000_100000014718 [0,1,0,0,0,1|1,0,1]=4 2687 B17R1.1313 CC(=O)Oc1ccc(cc1)CNCC(C)(F)F 270004a_100000731000_100000014718 [0,1,0,0,0,1|1,0,1]=4 2688 B17R1.1313 CC(=O)Oc1ccc(cc1)CSCC(C)(C)C 62a_100011219605_100000033664 [0,1,0,0,0,1|1,0,1]=4 2689 B17R1.1313 CC(=O)Oc1ccc(cc1)CSCC(C)(C)F 62a_100011997219_100000033664 [0,1,0,0,0,1|1,0,1]=4 2690 B17R1.1313 CC(=O)Oc1ccc(cc1)CSCC(C)(C)O 62a_100000764493_100000033664 [0,1,0,0,0,1|0,0,2]=4 2691 B17R1.1313 CC(=O)Oc1ccc(cc1)CSCS(=O)(=O)N 62a_100000741382_100000033664 [0,1,0,0,0,1|2,0,0]=4 2692 B17R1.1313 CC(=O)Oc1ccc(cc1)CSCS(=O)(=O)[O-] 62a_100009817235_100000033664 [0,1,0,0,0,1|2,0,0]=4 2693 B17R1.1313 CC(=O)Oc1ccc(cc1)CSC[N+](C)(C)C 62a_200000036245_100000033664 [0,1,0,0,0,1|2,0,0]=4 2694 B17R1.1313 CC(=O)Oc1ccc(cc1)CSC[Si](C)(C)C 62a_100000037933_100000033664 [0,1,0,0,0,1|1,1,0]=4 2695 B17R1.1313 CC(=O)Oc1ccc(cc1)SCCC(C)(C)C 62a_100000755188_100000002173 [0,1,0,0,0,1|1,0,1]=4 2696 B17R1.1313 CC(=O)Oc1ccc(cc1)SCCC(C)(C)O 62a_100000702414_100000002173 [0,1,0,0,0,1|0,0,2]=4 2697 B17R1.1313 CC(=O)Oc1ccc(cc1)SCCS(=O)(=O)C 62a_100000731031_100000002173 [0,1,0,0,0,1|1,0,0]=3 2698 B17R1.1313 CC(=O)Oc1ccc(cc1)SCCS(=O)(=O)[O-] 62a_100000762736_100000002173 [0,1,0,0,0,1|2,0,0]=4 2699 B17R1.1313 CC(=O)Oc1ccc(cc1)SCC[N+](C)(C)C 62a_100000085578_100000002173 [0,1,0,0,0,1|2,0,0]=4 2700 B17R1.1313 CC(=O)Oc1ccc(cc1)SCC[Si](C)(C)C 62a_200000733723_100000002173 [0,1,0,0,0,1|1,1,0]=4 2701 B17R1.1313 CC(=O)Sc1ccc(cc1)SCCS(=O)(=O)C 62a_200009995050_100000230027 [0,1,0,0,0,1|1,1,0]=4 2702 B17R1.1313 CC(=S)Oc1ccc(cc1)SCCS(=O)(=O)C 62a_100000731031_200009816735 [0,1,0,0,0,1|1,1,0]=4 2703 B17R1.1318 C=C(C)CCNc1ccc(cc1)N(C)C(=O)C 34a_100000229935_100000730704 [0,1,0,0,0,1|2,0,0]=4 2704 B17R1.1318 C=C(C)CCOc1ccc(cc1)N(C)C(=O)C 34a_100000743460_100000730704 [0,1,0,0,0,1|2,0,0]=4 2705 B17R1.1318 C=C(C)CCSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100000730704 [0,1,0,0,0,1|2,0,0]=4 2706 B17R1.1318 CC(=O)CCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100000053229 [0,1,0,0,0,1|2,0,0]=4 2707 B17R1.1318 CC(=O)CCSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100000053229 [0,1,0,0,0,1|1,0,0]=3 2708 B17R1.1318 CC(=O)N(C)c1ccc(cc1)NCCC(=O)N 34a_100000229935_100000731001 [0,1,0,0,0,1|2,0,0]=4 2709 B17R1.1318 CC(=O)N(C)c1ccc(cc1)OCCC(=O)N 34a_100000743460_100000731001 [0,1,0,0,0,1|2,0,0]=4 2710 B17R1.1318 CC(=O)N(C)c1ccc(cc1)SCCC(=O)N 62a_200009816415_100000744528 [0,1,0,0,0,1|2,0,0]=4 2711 B17R1.1318 CC(=O)OCCc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_200016374084 [0,1,0,0,0,1|2,0,0]=4 2712 B17R1.1318 CC(=O)OCNc1ccc(cc1)N(C)C(=O)C 34a_100000229935_100009813279 [0,1,0,0,0,1|2,0,0]=4 2713 B17R1.1318 CC(=O)OCOc1ccc(cc1)N(C)C(=O)C 34a_100000743460_100009813279 [0,1,0,0,0,1|2,0,0]=4 2714 B17R1.1318 CC(=O)OCSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100000076356 [0,1,0,0,0,1|2,0,0]=4 2715 B17R1.4793 C#CC(C)Oc1ccc(cc1)CCNC(=O)C 34a_100011395907_200000035995 [0,1,0,0,0,1|1,0,1]=4 2716 B17R1.4793 C=C(C)CCNc1ccc(cc1)CC(=O)NC 2230a_100000736799_100000730704 [0,1,0,0,0,1|2,0,0]=4 2717 B17R1.4793 C=C(C)CCNc1ccc(cc1)CC(=O)NC 34a_100000736799_100000730704 [0,1,0,0,0,1|2,0,0]=4 2718 B17R1.4793 C=C(C)CCNc1ccc(cc1)NC(=O)CC 34a_100000186511_100000730704 [0,1,0,0,0,1|2,0,0]=4 2719 B17R1.4793 C=C(C)CCNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000730704 [0,1,0,0,0,1|2,0,0]=4 2720 B17R1.4793 C=C(C)CCOc1ccc(cc1)CC(=O)NC 34a_200000020795_100000730704 [0,1,0,0,0,1|2,0,0]=4 2721 B17R1.4793 C=C(C)CCOc1ccc(cc1)CC(=O)OC 34a_100000211648_100000730704 [0,1,0,0,0,1|2,0,0]=4 2722 B17R1.4793 C=C(C)CCOc1ccc(cc1)NC(=O)CC 34a_200000243810_100000730704 [0,1,0,0,0,1|2,0,0]=4 2723 B17R1.4793 C=C(C)CCOc1ccc(cc1)NC(=O)CC 7a_200000243810_100000730704 [0,1,0,0,0,1|2,0,0]=4 2724 B17R1.4793 C=C(C)CCOc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000730704 [0,1,0,0,0,1|2,0,0]=4 2725 B17R1.4793 C=C(C)CCOc1ccc(cc1)NC(=O)OC 34a_100011235918_100000730704 [0,1,0,0,0,1|2,0,0]=4 2726 B17R1.4793 C=C(C)CCSc1ccc(cc1)CC(=O)NC 62a_100000155101_100000730704 [0,1,0,0,0,1|2,0,0]=4 2727 B17R1.4793 C=C(C)CCSc1ccc(cc1)CC(=O)NC 62a_100000730704_100000155101 [0,1,0,0,0,1|2,0,0]=4 2728 B17R1.4793 C=C(C)CCSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000730704 [0,1,0,0,0,1|2,0,0]=4 2729 B17R1.4793 C=C(C)CCSc1ccc(cc1)CC(=O)OC 62a_100000730704_100000149743 [0,1,0,0,0,1|2,0,0]=4 2730 B17R1.4793 C=C(C)CCSc1ccc(cc1)NC(=O)CN 62a_100000730704_100000741985 [0,1,0,0,0,1|2,0,0]=4 2731 B17R1.4793 C=C(C)CCSc1ccc(cc1)NC(=O)OC 62a_100000730704_100000181880 [0,1,0,0,0,1|2,0,0]=4 2732 B17R1.4793 C=C(C)CCSc1ccc(cc1)OC(=O)CC 62a_100000730704_200009811598 [0,1,0,0,0,1|1,0,0]=3 2733 B17R1.4793 C=C(C)COCc1ccc(cc1)CC(=O)OC 34a_100000087118_100000748629 [0,1,0,0,0,1|2,0,0]=4 2734 B17R1.4793 C=C(C)COCc1ccc(cc1)CC(=O)OC 34a_100000210245_100009816886 [0,1,0,0,0,1|2,0,0]=4 2735 B17R1.4793 C=C(C)CSCc1ccc(cc1)CC(=O)OC 62a_100000748629_100009816886 [0,1,0,0,0,1|2,0,0]=4 2736 B17R1.4793 C=C(C)CSCc1ccc(cc1)CC(=O)OC 62a_100009816886_100000211660 [0,1,0,0,0,1|2,0,0]=4 2737 B17R1.4793 CC(=O)CCSc1ccc(cc1)NC(=O)CN 62a_100000053229_100000741985 [0,1,0,0,0,1|1,0,0]=3 2738 B17R1.4793 CC(=O)NCCc1ccc(cc1)OC(C)C#N 7a_100011395907_100000703298 [0,1,0,0,0,1|1,0,1]=4 2739 B17R1.4793 CC(=O)NCCc1ccc(cc1)OC(C)CO 34a_100011395907_100012180447 [0,1,0,0,0,1|0,0,2]=4 2740 B17R1.4793 CC(=O)NCCc1ccc(cc1)OC(C)CO 7a_100011395907_100012180447 [0,1,0,0,0,1|0,0,2]=4 2741 B17R1.4793 CC(=O)OCNc1ccc(cc1)NC(=O)CO 34a_100011269904_100009813279 [0,1,0,0,0,1|2,0,0]=4 2742 B17R1.4793 CC(=O)OCOc1ccc(cc1)NC(=O)CCl 34a_100000233757_100009813279 [0,1,0,0,0,1|2,0,0]=4 2743 B17R1.4793 CC(=O)OCSc1ccc(cc1)NC(=O)CN 62a_100000076356_100000741985 [0,1,0,0,0,1|2,0,0]=4 2744 B17R1.4793 CCC(=O)Nc1ccc(cc1)NCCC(=O)N 34a_100000186511_100000731001 [0,1,0,0,0,1|2,0,0]=4 2745 B17R1.4793 CCC(=O)Nc1ccc(cc1)NCOC(=O)C 34a_100000186511_100009813279 [0,1,0,0,0,1|2,0,0]=4 2746 B17R1.4793 CCC(=O)Nc1ccc(cc1)OCCC(=O)C 7a_200000243810_100000053229 [0,1,0,0,0,1|1,0,0]=3 2747 B17R1.4793 CCC(=O)Nc1ccc(cc1)OCCC(=O)N 34a_200000243810_100000731001 [0,1,0,0,0,1|2,0,0]=4 2748 B17R1.4793 CCC(=O)Nc1ccc(cc1)OCCC(=O)N 7a_200000243810_100000744528 [0,1,0,0,0,1|2,0,0]=4 2749 B17R1.4793 CCC(=O)Nc1ccc(cc1)OCOC(=O)C 34a_200000243810_100009813279 [0,1,0,0,0,1|2,0,0]=4 2750 B17R1.4793 CCC(=O)Oc1ccc(cc1)C=NNC(=O)C 4a_100000189765_200000014686 [0,1,0,0,0,1|1,0,1]=4 2751 B17R1.4793 CCC(=O)Oc1ccc(cc1)CNCC(C)C 270004a_100000210953_200000014686 [0,1,0,0,0,1|1,0,1]=4 2752 B17R1.4793 CCC(=O)Oc1ccc(cc1)CNCC(C)O 270004a_100000210904_200000014686 [0,1,0,0,0,1|0,0,2]=4 2753 B17R1.4793 CCC(=O)Oc1ccc(cc1)SCC=C(C)C 62a_100000761012_200009811598 [0,1,0,0,0,1|1,0,1]=4 2754 B17R1.4793 CCC(=O)Oc1ccc(cc1)SCCC(=O)C 62a_100000053229_200009811598 [0,1,0,0,0,1|0,0,0]=2 2755 B17R1.4793 CCC(=O)Oc1ccc(cc1)SCCC(=O)N 62a_100000744528_200009811598 [0,1,0,0,0,1|1,0,0]=3 2756 B17R1.4793 CCC(=O)Oc1ccc(cc1)SCCC(C)C 62a_100000210312_200009811598 [0,1,0,0,0,1|1,0,1]=4 2757 B17R1.4793 CCC(=O)Oc1ccc(cc1)SCCC(C)O 62a_100012276601_200009811598 [0,1,0,0,0,1|0,0,2]=4 2758 B17R1.4793 CCC(=O)Oc1ccc(cc1)SCOC(=O)C 62a_100000076356_200009811598 [0,1,0,0,0,1|1,0,0]=3 2759 B17R1.4793 CCC(C)Oc1ccc(cc1)CCNC(=O)C 34a_100011395907_100011215416 [0,1,0,0,0,1|1,0,1]=4 2760 B17R1.4793 CCC(C)Oc1ccc(cc1)CCNC(=O)C 7a_100011395907_100000758301 [0,1,0,0,0,1|1,0,1]=4 2761 B17R1.4793 CCC(C)Oc1ccc(cc1)NCCC(=O)C 7a_100000743956_100000053229 [0,1,0,0,0,1|1,0,1]=4 2762 B17R1.4793 CNC(=O)Cc1ccc(cc1)NCCC(=O)N 2230a_100000736799_100000744528 [0,1,0,0,0,1|2,0,0]=4 2763 B17R1.4793 CNC(=O)Cc1ccc(cc1)NCCC(=O)N 34a_100000736799_100000731001 [0,1,0,0,0,1|2,0,0]=4 2764 B17R1.4793 CNC(=O)Cc1ccc(cc1)NCOC(=O)C 34a_100000736799_100009813279 [0,1,0,0,0,1|2,0,0]=4 2765 B17R1.4793 CNC(=O)Cc1ccc(cc1)OCCC(=O)N 34a_200000020795_100000731001 [0,1,0,0,0,1|2,0,0]=4 2766 B17R1.4793 CNC(=O)Cc1ccc(cc1)OCOC(=O)C 34a_200000020795_100009813279 [0,1,0,0,0,1|2,0,0]=4 2767 B17R1.4793 CNC(=O)Cc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000155101 [0,1,0,0,0,1|1,0,0]=3 2768 B17R1.4793 CNC(=O)Cc1ccc(cc1)SCCC(=O)C 62a_100000155101_100000053229 [0,1,0,0,0,1|1,0,0]=3 2769 B17R1.4793 CNC(=O)Cc1ccc(cc1)SCCC(=O)N 62a_100000155101_100000744528 [0,1,0,0,0,1|2,0,0]=4 2770 B17R1.4793 CNC(=O)Cc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000155101 [0,1,0,0,0,1|2,0,0]=4 2771 B17R1.4793 CNC(=O)Cc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000155101 [0,1,0,0,0,1|2,0,0]=4 2772 B17R1.4793 CNC(=O)Cc1ccc(cc1)SCOC(=O)C 62a_100000155101_100000076356 [0,1,0,0,0,1|2,0,0]=4 2773 B17R1.4793 COC(=O)Cc1ccc(cc1)CNCC(=O)N 2230a_100000711301_100009816886 [0,1,0,0,0,1|2,0,0]=4 2774 B17R1.4793 COC(=O)Cc1ccc(cc1)CNCC(=O)O 269956a_100016091260_100009816886 [0,1,0,0,0,1|2,0,0]=4 2775 B17R1.4793 COC(=O)Cc1ccc(cc1)COCC(=O)C 34a_100000211253_100009816886 [0,1,0,0,0,1|1,0,0]=3 2776 B17R1.4793 COC(=O)Cc1ccc(cc1)COCC(=O)N 34a_100000087118_100000187820 [0,1,0,0,0,1|2,0,0]=4 2777 B17R1.4793 COC(=O)Cc1ccc(cc1)COCC(=O)[O-] 34a_100000087118_100020667443 [0,1,0,0,0,1|2,0,0]=4 2778 B17R1.4793 COC(=O)Cc1ccc(cc1)CSCC(=O)N 62a_100000747473_100009816886 [0,1,0,0,0,1|2,0,0]=4 2779 B17R1.4793 COC(=O)Cc1ccc(cc1)CSCC(=O)N 62a_100009816886_100000747473 [0,1,0,0,0,1|2,0,0]=4 2780 B17R1.4793 COC(=O)Cc1ccc(cc1)CSCC(=O)[O-] 62a_100009816886_100020667443 [0,1,0,0,0,1|2,0,0]=4 2781 B17R1.4793 COC(=O)Cc1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100009816886 [0,1,0,0,0,1|2,0,0]=4 2782 B17R1.4793 COC(=O)Cc1ccc(cc1)OCCC(=O)N 34a_100000211648_100000731001 [0,1,0,0,0,1|2,0,0]=4 2783 B17R1.4793 COC(=O)Cc1ccc(cc1)OCOC(=O)C 34a_100000211648_100009813279 [0,1,0,0,0,1|2,0,0]=4 2784 B17R1.4793 COC(=O)Cc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000149743 [0,1,0,0,0,1|1,0,0]=3 2785 B17R1.4793 COC(=O)Cc1ccc(cc1)SCCC(=O)C 62a_100000149743_100000053229 [0,1,0,0,0,1|1,0,0]=3 2786 B17R1.4793 COC(=O)Cc1ccc(cc1)SCCC(=O)N 62a_100000149743_100000744528 [0,1,0,0,0,1|2,0,0]=4 2787 B17R1.4793 COC(=O)Cc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000149743 [0,1,0,0,0,1|2,0,0]=4 2788 B17R1.4793 COC(=O)Cc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000149743 [0,1,0,0,0,1|2,0,0]=4 2789 B17R1.4793 COC(=O)Cc1ccc(cc1)SCOC(=O)C 62a_100000149743_100000076356 [0,1,0,0,0,1|2,0,0]=4 2790 B17R1.4793 COC(=O)Cc1ccc(cn1)SCCC(=O)C 62a_100000053229_100012362609 [0,1,0,0,0,1|2,0,0]=4 2791 B17R1.4793 COC(=O)Cc1ccc(cn1)SCCC(=O)C 62a_100012362609_100000053229 [0,1,0,0,0,1|2,0,0]=4 2792 B17R1.4793 COC(=O)Cc1ccc(nc1)SCCC(=O)C 62a_100000053229_100000071674 [0,1,0,0,0,1|2,0,0]=4 2793 B17R1.4793 COC(=O)Cc1ccc(nc1)SCCC(=O)C 62a_100000071674_100000053229 [0,1,0,0,0,1|2,0,0]=4 2794 B17R1.4793 COC(=O)Nc1ccc(cc1)OCCC(=O)N 34a_100011235918_100000731001 [0,1,0,0,0,1|2,0,0]=4 2795 B17R1.4793 COC(=O)Nc1ccc(cc1)OCOC(=O)C 34a_100011235918_100009813279 [0,1,0,0,0,1|2,0,0]=4 2796 B17R1.4793 COC(=O)Nc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000181880 [0,1,0,0,0,1|1,0,0]=3 2797 B17R1.4793 COC(=O)Nc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000181880 [0,1,0,0,0,1|2,0,0]=4 2798 B17R1.4793 COC(=O)Nc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000181880 [0,1,0,0,0,1|2,0,0]=4 2799 B17R1.4793 COC(=O)Nc1ccc(cn1)SCCC(=O)C 62a_100000053229_100000188976 [0,1,0,0,0,1|2,0,0]=4 2800 B17R1.4793 NC(=O)CCNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000731001 [0,1,0,0,0,1|2,0,0]=4 2801 B17R1.4793 NC(=O)CCOc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000731001 [0,1,0,0,0,1|2,0,0]=4 2802 B17R1.4793 NCC(=O)Nc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000741985 [0,1,0,0,0,1|2,0,0]=4 2803 B17R1.4993 C=C(C)CCC(=O)c1ccc(cc1)NC(=O)C 1458a_100000185149_100000730704 [0,1,0,0,0,1|2,0,0]=4 2804 B17R1.4993 C=C(C)CCN(C)c1ccc(cc1)NC(=O)C 2230a_100000219403_100000730704 [0,1,0,0,0,1|2,0,0]=4 2805 B17R1.4993 C=C(C)CCN(C)c1ccc(cc1)NC(=O)C 269982a_100000219403_100000730704 [0,1,0,0,0,1|2,0,0]=4 2806 B17R1.4993 C=C(C)CCN(C)c1ccc(cc1)NC(=O)C 34a_100000219403_100000730704 [0,1,0,0,0,1|2,0,0]=4 2807 B17R1.4993 C=C(C)CCN(C)c1ccc(cc1)NC(=O)C 38a_100000219403_100000730704 [0,1,0,0,0,1|2,0,0]=4 2808 B17R1.4993 C=C(C)CNC(=O)c1ccc(cc1)OC(=O)C 11a_100000765925_100000188978 [0,1,0,0,0,1|1,0,1]=4 2809 B17R1.4993 C=C(C)CNC(=O)c1ccc(cc1)OC(=O)C 1626a_100000765925_100000188978 [0,1,0,0,0,1|1,0,1]=4 2810 B17R1.4993 C=C(C)CNC(=O)c1ccc(cc1)OC(=O)C 240690a_100000765925_100000188978 [0,1,0,0,0,1|1,0,1]=4 2811 B17R1.4993 CC(=O)CCN(C)c1ccc(cc1)NC(=O)C 269982a_100000219403_100000053229 [0,1,0,0,0,1|1,0,0]=3 2812 B17R1.4993 CC(=O)NN=C(C)c1ccc(cc1)OC(=O)C 4a_100000189765_100000001828 [0,1,0,0,0,1|1,0,1]=4 2813 B17R1.4993 CC(=O)Nc1ccc(cc1)N(C)CCC(=O)N 2230a_100000219403_100000744528 [0,1,0,0,0,1|2,0,0]=4 2814 B17R1.4993 CC(=O)Nc1ccc(cc1)N(C)CCC(=O)N 269982a_100000219403_100000744528 [0,1,0,0,0,1|2,0,0]=4 2815 B17R1.4993 CC(=O)Nc1ccc(cc1)N(C)CCC(=O)N 34a_100000219403_100000731001 [0,1,0,0,0,1|2,0,0]=4 2816 B17R1.4993 CC(=O)Nc1ccc(cc1)N(C)COC(=O)C 269982a_100000219403_100000076356 [0,1,0,0,0,1|2,0,0]=4 2817 B17R1.4993 CC(=O)Nc1ccc(cc1)N(C)COC(=O)C 34a_100000219403_100009813279 [0,1,0,0,0,1|2,0,0]=4 2818 B17R1.4993 CC(=O)Oc1ccc(cc1)C(=O)NCC(=O)N 11a_100000711301_100000188978 [0,1,0,0,0,1|1,0,1]=4 2819 B17R1.4993 CC(=O)Oc1ccc(cc1)C(=O)NCC(=O)N 240690a_100000711301_100000188978 [0,1,0,0,0,1|1,0,1]=4 2820 B17R1.4993 CC(=O)Oc1ccc(cc1)C(C)NCC(C)C 269862a_100000210953_100000001828 [0,1,0,0,0,1|1,0,1]=4 2821 B17R1.4993 CC(=O)Oc1ccc(cc1)C(C)NCC(C)O 269862a_100000210904_100000001828 [0,1,0,0,0,1|0,0,2]=4 2822 B17R1.7927 C=C(C)CCNc1ccc(c(c1)C)NC(=O)C 34a_100000736504_100000730704 [0,1,0,0,0,1|2,0,0]=4 2823 B17R1.7927 C=C(C)CCNc1ccc(c(c1)C)NC(=O)C 7a_100000736504_100000730704 [0,1,0,0,0,1|2,0,0]=4 2824 B17R1.7927 C=C(C)CCNc1ccc(c(c1)Cl)NC(=O)C 34a_100000244014_100000730704 [0,1,0,0,0,1|2,0,0]=4 2825 B17R1.7927 C=C(C)CCNc1ccc(c(c1)Cl)NC(=O)C 7a_100000244014_100000730704 [0,1,0,0,0,1|2,0,0]=4 2826 B17R1.7927 C=C(C)CCOc1ccc(c(c1)Cl)CC(=O)C 34a_200000084595_100000730704 [0,1,0,0,0,1|2,0,0]=4 2827 B17R1.7927 C=C(C)CCOc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_100000730704 [0,1,0,0,0,1|2,0,0]=4 2828 B17R1.7927 C=C(C)CCSc1ccc(c(c1)C)NC(=O)C 62a_100000730704_100000152120 [0,1,0,0,0,1|2,0,0]=4 2829 B17R1.7927 C=C(C)CCSc1ccc(c(c1)Cl)NC(=O)C 62a_100000730704_100011273303 [0,1,0,0,0,1|2,0,0]=4 2830 B17R1.7927 C=C(C)CCSc1ccc(c(c1)F)NC(=O)C 62a_100000730704_100000155584 [0,1,0,0,0,1|2,0,0]=4 2831 B17R1.7927 C=C(C)CCSc1ccc(c(c1)F)OC(=O)C 62a_100000730704_100009811628 [0,1,0,0,0,1|1,0,0]=3 2832 B17R1.7927 C=C(C)CCSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000730704 [0,1,0,0,0,1|1,0,0]=3 2833 B17R1.7927 CC(=O)CCNc1ccc(c(c1)Br)OC(C)C 7a_200000706018_100000053229 [0,1,0,0,0,1|1,0,1]=4 2834 B17R1.7927 CC(=O)CCNc1ccc(c(c1)C)NC(=O)C 7a_100000736504_100000053229 [0,1,0,0,0,1|1,0,0]=3 2835 B17R1.7927 CC(=O)CCNc1ccc(c(c1)Cl)NC(=O)C 7a_100000244014_100000053229 [0,1,0,0,0,1|1,0,0]=3 2836 B17R1.7927 CC(=O)CCNc1ccc(c(c1)Cl)OC(C)C 7a_100000737677_100000053229 [0,1,0,0,0,1|1,0,1]=4 2837 B17R1.7927 CC(=O)CCOc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_100000053229 [0,1,0,0,0,1|1,0,0]=3 2838 B17R1.7927 CC(=O)CCSc1ccc(c(c1)C)NC(=O)C 62a_100000053229_100000152120 [0,1,0,0,0,1|1,0,0]=3 2839 B17R1.7927 CC(=O)CCSc1ccc(c(c1)C)OC(C)C 62a_100000053229_200011825982 [0,1,0,0,0,1|1,0,1]=4 2840 B17R1.7927 CC(=O)CCSc1ccc(c(c1)C)OC(C)C 62a_200011825982_100000053229 [0,1,0,0,0,1|1,0,1]=4 2841 B17R1.7927 CC(=O)CCSc1ccc(c(c1)Cl)NC(=O)C 62a_100000053229_100011273303 [0,1,0,0,0,1|1,0,0]=3 2842 B17R1.7927 CC(=O)CCSc1ccc(c(c1)F)NC(=O)C 62a_100000053229_100000155584 [0,1,0,0,0,1|1,0,0]=3 2843 B17R1.7927 CC(=O)CCSc1ccc(c(c1)F)OC(=O)C 62a_100000053229_100009811628 [0,1,0,0,0,1|0,0,0]=2 2844 B17R1.7927 CC(=O)CCSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000053229 [0,1,0,0,0,1|0,0,0]=2 2845 B17R1.7927 CC(=O)CCSc1ccc(c(c1)F)OC(C)C 62a_100000053229_100009811877 [0,1,0,0,0,1|1,0,1]=4 2846 B17R1.7927 CC(=O)CCSc1ccc(c(c1)F)OC(C)C 62a_100009811877_100000053229 [0,1,0,0,0,1|1,0,1]=4 2847 B17R1.7927 CC(=O)CCSc1ccc(c(c1)N)OC(C)C 62a_100000053229_100000690130 [0,1,0,0,0,1|1,0,1]=4 2848 B17R1.7927 CC(=O)CCSc1ccc(c(c1)N)OC(C)C 62a_100000690130_100000053229 [0,1,0,0,0,1|1,0,1]=4 2849 B17R1.7927 CC(=O)CCSc1cnc(c(c1)C)NC(=O)C 62a_100000053229_200011934169 [0,1,0,0,0,1|2,0,0]=4 2850 B17R1.7927 CC(=O)Cc1ccc(cc1Cl)OCCC(=O)N 34a_200000084595_100000731001 [0,1,0,0,0,1|2,0,0]=4 2851 B17R1.7927 CC(=O)Cc1ccc(cc1Cl)OCCC(=O)N 7a_200000084595_100000744528 [0,1,0,0,0,1|2,0,0]=4 2852 B17R1.7927 CC(=O)Cc1ccc(cc1Cl)OCOC(=O)C 34a_200000084595_100009813279 [0,1,0,0,0,1|2,0,0]=4 2853 B17R1.7927 CC(=O)Nc1ccc(cc1C)NCCC(=O)N 34a_100000736504_100000731001 [0,1,0,0,0,1|2,0,0]=4 2854 B17R1.7927 CC(=O)Nc1ccc(cc1C)NCCC(=O)N 7a_100000736504_100000744528 [0,1,0,0,0,1|2,0,0]=4 2855 B17R1.7927 CC(=O)Nc1ccc(cc1C)NCOC(=O)C 34a_100000736504_100009813279 [0,1,0,0,0,1|2,0,0]=4 2856 B17R1.7927 CC(=O)Nc1ccc(cc1C)SCCC(=O)N 62a_100000744528_100000152120 [0,1,0,0,0,1|2,0,0]=4 2857 B17R1.7927 CC(=O)Nc1ccc(cc1C)SCOC(=O)C 62a_100000076356_100000152120 [0,1,0,0,0,1|2,0,0]=4 2858 B17R1.7927 CC(=O)Nc1ccc(cc1Cl)NCCC(=O)N 34a_100000244014_100000731001 [0,1,0,0,0,1|2,0,0]=4 2859 B17R1.7927 CC(=O)Nc1ccc(cc1Cl)NCCC(=O)N 7a_100000244014_100000744528 [0,1,0,0,0,1|2,0,0]=4 2860 B17R1.7927 CC(=O)Nc1ccc(cc1Cl)NCOC(=O)C 34a_100000244014_100009813279 [0,1,0,0,0,1|2,0,0]=4 2861 B17R1.7927 CC(=O)Nc1ccc(cc1Cl)SCCC(=O)N 62a_100000744528_100011273303 [0,1,0,0,0,1|2,0,0]=4 2862 B17R1.7927 CC(=O)Nc1ccc(cc1Cl)SCOC(=O)C 62a_100000076356_100011273303 [0,1,0,0,0,1|2,0,0]=4 2863 B17R1.7927 CC(=O)Nc1ccc(cc1F)SCCC(=O)N 62a_100000744528_100000155584 [0,1,0,0,0,1|2,0,0]=4 2864 B17R1.7927 CC(=O)Nc1ccc(cc1F)SCOC(=O)C 62a_100000076356_100000155584 [0,1,0,0,0,1|2,0,0]=4 2865 B17R1.7927 CC(=O)OCSc1ccc(c(c1)F)OC(=O)C 62a_100000076356_100009811628 [0,1,0,0,0,1|1,0,0]=3 2866 B17R1.7927 CC(=O)OCSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000076356 [0,1,0,0,0,1|1,0,0]=3 2867 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCC=C(C)C 62a_100000761012_100009811628 [0,1,0,0,0,1|1,0,1]=4 2868 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCC=C(C)C 62a_100009811628_100000761012 [0,1,0,0,0,1|1,0,1]=4 2869 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCCC(=O)N 62a_100000744528_100009811628 [0,1,0,0,0,1|1,0,0]=3 2870 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCCC(=O)N 62a_100009811628_100000744528 [0,1,0,0,0,1|1,0,0]=3 2871 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCCC(C)C 62a_100000210312_100009811628 [0,1,0,0,0,1|1,0,1]=4 2872 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCCC(C)C 62a_100009811628_100000210312 [0,1,0,0,0,1|1,0,1]=4 2873 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCCC(C)O 62a_100009811628_100012276601 [0,1,0,0,0,1|0,0,2]=4 2874 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCCC(C)O 62a_100012276601_100009811628 [0,1,0,0,0,1|0,0,2]=4 2875 B17R1.7927 CC(=O)Oc1ccc(cc1F)SCCN(C)C 62a_100009811628_100000755713 [0,1,0,0,0,1|2,0,0]=4 2876 B17R1.7945 C=C(C)CCOc1ccc(cc1Br)CC(=O)C 34a_100010141077_100000730704 [0,1,0,0,0,1|2,0,0]=4 2877 B17R1.7945 C=C(C)CCOc1ccc(cc1Br)CC(=O)C 7a_100010141077_100000730704 [0,1,0,0,0,1|2,0,0]=4 2878 B17R1.7945 C=C(C)CCOc1ccc(cc1C)CC(=O)C 34a_200000080089_100000730704 [0,1,0,0,0,1|2,0,0]=4 2879 B17R1.7945 C=C(C)CCOc1ccc(cc1C)CC(=O)C 7a_200000080089_100000730704 [0,1,0,0,0,1|2,0,0]=4 2880 B17R1.7945 C=C(C)CCOc1ccc(cc1C)NC(=O)C 34a_100012186693_100000730704 [0,1,0,0,0,1|2,0,0]=4 2881 B17R1.7945 C=C(C)CCOc1ccc(cc1C)NC(=O)C 7a_100012186693_100000730704 [0,1,0,0,0,1|2,0,0]=4 2882 B17R1.7945 C=C(C)CCOc1ccc(cc1Cl)CC(=O)C 34a_200000080078_100000730704 [0,1,0,0,0,1|2,0,0]=4 2883 B17R1.7945 C=C(C)CCOc1ccc(cc1Cl)CC(=O)C 7a_200000080078_100000730704 [0,1,0,0,0,1|2,0,0]=4 2884 B17R1.7945 C=C(C)CCOc1ccc(cc1Cl)NC(=O)C 34a_100011215158_100000730704 [0,1,0,0,0,1|2,0,0]=4 2885 B17R1.7945 C=C(C)CCOc1ccc(cc1Cl)NC(=O)C 7a_100011215158_100000730704 [0,1,0,0,0,1|2,0,0]=4 2886 B17R1.7945 C=C(C)CCSc1ccc(cc1C)NC(=O)C 62a_100000730704_100000155607 [0,1,0,0,0,1|2,0,0]=4 2887 B17R1.7945 C=C(C)CCSc1ccc(cc1F)NC(=O)C 62a_100000730704_100011219590 [0,1,0,0,0,1|2,0,0]=4 2888 B17R1.7945 CC(=O)CCNc1ccc(cc1F)OC(C)C 7a_100000747098_100000053229 [0,1,0,0,0,1|1,0,1]=4 2889 B17R1.7945 CC(=O)CCOc1ccc(cc1Br)CC(=O)C 7a_100010141077_100000053229 [0,1,0,0,0,1|1,0,0]=3 2890 B17R1.7945 CC(=O)CCOc1ccc(cc1C)CC(=O)C 7a_200000080089_100000053229 [0,1,0,0,0,1|1,0,0]=3 2891 B17R1.7945 CC(=O)CCOc1ccc(cc1C)NC(=O)C 7a_100012186693_100000053229 [0,1,0,0,0,1|1,0,0]=3 2892 B17R1.7945 CC(=O)CCOc1ccc(cc1Cl)CC(=O)C 7a_200000080078_100000053229 [0,1,0,0,0,1|1,0,0]=3 2893 B17R1.7945 CC(=O)CCOc1ccc(cc1Cl)NC(=O)C 7a_100011215158_100000053229 [0,1,0,0,0,1|1,0,0]=3 2894 B17R1.7945 CC(=O)CCSc1ccc(cc1C)NC(=O)C 62a_100000053229_100000155607 [0,1,0,0,0,1|1,0,0]=3 2895 B17R1.7945 CC(=O)CCSc1ccc(cc1C)NC(=O)N 62a_100000053229_100000238934 [0,1,0,0,0,1|2,0,0]=4 2896 B17R1.7945 CC(=O)CCSc1ccc(cc1F)NC(=O)C 62a_100000053229_100011219590 [0,1,0,0,0,1|1,0,0]=3 2897 B17R1.7945 CC(=O)CCSc1ccc(cc1F)OC(C)C 62a_100000053229_200012236954 [0,1,0,0,0,1|1,0,1]=4 2898 B17R1.7945 CC(=O)CCSc1ccc(cc1F)OC(C)C 62a_200012236954_100000053229 [0,1,0,0,0,1|1,0,1]=4 2899 B17R1.7945 CC(=O)CCSc1ccc(nc1C)NC(=O)C 62a_100000053229_100000187074 [0,1,0,0,0,1|2,0,0]=4 2900 B17R1.7945 CC(=O)CCSc1ccc(nc1C)NC(=O)C 62a_100000187074_100000053229 [0,1,0,0,0,1|2,0,0]=4 2901 B17R1.7945 CC(=O)CCSc1ccc(nc1F)NC(=O)C 62a_100000053229_100000050017 [0,1,0,0,0,1|2,0,0]=4 2902 B17R1.7945 CC(=O)CCSc1cnc(cc1C)NC(=O)C 62a_100000053229_100011934553 [0,1,0,0,0,1|2,0,0]=4 2903 B17R1.7945 CC(=O)Cc1ccc(c(c1)Br)OCCC(=O)N 34a_100010141077_100000731001 [0,1,0,0,0,1|2,0,0]=4 2904 B17R1.7945 CC(=O)Cc1ccc(c(c1)Br)OCCC(=O)N 7a_100010141077_100000744528 [0,1,0,0,0,1|2,0,0]=4 2905 B17R1.7945 CC(=O)Cc1ccc(c(c1)Br)OCOC(=O)C 34a_100010141077_100009813279 [0,1,0,0,0,1|2,0,0]=4 2906 B17R1.7945 CC(=O)Cc1ccc(c(c1)C)OCCC(=O)N 34a_200000080089_100000731001 [0,1,0,0,0,1|2,0,0]=4 2907 B17R1.7945 CC(=O)Cc1ccc(c(c1)C)OCCC(=O)N 7a_200000080089_100000744528 [0,1,0,0,0,1|2,0,0]=4 2908 B17R1.7945 CC(=O)Cc1ccc(c(c1)C)OCOC(=O)C 34a_200000080089_100009813279 [0,1,0,0,0,1|2,0,0]=4 2909 B17R1.7945 CC(=O)Cc1ccc(c(c1)Cl)OCCC(=O)N 34a_200000080078_100000731001 [0,1,0,0,0,1|2,0,0]=4 2910 B17R1.7945 CC(=O)Cc1ccc(c(c1)Cl)OCCC(=O)N 7a_200000080078_100000744528 [0,1,0,0,0,1|2,0,0]=4 2911 B17R1.7945 CC(=O)Cc1ccc(c(c1)Cl)OCOC(=O)C 34a_200000080078_100009813279 [0,1,0,0,0,1|2,0,0]=4 2912 B17R1.7945 CC(=O)Nc1ccc(c(c1)C)OCCC(=O)N 34a_100012186693_100000731001 [0,1,0,0,0,1|2,0,0]=4 2913 B17R1.7945 CC(=O)Nc1ccc(c(c1)C)OCCC(=O)N 7a_100012186693_100000744528 [0,1,0,0,0,1|2,0,0]=4 2914 B17R1.7945 CC(=O)Nc1ccc(c(c1)C)OCOC(=O)C 34a_100012186693_100009813279 [0,1,0,0,0,1|2,0,0]=4 2915 B17R1.7945 CC(=O)Nc1ccc(c(c1)C)SCCC(=O)N 62a_100000744528_100000155607 [0,1,0,0,0,1|2,0,0]=4 2916 B17R1.7945 CC(=O)Nc1ccc(c(c1)C)SCOC(=O)C 62a_100000076356_100000155607 [0,1,0,0,0,1|2,0,0]=4 2917 B17R1.7945 CC(=O)Nc1ccc(c(c1)Cl)OCCC(=O)N 34a_100011215158_100000731001 [0,1,0,0,0,1|2,0,0]=4 2918 B17R1.7945 CC(=O)Nc1ccc(c(c1)Cl)OCCC(=O)N 7a_100011215158_100000744528 [0,1,0,0,0,1|2,0,0]=4 2919 B17R1.7945 CC(=O)Nc1ccc(c(c1)Cl)OCOC(=O)C 34a_100011215158_100009813279 [0,1,0,0,0,1|2,0,0]=4 2920 B17R1.7945 CC(=O)Nc1ccc(c(c1)F)SCCC(=O)N 62a_100000744528_100011219590 [0,1,0,0,0,1|2,0,0]=4 2921 B17R1.7945 CC(=O)Nc1ccc(c(c1)F)SCOC(=O)C 62a_100000076356_100011219590 [0,1,0,0,0,1|2,0,0]=4 2922 B17R1.26211 C=C(C)CC(=O)Cc1ccc(cc1)NC(=O)C 1458a_100000199044_100000748629 [0,1,0,0,0,1|2,0,0]=4 2923 B17R1.26211 C=C(C)CN(C)Cc1ccc(cc1)NC(=O)C 2230a_100000225649_100000731167 [0,1,0,0,0,1|2,0,0]=4 2924 B17R1.26211 C=C(C)CN(C)Cc1ccc(cc1)NC(=O)C 269982a_100000225649_100000731167 [0,1,0,0,0,1|2,0,0]=4 2925 B17R1.26211 C=C(C)CN(C)Cc1ccc(cc1)OC(=O)C 2230a_100000225649_100000033664 [0,1,0,0,0,1|1,0,0]=3 2926 B17R1.26211 C=C(C)CN(C)Cc1ccc(cc1)OC(=O)C 269982a_100000225649_100000033664 [0,1,0,0,0,1|1,0,0]=3 2927 B17R1.26211 C=C(C)CN(C)Cc1ccc(cc1)OC(=O)C 270004a_100000225649_100000014718 [0,1,0,0,0,1|1,0,0]=3 2928 B17R1.26211 CC(=O)Cc1ccc(cc1)SC(C)OC(=O)C 62a_100000691760_100009818208 [0,1,0,0,0,1|2,0,0]=4 2929 B17R1.26211 CC(=O)Cc1ccc(cc1)SC(C)OC(=O)C 62a_100009818208_100000691760 [0,1,0,0,0,1|2,0,0]=4 2930 B17R1.26211 CC(=O)Nc1ccc(cc1)CC(=O)CC(=O)N 1458a_100000199044_100000187820 [0,1,0,0,0,1|2,0,0]=4 2931 B17R1.26211 CC(=O)Nc1ccc(cc1)CC(=O)CC(=O)N 1458a_100134613110_100000731167 [0,1,0,0,0,1|2,0,0]=4 2932 B17R1.26211 CC(=O)Nc1ccc(cc1)CC(=O)CC(=O)[O-] 1458a_100000199044_100020667443 [0,1,0,0,0,1|2,0,0]=4 2933 B17R1.26211 CC(=O)Nc1ccc(cc1)CN(C)CC(=O)N 2230a_100000739694_100000731167 [0,1,0,0,0,1|2,0,0]=4 2934 B17R1.26211 CC(=O)Nc1ccc(cc1)CN(C)CC(=O)O 269956a_100000746989_100000731167 [0,1,0,0,0,1|2,0,0]=4 2935 B17R1.26211 CC(=O)Nc1ccc(cc1)SC(C)OC(=O)C 62a_100009818208_100000155215 [0,1,0,0,0,1|2,0,0]=4 2936 B17R1.26211 CC(=O)OC(C)Sc1ccc(cc1)OC(=S)C 62a_100009818208_200009816735 [0,1,0,0,0,1|1,1,0]=4 2937 B17R1.26211 CC(=O)OC(C)Sc1ccc(cc1)SC(=O)C 62a_200009995050_100009818208 [0,1,0,0,0,1|1,1,0]=4 2938 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(=O)N 2230a_100000739694_100000033664 [0,1,0,0,0,1|1,0,0]=3 2939 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(=O)N 270004a_100000739694_100000014718 [0,1,0,0,0,1|1,0,0]=3 2940 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(=O)O 269956a_100000746989_100000033664 [0,1,0,0,0,1|1,0,0]=3 2941 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(C)C 2230a_100000747067_100000033664 [0,1,0,0,0,1|1,0,1]=4 2942 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(C)C 269982a_100000747067_100000033664 [0,1,0,0,0,1|1,0,1]=4 2943 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(C)C 270004a_100000747067_100000014718 [0,1,0,0,0,1|1,0,1]=4 2944 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(C)O 2230a_100000227577_100000033664 [0,1,0,0,0,1|0,0,2]=4 2945 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(C)O 269982a_100000227577_100000033664 [0,1,0,0,0,1|0,0,2]=4 2946 B17R1.26211 CC(=O)Oc1ccc(cc1)CN(C)CC(C)O 270004a_100000227577_100000014718 [0,1,0,0,0,1|0,0,2]=4 2947 B17R1.26211 CC(=O)Oc1ccc(cc1)NC(=O)CC(=O)N 22a_100009829859_100134613110 [0,1,0,0,0,1|1,0,1]=4 2948 B17R1.26211 CC(=O)Oc1ccc(cc1)NC(=O)CC(=O)N 527a_100009829859_100134613110 [0,1,0,0,0,1|1,0,1]=4 2949 B17R1.26211 CC(=O)Oc1ccc(cc1)SC(C)CC(C)C 62a_100000731052_100000002173 [0,1,0,0,0,1|1,0,1]=4 2950 B17R1.26211 CC(=O)Oc1ccc(cc1)SC(C)CN(C)C 62a_100020606517_100000002173 [0,1,0,0,0,1|2,0,0]=4 2951 B17R1.26211 CC(=O)Oc1ccc(cc1)SC(C)OC(=O)C 62a_100009818208_100000002173 [0,1,0,0,0,1|1,0,0]=3 2952 B17R1.26212 C=C(C)C(C)NCc1ccc(cc1)NC(=O)C 269862a_100000735448_100011216138 [0,1,0,0,0,1|2,0,0]=4 2953 B17R1.26212 CC(=O)C(=O)CSc1ccc(cc1)OC(=S)C 62a_100011261029_200009816735 [0,1,0,0,0,1|0,1,1]=4 2954 B17R1.26212 CC(=O)C(C)NCc1ccc(cc1)CC(=O)O 269956a_100016989728_100009814033 [0,1,0,0,0,1|2,0,0]=4 2955 B17R1.26212 CC(=O)C(C)NCc1ccc(cc1)OC(C)C 2230a_100020586559_100009814033 [0,1,0,0,0,1|1,0,1]=4 2956 B17R1.26212 CC(=O)C(C)OCc1ccc(cc1)OC(C)C 7a_100000173089_100000179758 [0,1,0,0,0,1|1,0,1]=4 2957 B17R1.26212 CC(=O)Cc1ccc(cc1)OCC(=O)C(=O)C 34a_100011218180_100011261029 [0,1,0,0,0,1|1,0,1]=4 2958 B17R1.26212 CC(=O)Cc1ccc(cc1)SCC(=O)C(=O)C 62a_100000691760_100011261029 [0,1,0,0,0,1|1,0,1]=4 2959 B17R1.26212 CC(=O)Cc1ccc(cc1)SCC(=O)C(=O)C 62a_100011261029_100000691760 [0,1,0,0,0,1|1,0,1]=4 2960 B17R1.26212 CC(=O)Nc1ccc(cc1)CNC(C)C(=O)N 34a_100000735448_100000702099 [0,1,0,0,0,1|2,0,0]=4 2961 B17R1.26212 CC(=O)Nc1ccc(cc1)CNC(F)C(=O)N 34a_100000735448_100009813875 [0,1,0,0,0,1|2,0,0]=4 2962 B17R1.26212 CC(=O)Nc1ccc(cc1)CNC(F)C(=O)[O-] 34a_100000735448_100020610796 [0,1,0,0,0,1|2,0,0]=4 2963 B17R1.26212 CC(=O)Nc1ccc(cc1)CN[C@@H](C)C(=O)O 269956a_100000743915_100000731167 [0,1,0,0,0,1|2,0,0]=4 2964 B17R1.26212 CC(=O)Nc1ccc(cc1)CN[C@H](C)C(=O)N 2230a_100000119354_100000731167 [0,1,0,0,0,1|2,0,0]=4 2965 B17R1.26212 CC(=O)Nc1ccc(cc1)CN[C@H](C)C(=O)N 34a_100000119354_100000731167 [0,1,0,0,0,1|2,0,0]=4 2966 B17R1.26212 CC(=O)Nc1ccc(cc1)COC(C)C(=O)C 34a_100000212229_100000731167 [0,1,0,0,0,1|1,0,0]=3 2967 B17R1.26212 CC(=O)Nc1ccc(cc1)COC(C)C(=O)C 7a_100000246270_100000179758 [0,1,0,0,0,1|1,0,0]=3 2968 B17R1.26212 CC(=O)Nc1ccc(cc1)COC(C)C(=O)N 34a_100000246270_100000702099 [0,1,0,0,0,1|2,0,0]=4 2969 B17R1.26212 CC(=O)Nc1ccc(cc1)COC(C)C(=O)N 7a_100000246270_100000702099 [0,1,0,0,0,1|2,0,0]=4 2970 B17R1.26212 CC(=O)Nc1ccc(cc1)COC(F)C(=O)N 34a_100000246270_100009813875 [0,1,0,0,0,1|2,0,0]=4 2971 B17R1.26212 CC(=O)Nc1ccc(cc1)COC(F)C(=O)N 7a_100000246270_100009813875 [0,1,0,0,0,1|2,0,0]=4 2972 B17R1.26212 CC(=O)Nc1ccc(cc1)COC(F)C(=O)[O-] 34a_100000246270_100020610796 [0,1,0,0,0,1|2,0,0]=4 2973 B17R1.26212 CC(=O)Nc1ccc(cc1)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000731167 [0,1,0,0,0,1|2,0,0]=4 2974 B17R1.26212 CC(=O)Nc1ccc(cc1)CO[C@H](C)C(=O)N 34a_100000731257_100000731167 [0,1,0,0,0,1|2,0,0]=4 2975 B17R1.26212 CC(=O)Nc1ccc(cc1)CO[C@H](C)C(=O)N 7a_100000731257_100000731167 [0,1,0,0,0,1|2,0,0]=4 2976 B17R1.26212 CC(=O)Nc1ccc(cc1)CSC(C)C(=O)C 62a_100009814033_100000731167 [0,1,0,0,0,1|1,0,0]=3 2977 B17R1.26212 CC(=O)Nc1ccc(cc1)CSC(C)C(=O)N 62a_100000702099_100000731167 [0,1,0,0,0,1|2,0,0]=4 2978 B17R1.26212 CC(=O)Nc1ccc(cc1)CSC(F)C(=O)N 62a_100009813875_100000731167 [0,1,0,0,0,1|2,0,0]=4 2979 B17R1.26212 CC(=O)Nc1ccc(cc1)CSC(F)C(=O)[O-] 62a_100020610796_100000731167 [0,1,0,0,0,1|2,0,0]=4 2980 B17R1.26212 CC(=O)Nc1ccc(cc1)NCC(=O)C(=O)C 34a_100000184111_100011261029 [0,1,0,0,0,1|1,0,1]=4 2981 B17R1.26212 CC(=O)Nc1ccc(cc1)OCC(=O)C(=O)C 34a_100000184395_100011261029 [0,1,0,0,0,1|1,0,1]=4 2982 B17R1.26212 CC(=O)Nc1ccc(cc1)SCC(=O)C(=O)C 62a_100011261029_100000155215 [0,1,0,0,0,1|1,0,1]=4 2983 B17R1.26212 CC(=O)Oc1ccc(cc1)CCC(=O)N(C)C 11a_100102631434_200000064328 [0,1,0,0,0,1|2,0,0]=4 2984 B17R1.26212 CC(=O)Oc1ccc(cc1)CCC(=O)N(C)C 1626a_100102631434_200000064328 [0,1,0,0,0,1|2,0,0]=4 2985 B17R1.26212 CC(=O)Oc1ccc(cc1)CCC(=O)N(C)C 240690a_100102631434_200000064328 [0,1,0,0,0,1|2,0,0]=4 2986 B17R1.26212 CC(=O)Oc1ccc(cc1)CCC(=O)N(C)C 271570a_200010232142_100000002173 [0,1,0,0,0,1|2,0,0]=4 2987 B17R1.26212 CC(=O)Oc1ccc(cc1)CCC(C)N(C)C 270004a_100102631434_100000002119 [0,1,0,0,0,1|2,0,0]=4 2988 B17R1.26212 CC(=O)Oc1ccc(cc1)CNC(C)C(C)C 207a_100000211541_100000014718 [0,1,0,0,0,1|1,0,1]=4 2989 B17R1.26212 CC(=O)Oc1ccc(cc1)CNC(C)C(C)C 2230a_100000211541_100000033664 [0,1,0,0,0,1|1,0,1]=4 2990 B17R1.26212 CC(=O)Oc1ccc(cc1)CNC(C)C(C)C 270004a_100000211541_100000014718 [0,1,0,0,0,1|1,0,1]=4 2991 B17R1.26212 CC(=O)Oc1ccc(cc1)CN[C@@H](C)C(=O)O 269956a_100000743915_100000033664 [0,1,0,0,0,1|1,0,0]=3 2992 B17R1.26212 CC(=O)Oc1ccc(cc1)CN[C@H](C)C(=O)N 2230a_100000119354_100000033664 [0,1,0,0,0,1|1,0,0]=3 2993 B17R1.26212 CC(=O)Oc1ccc(cc1)CN[C@H](C)C(=O)N 270004a_100000119354_100000014718 [0,1,0,0,0,1|1,0,0]=3 2994 B17R1.26212 CC(=O)Oc1ccc(cc1)COC(C)C(C)C 7a_100000748068_100000033664 [0,1,0,0,0,1|1,0,1]=4 2995 B17R1.26212 CC(=O)Oc1ccc(cc1)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000033664 [0,1,0,0,0,1|1,0,0]=3 2996 B17R1.26212 CC(=O)Oc1ccc(cc1)CO[C@H](C)C(=O)N 7a_100000731257_100000033664 [0,1,0,0,0,1|1,0,0]=3 2997 B17R1.26212 CC(=O)Oc1ccc(cc1)CSC(C)C(=O)C 62a_100009814033_100000033664 [0,1,0,0,0,1|0,0,0]=2 2998 B17R1.26212 CC(=O)Oc1ccc(cc1)CSC(C)C(=O)N 62a_100000702099_100000033664 [0,1,0,0,0,1|1,0,0]=3 2999 B17R1.26212 CC(=O)Oc1ccc(cc1)CSC(F)C(=O)N 62a_100009813875_100000033664 [0,1,0,0,0,1|1,0,0]=3 3000 B17R1.26212 CC(=O)Oc1ccc(cc1)CSC(F)C(=O)[O-] 62a_100020610796_100000033664 [0,1,0,0,0,1|1,0,0]=3 3001 B17R1.26212 CC(=O)Oc1ccc(cc1)SCC(=O)C(=O)C 62a_100011261029_100000002173 [0,1,0,0,0,1|0,0,1]=3 3002 B17R1.26212 CC(=O)Sc1ccc(cc1)SCC(=O)C(=O)C 62a_200009995050_100011261029 [0,1,0,0,0,1|0,1,1]=4 3003 B17R1.1190 CCC(=O)CSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100000747405 [0,2,0,0,0,0|2,0,0]=4 3004 B17R1.1190 CNC(=O)CCc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_200010273138 [0,2,0,0,0,0|2,0,0]=4 3005 B17R1.1190 CNC(=O)CNc1ccc(cc1)N(C)C(=O)C 34a_100000229935_100000183359 [0,2,0,0,0,0|2,0,0]=4 3006 B17R1.1190 CNC(=O)COc1ccc(cc1)N(C)C(=O)C 34a_100000743460_100000183359 [0,2,0,0,0,0|2,0,0]=4 3007 B17R1.1190 CNC(=O)CSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100000183359 [0,2,0,0,0,0|2,0,0]=4 3008 B17R1.1190 COC(=O)CCc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100012357364 [0,2,0,0,0,0|2,0,0]=4 3009 B17R1.1190 COC(=O)CNc1ccc(cc1)N(C)C(=O)C 34a_100000229935_100000747449 [0,2,0,0,0,0|2,0,0]=4 3010 B17R1.1190 COC(=O)COc1ccc(cc1)N(C)C(=O)C 34a_100000743460_100000747449 [0,2,0,0,0,0|2,0,0]=4 3011 B17R1.1190 COC(=O)CSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100000747449 [0,2,0,0,0,0|2,0,0]=4 3012 B17R1.104611 CC(=O)C(C)Sc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100009814033 [0,2,0,0,0,0|2,0,0]=4 3013 B17R1.401 CNS(=O)(=O)CCc1ccc(cc1)NC(=O)C 11a_100010243560_100015343762 [0,2,0,0,0,0|2,0,0]=4 3014 B17R1.401 CNS(=O)(=O)CCc1ccc(cc1)NC(=O)C 1626a_100010243560_100015343762 [0,2,0,0,0,0|2,0,0]=4 3015 B17R1.401 CNS(=O)(=O)CCc1ccc(cc1)NC(=O)C 22a_100010243560_100000070787 [0,2,0,0,0,0|2,0,0]=4 3016 B17R1.401 CNS(=O)(=O)CCc1ccc(cc1)NC(=O)C 527a_100010243560_100103153847 [0,2,0,0,0,0|2,0,0]=4 3017 B17R1.873 C#CC(=O)CC(=O)c1ccc(cc1)OC(=O)C 1458a_100000211873_100010246728 [0,2,0,0,0,0|0,0,2]=4 3018 B17R1.873 C=CC(=O)CC(=O)c1ccc(cc1)OC(=O)C 1458a_100000185746_100010246728 [0,2,0,0,0,0|0,0,2]=4 3019 B17R1.873 CC(=O)Nc1ccc(cc1)C(=O)CC(=O)CO 1458a_100000210174_100000183838 [0,2,0,0,0,0|1,0,1]=4 3020 B17R1.873 CC(=O)Oc1ccc(cc1)C(=O)CC(=O)CO 1458a_100000210174_100010246728 [0,2,0,0,0,0|0,0,1]=3 3021 B17R1.873 CCC(=O)CC(=O)c1ccc(cc1)NC(=O)C 1458a_100000185149_100000747405 [0,2,0,0,0,0|1,0,1]=4 3022 B17R1.873 CCC(=O)CC(=O)c1ccc(cc1)NC(=O)C 1458a_100000210414_100000183838 [0,2,0,0,0,0|1,0,1]=4 3023 B17R1.873 CCC(=O)CC(=O)c1ccc(cc1)OC(=O)C 1458a_100000210414_100010246728 [0,2,0,0,0,0|0,0,1]=3 3024 B17R1.873 CCC(=O)CN(C)c1ccc(cc1)NC(=O)C 269982a_100000219403_100000747405 [0,2,0,0,0,0|2,0,0]=4 3025 B17R1.873 CNC(=O)CC(=O)c1ccc(cc1)NC(=O)C 1458a_100000185149_100000183359 [0,2,0,0,0,0|1,0,1]=4 3026 B17R1.873 CNC(=O)CN(C)c1ccc(cc1)NC(=O)C 2230a_100000219403_100000183359 [0,2,0,0,0,0|2,0,0]=4 3027 B17R1.873 CNC(=O)CN(C)c1ccc(cc1)NC(=O)C 269982a_100000219403_100000183359 [0,2,0,0,0,0|2,0,0]=4 3028 B17R1.873 CNC(=O)CN(C)c1ccc(cc1)NC(=O)C 34a_100000219403_100000183359 [0,2,0,0,0,0|2,0,0]=4 3029 B17R1.873 CNC(=O)CN(C)c1ccc(cc1)NC(=O)C 38a_100000219403_100000243848 [0,2,0,0,0,0|2,0,0]=4 3030 B17R1.873 COC(=O)CC(=O)c1ccc(cc1)NC(=O)C 1458a_100000185149_100000747449 [0,2,0,0,0,0|1,0,1]=4 3031 B17R1.873 COC(=O)CC(N)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000736623 [0,2,0,0,0,0|2,0,0]=4 3032 B17R1.873 COC(=O)CN(C)c1ccc(cc1)NC(=O)C 2230a_100000219403_100000747449 [0,2,0,0,0,0|2,0,0]=4 3033 B17R1.873 COC(=O)CN(C)c1ccc(cc1)NC(=O)C 269982a_100000219403_100000747449 [0,2,0,0,0,0|2,0,0]=4 3034 B17R1.873 COC(=O)CN(C)c1ccc(cc1)NC(=O)C 34a_100000219403_100000747449 [0,2,0,0,0,0|2,0,0]=4 3035 B17R1.873 COC(=O)CN(C)c1ccc(cc1)NC(=O)C 38a_100000219403_100000747449 [0,2,0,0,0,0|2,0,0]=4 3036 B17R1.965 C#CCC(=O)CCc1ccc(cc1)OC(C)C 1458a_100000743653_100000184674 [0,2,0,0,0,0|1,0,1]=4 3037 B17R1.965 C#CCC(=O)COc1ccc(cc1)NC(=O)C 1458a_100011194236_100000184674 [0,2,0,0,0,0|2,0,0]=4 3038 B17R1.965 C#CCC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100011220946 [0,2,0,0,0,0|2,0,0]=4 3039 B17R1.965 C#CCC(=O)NCc1ccc(cc1)NC(=O)C 527a_100000735448_100011220946 [0,2,0,0,0,0|2,0,0]=4 3040 B17R1.965 C=CCC(=O)CCc1ccc(cc1)OC(C)C 1458a_100000743653_100000210623 [0,2,0,0,0,0|1,0,1]=4 3041 B17R1.965 C=CCC(=O)COc1ccc(cc1)NC(=O)C 1458a_100011194236_100000210623 [0,2,0,0,0,0|2,0,0]=4 3042 B17R1.965 C=CCC(=O)NCc1ccc(cc1)NC(=O)C 11a_100000735448_100000210193 [0,2,0,0,0,0|2,0,0]=4 3043 B17R1.965 C=CCC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100000210193 [0,2,0,0,0,0|2,0,0]=4 3044 B17R1.965 C=CCC(=O)NCc1ccc(cc1)NC(=O)C 240690a_100000735448_100000210193 [0,2,0,0,0,0|2,0,0]=4 3045 B17R1.965 C=CCC(=O)NCc1ccc(cc1)NC(=O)C 527a_100000735448_100000210193 [0,2,0,0,0,0|2,0,0]=4 3046 B17R1.965 C=COC(=O)CSc1ccc(cc1)OC(=O)C 62a_100000036128_100000002173 [0,2,0,0,0,0|1,0,1]=4 3047 B17R1.965 CC(=O)Cc1ccc(cc1)OCC(=O)NCO 34a_100011218180_100000185155 [0,2,0,0,0,0|2,0,0]=4 3048 B17R1.965 CC(=O)Cc1ccc(cc1)OCC(=O)NCO 7a_100011218180_100000185155 [0,2,0,0,0,0|2,0,0]=4 3049 B17R1.965 CC(=O)Cc1ccc(cc1)SCC(=O)NCO 62a_100000185155_100000691760 [0,2,0,0,0,0|2,0,0]=4 3050 B17R1.965 CC(=O)Cc1ccc(cc1)SCC(=O)NCO 62a_100000691760_100000185155 [0,2,0,0,0,0|2,0,0]=4 3051 B17R1.965 CC(=O)Nc1ccc(cc1)CNC(=O)CC#N 1626a_100000735448_100051588842 [0,2,0,0,0,0|2,0,0]=4 3052 B17R1.965 CC(=O)Nc1ccc(cc1)CNC(=O)CC#N 240690a_100000735448_100051588842 [0,2,0,0,0,0|2,0,0]=4 3053 B17R1.965 CC(=O)Nc1ccc(cc1)CNC(=O)CCO 240690a_100000735448_100011216618 [0,2,0,0,0,0|2,0,0]=4 3054 B17R1.965 CC(=O)Nc1ccc(cc1)NCC(=O)NCO 34a_100000184111_100000185155 [0,2,0,0,0,0|2,0,0]=4 3055 B17R1.965 CC(=O)Nc1ccc(cc1)OCC(=O)CC#N 1458a_100011194236_100011214920 [0,2,0,0,0,0|2,0,0]=4 3056 B17R1.965 CC(=O)Nc1ccc(cc1)OCC(=O)CCF 1458a_100011194236_100011217306 [0,2,0,0,0,0|2,0,0]=4 3057 B17R1.965 CC(=O)Nc1ccc(cc1)OCC(=O)CCO 1458a_100011194236_100000211926 [0,2,0,0,0,0|2,0,0]=4 3058 B17R1.965 CC(=O)Nc1ccc(cc1)OCC(=O)NCO 34a_100000184395_100000185155 [0,2,0,0,0,0|2,0,0]=4 3059 B17R1.965 CC(=O)Nc1ccc(cc1)OCC(=O)NCO 7a_100000184395_100000185155 [0,2,0,0,0,0|2,0,0]=4 3060 B17R1.965 CC(=O)Nc1ccc(cc1)SCC(=O)NCO 62a_100000185155_100000155215 [0,2,0,0,0,0|2,0,0]=4 3061 B17R1.965 CC(=O)Oc1ccc(cc1)SCC(=O)NCO 62a_100000185155_100000002173 [0,2,0,0,0,0|1,0,0]=3 3062 B17R1.965 CC(=O)Sc1ccc(cc1)SCC(=O)NCO 62a_200009995050_100000185155 [0,2,0,0,0,0|1,1,0]=4 3063 B17R1.965 CC(=S)Oc1ccc(cc1)SCC(=O)NCO 62a_100000185155_200009816735 [0,2,0,0,0,0|1,1,0]=4 3064 B17R1.965 CC(C)Oc1ccc(cc1)CCC(=O)CC#N 1458a_100000743653_100011214920 [0,2,0,0,0,0|1,0,1]=4 3065 B17R1.965 CC(C)Oc1ccc(cc1)CCC(=O)CCF 1458a_100000743653_100011217306 [0,2,0,0,0,0|1,0,1]=4 3066 B17R1.965 CC(C)Oc1ccc(cc1)CCC(=O)CCO 1458a_100000743653_100000211926 [0,2,0,0,0,0|1,0,1]=4 3067 B17R1.965 CC=CC(=O)NCc1ccc(cc1)NC(=O)C 11a_100000735448_100000210699 [0,2,0,0,0,0|2,0,0]=4 3068 B17R1.965 CC=CC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100000210699 [0,2,0,0,0,0|2,0,0]=4 3069 B17R1.965 CC=CC(=O)NCc1ccc(cc1)NC(=O)C 240690a_100000735448_100000210699 [0,2,0,0,0,0|2,0,0]=4 3070 B17R1.965 CCCC(=O)CCc1ccc(cc1)OC(C)C 1458a_100000743653_100000210303 [0,2,0,0,0,0|1,0,1]=4 3071 B17R1.965 CCCC(=O)COc1ccc(cc1)CC(=O)C 7a_100011218180_100000747444 [0,2,0,0,0,0|2,0,0]=4 3072 B17R1.965 CCCC(=O)COc1ccc(cc1)NC(=O)C 1458a_100011194236_100000210303 [0,2,0,0,0,0|2,0,0]=4 3073 B17R1.965 CCCC(=O)COc1ccc(cc1)NC(=O)C 7a_100000184395_100000747444 [0,2,0,0,0,0|2,0,0]=4 3074 B17R1.965 CCCC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000691760_100000747444 [0,2,0,0,0,0|2,0,0]=4 3075 B17R1.965 CCCC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000747444_100000691760 [0,2,0,0,0,0|2,0,0]=4 3076 B17R1.965 CCCC(=O)CSc1ccc(cc1)NC(=O)C 62a_100000747444_100000155215 [0,2,0,0,0,0|2,0,0]=4 3077 B17R1.965 CCCC(=O)CSc1ccc(cc1)OC(=O)C 62a_100000747444_100000002173 [0,2,0,0,0,0|1,0,0]=3 3078 B17R1.965 CCCC(=O)CSc1ccc(cc1)OC(=S)C 62a_100000747444_200009816735 [0,2,0,0,0,0|1,1,0]=4 3079 B17R1.965 CCCC(=O)CSc1ccc(cc1)SC(=O)C 62a_200009995050_100000747444 [0,2,0,0,0,0|1,1,0]=4 3080 B17R1.965 CCCC(=O)NCc1ccc(cc1)NC(=O)C 11a_100000735448_100000211992 [0,2,0,0,0,0|2,0,0]=4 3081 B17R1.965 CCCC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100000211992 [0,2,0,0,0,0|2,0,0]=4 3082 B17R1.965 CCCC(=O)NCc1ccc(cc1)NC(=O)C 240690a_100000735448_100000211992 [0,2,0,0,0,0|2,0,0]=4 3083 B17R1.965 CCCC(=O)NCc1ccc(cc1)NC(=O)C 527a_100000735448_100000211992 [0,2,0,0,0,0|2,0,0]=4 3084 B17R1.965 CCNC(=O)CCc1ccc(cc1)OC(=O)C 11a_100015525214_200000064328 [0,2,0,0,0,0|0,0,0]=2 3085 B17R1.965 CCNC(=O)CCc1ccc(cc1)OC(=O)C 240690a_100015525214_200000064328 [0,2,0,0,0,0|0,0,0]=2 3086 B17R1.965 CCNC(=O)CCc1ccc(cc1)OC(C)C 11a_100015525214_100000743653 [0,2,0,0,0,0|1,0,1]=4 3087 B17R1.965 CCNC(=O)CCc1ccc(cc1)OC(C)C 240690a_100015525214_100000743653 [0,2,0,0,0,0|1,0,1]=4 3088 B17R1.965 CCNC(=O)CCc1ccc(cc1)OC(C)C 34a_100102955019_100000210206 [0,2,0,0,0,0|1,0,1]=4 3089 B17R1.965 CCNC(=O)CCc1ccc(cc1)OC(C)C 527a_100015525214_100000743653 [0,2,0,0,0,0|1,0,1]=4 3090 B17R1.965 CCNC(=O)CCc1ccc(cc1)OC(C)C 7a_100102955019_100000210206 [0,2,0,0,0,0|1,0,1]=4 3091 B17R1.965 CCNC(=O)CNc1ccc(cc1)NC(=O)C 34a_100000184111_100000183381 [0,2,0,0,0,0|2,0,0]=4 3092 B17R1.965 CCNC(=O)COc1ccc(cc1)CC(=O)C 34a_100011218180_100000183381 [0,2,0,0,0,0|2,0,0]=4 3093 B17R1.965 CCNC(=O)COc1ccc(cc1)CC(=O)C 7a_100011218180_100000183381 [0,2,0,0,0,0|2,0,0]=4 3094 B17R1.965 CCNC(=O)COc1ccc(cc1)NC(=O)C 11a_100015525214_100011194236 [0,2,0,0,0,0|2,0,0]=4 3095 B17R1.965 CCNC(=O)COc1ccc(cc1)NC(=O)C 240690a_100015525214_100011194236 [0,2,0,0,0,0|2,0,0]=4 3096 B17R1.965 CCNC(=O)COc1ccc(cc1)NC(=O)C 34a_100000184395_100000183381 [0,2,0,0,0,0|2,0,0]=4 3097 B17R1.965 CCNC(=O)COc1ccc(cc1)NC(=O)C 527a_100015525214_100011194236 [0,2,0,0,0,0|2,0,0]=4 3098 B17R1.965 CCNC(=O)COc1ccc(cc1)NC(=O)C 7a_100000184395_100000183381 [0,2,0,0,0,0|2,0,0]=4 3099 B17R1.965 CCNC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000183381_100000691760 [0,2,0,0,0,0|2,0,0]=4 3100 B17R1.965 CCNC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000691760_100000183381 [0,2,0,0,0,0|2,0,0]=4 3101 B17R1.965 CCNC(=O)CSc1ccc(cc1)NC(=O)C 62a_100000183381_100000155215 [0,2,0,0,0,0|2,0,0]=4 3102 B17R1.965 CCNC(=O)CSc1ccc(cc1)OC(=O)C 62a_100000183381_100000002173 [0,2,0,0,0,0|1,0,0]=3 3103 B17R1.965 CCNC(=O)CSc1ccc(cc1)OC(=S)C 62a_100000183381_200009816735 [0,2,0,0,0,0|1,1,0]=4 3104 B17R1.965 CCNC(=O)CSc1ccc(cc1)SC(=O)C 62a_200009995050_100000183381 [0,2,0,0,0,0|1,1,0]=4 3105 B17R1.965 CCNC(=O)NCc1ccc(cc1)NC(=O)C 2708a_100000735448_100015525214 [0,2,0,0,0,0|2,0,0]=4 3106 B17R1.965 CCNC(=O)NCc1ccc(cc1)NC(=O)C 2708a_100015525214_100000735448 [0,2,0,0,0,0|2,0,0]=4 3107 B17R1.965 CCNC(=O)NCc1ccc(cc1)NC(=O)C 273464a_100000735448_100015525214 [0,2,0,0,0,0|2,0,0]=4 3108 B17R1.965 CCNC(=O)NCc1ccc(cc1)NC(=O)C 273464a_100015525214_100000735448 [0,2,0,0,0,0|2,0,0]=4 3109 B17R1.965 CCNC(=O)NCc1ccc(cc1)NC(=O)C 512a_100000735448_100015525214 [0,2,0,0,0,0|2,0,0]=4 3110 B17R1.965 CCNC(=O)NCc1ccc(cc1)NC(=O)C 512a_100015525214_100000735448 [0,2,0,0,0,0|2,0,0]=4 3111 B17R1.965 CCNC(C)CCc1ccc(cc1)OC(=O)C 270004a_100015525214_100000002119 [0,2,0,0,0,0|1,0,1]=4 3112 B17R1.965 CCOC(=O)C=Cc1ccc(cc1)OC(=O)C 271570a_100010199719_100000002173 [0,2,0,0,0,0|0,0,2]=4 3113 B17R1.965 CCOC(=O)CCc1ccc(cc1)C=C(C)C 271570a_100102525489_100012353604 [0,2,0,0,0,0|2,0,0]=4 3114 B17R1.965 CCOC(=O)CCc1ccc(cc1)NC(=O)C 188690a_100000758882_100015343762 [0,2,0,0,0,0|1,0,0]=3 3115 B17R1.965 CCOC(=O)CCc1ccc(cc1)OC(C)C 34a_100000042238_100000210206 [0,2,0,0,0,0|1,0,1]=4 3116 B17R1.965 CCOC(=O)CCc1ccc(cc1)OC(C)C 7a_100000042238_100000210206 [0,2,0,0,0,0|1,0,1]=4 3117 B17R1.965 CCOC(=O)CNc1ccc(cc1)NC(=O)C 34a_100000184111_100000188475 [0,2,0,0,0,0|2,0,0]=4 3118 B17R1.965 CCOC(=O)COc1ccc(cc1)CC(=O)C 34a_100011218180_100000188475 [0,2,0,0,0,0|2,0,0]=4 3119 B17R1.965 CCOC(=O)COc1ccc(cc1)CC(=O)C 7a_100011218180_100000188475 [0,2,0,0,0,0|2,0,0]=4 3120 B17R1.965 CCOC(=O)COc1ccc(cc1)NC(=O)C 34a_100000184395_100000188475 [0,2,0,0,0,0|2,0,0]=4 3121 B17R1.965 CCOC(=O)COc1ccc(cc1)NC(=O)C 7a_100000184395_100000188475 [0,2,0,0,0,0|2,0,0]=4 3122 B17R1.965 CCOC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000188475_100000691760 [0,2,0,0,0,0|2,0,0]=4 3123 B17R1.965 CCOC(=O)CSc1ccc(cc1)CC(=O)C 62a_100000691760_100000188475 [0,2,0,0,0,0|2,0,0]=4 3124 B17R1.965 CCOC(=O)CSc1ccc(cc1)NC(=O)C 62a_100000188475_100000155215 [0,2,0,0,0,0|2,0,0]=4 3125 B17R1.965 CCOC(=O)CSc1ccc(cc1)OC(=O)C 62a_100000188475_100000002173 [0,2,0,0,0,0|1,0,0]=3 3126 B17R1.965 CCOC(=O)CSc1ccc(cc1)OC(=S)C 62a_100000188475_200009816735 [0,2,0,0,0,0|1,1,0]=4 3127 B17R1.965 CCOC(=O)CSc1ccc(cc1)SC(=O)C 62a_200009995050_100000188475 [0,2,0,0,0,0|1,1,0]=4 3128 B17R1.965 CNNC(=O)CCc1ccc(cc1)OC(C)C 22a_100016993582_100000743653 [0,2,0,0,0,0|1,0,1]=4 3129 B17R1.965 CNNC(=O)COc1ccc(cc1)NC(=O)C 22a_100016993582_100011194236 [0,2,0,0,0,0|2,0,0]=4 3130 B17R1.965 CNNC(=O)NCc1ccc(cc1)NC(=O)C 273464a_100000735448_100016993582 [0,2,0,0,0,0|2,0,0]=4 3131 B17R1.965 CNNC(=O)NCc1ccc(cc1)NC(=O)C 512a_100000735448_100016993582 [0,2,0,0,0,0|2,0,0]=4 3132 B17R1.965 CNNC(=O)NCc1ccc(cc1)NC(=O)C 512a_100016993582_100000735448 [0,2,0,0,0,0|2,0,0]=4 3133 B17R1.965 COCC(=O)NCc1ccc(cc1)NC(=O)C 11a_100000735448_100000210968 [0,2,0,0,0,0|2,0,0]=4 3134 B17R1.965 COCC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100000210968 [0,2,0,0,0,0|2,0,0]=4 3135 B17R1.965 COCC(=O)NCc1ccc(cc1)NC(=O)C 240690a_100000735448_100000210968 [0,2,0,0,0,0|2,0,0]=4 3136 B17R1.965 COCC(=O)NCc1ccc(cc1)NC(=O)C 527a_100000735448_100000210968 [0,2,0,0,0,0|2,0,0]=4 3137 B17R1.965 CSCC(=O)NCc1ccc(cc1)NC(=O)C 11a_100000735448_100000184570 [0,2,0,0,0,0|2,0,0]=4 3138 B17R1.965 CSCC(=O)NCc1ccc(cc1)NC(=O)C 1626a_100000735448_100000184570 [0,2,0,0,0,0|2,0,0]=4 3139 B17R1.965 CSCC(=O)NCc1ccc(cc1)NC(=O)C 240690a_100000735448_100000184570 [0,2,0,0,0,0|2,0,0]=4 3140 B17R1.965 CSCC(=O)NCc1ccc(cc1)NC(=O)C 527a_100000735448_100000184570 [0,2,0,0,0,0|2,0,0]=4 3141 B17R1.1189 CCC(=O)COc1ccc(cc1Br)CC(=O)C 7a_100010141077_100000747405 [0,2,0,0,0,0|2,0,0]=4 3142 B17R1.1189 CCC(=O)COc1ccc(cc1C)CC(=O)C 7a_200000080089_100000747405 [0,2,0,0,0,0|2,0,0]=4 3143 B17R1.1189 CCC(=O)COc1ccc(cc1C)NC(=O)C 7a_100012186693_100000747405 [0,2,0,0,0,0|2,0,0]=4 3144 B17R1.1189 CCC(=O)COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_100000747405 [0,2,0,0,0,0|2,0,0]=4 3145 B17R1.1189 CCC(=O)COc1ccc(cc1Cl)NC(=O)C 7a_100011215158_100000747405 [0,2,0,0,0,0|2,0,0]=4 3146 B17R1.1189 CCC(=O)CSc1ccc(cc1C)NC(=O)C 62a_100000747405_100000155607 [0,2,0,0,0,0|2,0,0]=4 3147 B17R1.1189 CCC(=O)CSc1ccc(cc1F)NC(=O)C 62a_100000747405_100011219590 [0,2,0,0,0,0|2,0,0]=4 3148 B17R1.1189 CNC(=O)COc1ccc(cc1Br)CC(=O)C 34a_100010141077_100000183359 [0,2,0,0,0,0|2,0,0]=4 3149 B17R1.1189 CNC(=O)COc1ccc(cc1Br)CC(=O)C 7a_100010141077_100000183359 [0,2,0,0,0,0|2,0,0]=4 3150 B17R1.1189 CNC(=O)COc1ccc(cc1C)CC(=O)C 34a_200000080089_100000183359 [0,2,0,0,0,0|2,0,0]=4 3151 B17R1.1189 CNC(=O)COc1ccc(cc1C)CC(=O)C 7a_200000080089_100000183359 [0,2,0,0,0,0|2,0,0]=4 3152 B17R1.1189 CNC(=O)COc1ccc(cc1C)NC(=O)C 34a_100012186693_100000183359 [0,2,0,0,0,0|2,0,0]=4 3153 B17R1.1189 CNC(=O)COc1ccc(cc1C)NC(=O)C 7a_100012186693_100000183359 [0,2,0,0,0,0|2,0,0]=4 3154 B17R1.1189 CNC(=O)COc1ccc(cc1Cl)CC(=O)C 34a_200000080078_100000183359 [0,2,0,0,0,0|2,0,0]=4 3155 B17R1.1189 CNC(=O)COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_100000183359 [0,2,0,0,0,0|2,0,0]=4 3156 B17R1.1189 CNC(=O)COc1ccc(cc1Cl)NC(=O)C 34a_100011215158_100000183359 [0,2,0,0,0,0|2,0,0]=4 3157 B17R1.1189 CNC(=O)COc1ccc(cc1Cl)NC(=O)C 7a_100011215158_100000183359 [0,2,0,0,0,0|2,0,0]=4 3158 B17R1.1189 CNC(=O)CSc1ccc(cc1C)NC(=O)C 62a_100000183359_100000155607 [0,2,0,0,0,0|2,0,0]=4 3159 B17R1.1189 CNC(=O)CSc1ccc(cc1F)NC(=O)C 62a_100000183359_100011219590 [0,2,0,0,0,0|2,0,0]=4 3160 B17R1.1189 COC(=O)COc1ccc(cc1Br)CC(=O)C 34a_100010141077_100000747449 [0,2,0,0,0,0|2,0,0]=4 3161 B17R1.1189 COC(=O)COc1ccc(cc1Br)CC(=O)C 7a_100010141077_100000747449 [0,2,0,0,0,0|2,0,0]=4 3162 B17R1.1189 COC(=O)COc1ccc(cc1C)CC(=O)C 34a_200000080089_100000747449 [0,2,0,0,0,0|2,0,0]=4 3163 B17R1.1189 COC(=O)COc1ccc(cc1C)CC(=O)C 7a_200000080089_100000747449 [0,2,0,0,0,0|2,0,0]=4 3164 B17R1.1189 COC(=O)COc1ccc(cc1C)NC(=O)C 34a_100012186693_100000747449 [0,2,0,0,0,0|2,0,0]=4 3165 B17R1.1189 COC(=O)COc1ccc(cc1C)NC(=O)C 7a_100012186693_100000747449 [0,2,0,0,0,0|2,0,0]=4 3166 B17R1.1189 COC(=O)COc1ccc(cc1Cl)CC(=O)C 34a_200000080078_100000747449 [0,2,0,0,0,0|2,0,0]=4 3167 B17R1.1189 COC(=O)COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_100000747449 [0,2,0,0,0,0|2,0,0]=4 3168 B17R1.1189 COC(=O)COc1ccc(cc1Cl)NC(=O)C 34a_100011215158_100000747449 [0,2,0,0,0,0|2,0,0]=4 3169 B17R1.1189 COC(=O)COc1ccc(cc1Cl)NC(=O)C 7a_100011215158_100000747449 [0,2,0,0,0,0|2,0,0]=4 3170 B17R1.1189 COC(=O)CSc1ccc(cc1C)NC(=O)C 62a_100000747449_100000155607 [0,2,0,0,0,0|2,0,0]=4 3171 B17R1.1189 COC(=O)CSc1ccc(cc1F)NC(=O)C 62a_100000747449_100011219590 [0,2,0,0,0,0|2,0,0]=4 3172 B17R1.1354 COC(=O)CCc1ccc(cc1)OC(C)(C)C 34a_100000032826_100000210625 [0,2,0,0,0,0|1,0,1]=4 3173 B17R1.1355 C#CC(C)Oc1ccc(cc1)CCC(=O)OC 34a_100000032826_200000035995 [0,2,0,0,0,0|1,0,1]=4 3174 B17R1.1355 CCC(=O)COc1ccc(cc1)NC(=O)CC 1458a_100011593264_100000210202 [0,2,0,0,0,0|2,0,0]=4 3175 B17R1.1355 CCC(=O)COc1ccc(cc1)NC(=O)CC 7a_200000243810_100000747405 [0,2,0,0,0,0|2,0,0]=4 3176 B17R1.1355 CCC(=O)CSc1ccc(cc1)CC(=O)NC 62a_100000155101_100000747405 [0,2,0,0,0,0|2,0,0]=4 3177 B17R1.1355 CCC(=O)CSc1ccc(cc1)CC(=O)NC 62a_100000747405_100000155101 [0,2,0,0,0,0|2,0,0]=4 3178 B17R1.1355 CCC(=O)CSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000747405 [0,2,0,0,0,0|2,0,0]=4 3179 B17R1.1355 CCC(=O)CSc1ccc(cc1)CC(=O)OC 62a_100000747405_100000149743 [0,2,0,0,0,0|2,0,0]=4 3180 B17R1.1355 CCC(=O)CSc1ccc(cc1)NC(=O)CN 62a_100000747405_100000741985 [0,2,0,0,0,0|2,0,0]=4 3181 B17R1.1355 CCC(=O)CSc1ccc(cc1)NC(=O)OC 62a_100000747405_100000181880 [0,2,0,0,0,0|2,0,0]=4 3182 B17R1.1355 CCC(=O)CSc1ccc(cc1)OC(=O)CC 62a_100000747405_200009811598 [0,2,0,0,0,0|1,0,0]=3 3183 B17R1.1355 CCC(=O)NCc1ccc(cc1)CC(=O)OC 188690a_100016995050_100000210414 [0,2,0,0,0,0|2,0,0]=4 3184 B17R1.1355 CCC(=O)Nc1ccc(cc1)CCC(=O)OC 188690a_100000751780_100000210414 [0,2,0,0,0,0|1,0,0]=3 3185 B17R1.1355 CCC(=O)Nc1ccc(cc1)NCC(=O)NC 34a_100000186511_100000183359 [0,2,0,0,0,0|2,0,0]=4 3186 B17R1.1355 CCC(=O)Nc1ccc(cc1)NCC(=O)OC 34a_100000186511_100000747449 [0,2,0,0,0,0|2,0,0]=4 3187 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)CF 1458a_100011593264_100015361967 [0,2,0,0,0,0|2,0,0]=4 3188 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 11a_100000752409_100000210414 [0,2,0,0,0,0|2,0,0]=4 3189 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 11a_106832991635_100011593264 [0,2,0,0,0,0|2,0,0]=4 3190 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 1626a_100000752409_100000210414 [0,2,0,0,0,0|2,0,0]=4 3191 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 1626a_100102657272_100011593264 [0,2,0,0,0,0|2,0,0]=4 3192 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 22a_100000752409_100000210414 [0,2,0,0,0,0|2,0,0]=4 3193 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 240690a_100102657272_100011593264 [0,2,0,0,0,0|2,0,0]=4 3194 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 34a_200000243810_100000183359 [0,2,0,0,0,0|2,0,0]=4 3195 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 527a_100000752409_100000210414 [0,2,0,0,0,0|2,0,0]=4 3196 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 527a_100102657272_100011593264 [0,2,0,0,0,0|2,0,0]=4 3197 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)NC 7a_200000243810_100000183359 [0,2,0,0,0,0|2,0,0]=4 3198 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)OC 188690a_100000187534_100000210414 [0,2,0,0,0,0|2,0,0]=4 3199 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)OC 34a_200000243810_100000747449 [0,2,0,0,0,0|2,0,0]=4 3200 B17R1.1355 CCC(=O)Nc1ccc(cc1)OCC(=O)OC 7a_200000243810_100000747449 [0,2,0,0,0,0|2,0,0]=4 3201 B17R1.1355 CCC(=O)Oc1ccc(cc1)SCC(=O)NC 62a_100000183359_200009811598 [0,2,0,0,0,0|1,0,0]=3 3202 B17R1.1355 CCC(=O)Oc1ccc(cc1)SCC(=O)OC 62a_100000747449_200009811598 [0,2,0,0,0,0|1,0,0]=3 3203 B17R1.1355 CCC(C)Oc1ccc(cc1)CCC(=O)OC 34a_100000032826_100011215416 [0,2,0,0,0,0|1,0,1]=4 3204 B17R1.1355 CCC(C)Oc1ccc(cc1)CCC(=O)OC 7a_100000032826_100000758301 [0,2,0,0,0,0|1,0,1]=4 3205 B17R1.1355 CNC(=O)CNc1ccc(cc1)CC(=O)NC 2230a_100000736799_100000183359 [0,2,0,0,0,0|2,0,0]=4 3206 B17R1.1355 CNC(=O)CNc1ccc(cc1)CC(=O)NC 34a_100000736799_100000183359 [0,2,0,0,0,0|2,0,0]=4 3207 B17R1.1355 CNC(=O)CNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000183359 [0,2,0,0,0,0|2,0,0]=4 3208 B17R1.1355 CNC(=O)COc1ccc(cc1)CC(=O)NC 34a_200000020795_100000183359 [0,2,0,0,0,0|2,0,0]=4 3209 B17R1.1355 CNC(=O)COc1ccc(cc1)CC(=O)OC 34a_100000211648_100000183359 [0,2,0,0,0,0|2,0,0]=4 3210 B17R1.1355 CNC(=O)COc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000183359 [0,2,0,0,0,0|2,0,0]=4 3211 B17R1.1355 CNC(=O)COc1ccc(cc1)NC(=O)CO 22a_100000752409_100000210174 [0,2,0,0,0,0|2,0,0]=4 3212 B17R1.1355 CNC(=O)COc1ccc(cc1)NC(=O)CO 527a_100000752409_100000210174 [0,2,0,0,0,0|2,0,0]=4 3213 B17R1.1355 CNC(=O)COc1ccc(cc1)NC(=O)NC 2430a_100000752409_100102657272 [0,2,0,0,0,0|2,0,0]=4 3214 B17R1.1355 CNC(=O)COc1ccc(cc1)NC(=O)OC 34a_100011235918_100000183359 [0,2,0,0,0,0|2,0,0]=4 3215 B17R1.1355 CNC(=O)CSc1ccc(cc1)CC(=O)NC 62a_100000155101_100000183359 [0,2,0,0,0,0|2,0,0]=4 3216 B17R1.1355 CNC(=O)CSc1ccc(cc1)CC(=O)NC 62a_100000183359_100000155101 [0,2,0,0,0,0|2,0,0]=4 3217 B17R1.1355 CNC(=O)CSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000183359 [0,2,0,0,0,0|2,0,0]=4 3218 B17R1.1355 CNC(=O)CSc1ccc(cc1)CC(=O)OC 62a_100000183359_100000149743 [0,2,0,0,0,0|2,0,0]=4 3219 B17R1.1355 CNC(=O)CSc1ccc(cc1)NC(=O)CN 62a_100000183359_100000741985 [0,2,0,0,0,0|2,0,0]=4 3220 B17R1.1355 CNC(=O)CSc1ccc(cc1)NC(=O)OC 62a_100000183359_100000181880 [0,2,0,0,0,0|2,0,0]=4 3221 B17R1.1355 CNC(=O)Cc1ccc(cc1)NCC(=O)OC 2230a_100000736799_100000747449 [0,2,0,0,0,0|2,0,0]=4 3222 B17R1.1355 CNC(=O)Cc1ccc(cc1)NCC(=O)OC 34a_100000736799_100000747449 [0,2,0,0,0,0|2,0,0]=4 3223 B17R1.1355 CNC(=O)Cc1ccc(cc1)OCC(=O)OC 34a_200000020795_100000747449 [0,2,0,0,0,0|2,0,0]=4 3224 B17R1.1355 CNC(=O)Cc1ccc(cc1)SCC(=O)OC 62a_100000155101_100000747449 [0,2,0,0,0,0|2,0,0]=4 3225 B17R1.1355 CNC(=O)Cc1ccc(cc1)SCC(=O)OC 62a_100000747449_100000155101 [0,2,0,0,0,0|2,0,0]=4 3226 B17R1.1355 COC(=O)CCc1ccc(cc1)NC(=O)CO 188690a_100000751780_100000210174 [0,2,0,0,0,0|1,0,0]=3 3227 B17R1.1355 COC(=O)CCc1ccc(cc1)OC(C)C#N 7a_100000032826_100000703298 [0,2,0,0,0,0|1,0,1]=4 3228 B17R1.1355 COC(=O)CCc1ccc(cc1)OC(C)CO 34a_100000032826_100012180447 [0,2,0,0,0,0|0,0,2]=4 3229 B17R1.1355 COC(=O)CCc1ccc(cc1)OC(C)CO 7a_100000032826_100012180447 [0,2,0,0,0,0|0,0,2]=4 3230 B17R1.1355 COC(=O)CNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000747449 [0,2,0,0,0,0|2,0,0]=4 3231 B17R1.1355 COC(=O)COc1ccc(cc1)CC(=O)OC 34a_100000211648_100000747449 [0,2,0,0,0,0|2,0,0]=4 3232 B17R1.1355 COC(=O)COc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000747449 [0,2,0,0,0,0|2,0,0]=4 3233 B17R1.1355 COC(=O)COc1ccc(cc1)NC(=O)CO 188690a_100000187534_100000210174 [0,2,0,0,0,0|2,0,0]=4 3234 B17R1.1355 COC(=O)COc1ccc(cc1)NC(=O)OC 34a_100011235918_100000747449 [0,2,0,0,0,0|2,0,0]=4 3235 B17R1.1355 COC(=O)CSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000747449 [0,2,0,0,0,0|2,0,0]=4 3236 B17R1.1355 COC(=O)CSc1ccc(cc1)CC(=O)OC 62a_100000747449_100000149743 [0,2,0,0,0,0|2,0,0]=4 3237 B17R1.1355 COC(=O)CSc1ccc(cc1)NC(=O)CN 62a_100000747449_100000741985 [0,2,0,0,0,0|2,0,0]=4 3238 B17R1.1355 COC(=O)CSc1ccc(cc1)NC(=O)OC 62a_100000747449_100000181880 [0,2,0,0,0,0|2,0,0]=4 3239 B17R1.1355 COC(=O)Cc1ccc(cc1)CNC(=O)CO 188690a_100016995050_100000210174 [0,2,0,0,0,0|2,0,0]=4 3240 B17R1.1393 CCC(=O)CNc1ccc(c(c1)C)NC(=O)C 7a_100000736504_100000747405 [0,2,0,0,0,0|2,0,0]=4 3241 B17R1.1393 CCC(=O)CNc1ccc(c(c1)Cl)NC(=O)C 7a_100000244014_100000747405 [0,2,0,0,0,0|2,0,0]=4 3242 B17R1.1393 CCC(=O)COc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_100000747405 [0,2,0,0,0,0|2,0,0]=4 3243 B17R1.1393 CCC(=O)CSc1ccc(c(c1)C)NC(=O)C 62a_100000747405_100000152120 [0,2,0,0,0,0|2,0,0]=4 3244 B17R1.1393 CCC(=O)CSc1ccc(c(c1)Cl)NC(=O)C 62a_100000747405_100011273303 [0,2,0,0,0,0|2,0,0]=4 3245 B17R1.1393 CCC(=O)CSc1ccc(c(c1)F)NC(=O)C 62a_100000747405_100000155584 [0,2,0,0,0,0|2,0,0]=4 3246 B17R1.1393 CCC(=O)CSc1ccc(c(c1)F)OC(=O)C 62a_100000747405_100009811628 [0,2,0,0,0,0|1,0,0]=3 3247 B17R1.1393 CCC(=O)CSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000747405 [0,2,0,0,0,0|1,0,0]=3 3248 B17R1.1393 CNC(=O)CNc1ccc(c(c1)C)NC(=O)C 34a_100000736504_100000183359 [0,2,0,0,0,0|2,0,0]=4 3249 B17R1.1393 CNC(=O)CNc1ccc(c(c1)C)NC(=O)C 7a_100000736504_100000183359 [0,2,0,0,0,0|2,0,0]=4 3250 B17R1.1393 CNC(=O)CNc1ccc(c(c1)Cl)NC(=O)C 34a_100000244014_100000183359 [0,2,0,0,0,0|2,0,0]=4 3251 B17R1.1393 CNC(=O)CNc1ccc(c(c1)Cl)NC(=O)C 7a_100000244014_100000183359 [0,2,0,0,0,0|2,0,0]=4 3252 B17R1.1393 CNC(=O)COc1ccc(c(c1)Cl)CC(=O)C 34a_200000084595_100000183359 [0,2,0,0,0,0|2,0,0]=4 3253 B17R1.1393 CNC(=O)COc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_100000183359 [0,2,0,0,0,0|2,0,0]=4 3254 B17R1.1393 CNC(=O)CSc1ccc(c(c1)C)NC(=O)C 62a_100000183359_100000152120 [0,2,0,0,0,0|2,0,0]=4 3255 B17R1.1393 CNC(=O)CSc1ccc(c(c1)Cl)NC(=O)C 62a_100000183359_100011273303 [0,2,0,0,0,0|2,0,0]=4 3256 B17R1.1393 CNC(=O)CSc1ccc(c(c1)F)NC(=O)C 62a_100000183359_100000155584 [0,2,0,0,0,0|2,0,0]=4 3257 B17R1.1393 CNC(=O)CSc1ccc(c(c1)F)OC(=O)C 62a_100000183359_100009811628 [0,2,0,0,0,0|1,0,0]=3 3258 B17R1.1393 CNC(=O)CSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000183359 [0,2,0,0,0,0|1,0,0]=3 3259 B17R1.1393 COC(=O)CNc1ccc(c(c1)C)NC(=O)C 34a_100000736504_100000747449 [0,2,0,0,0,0|2,0,0]=4 3260 B17R1.1393 COC(=O)CNc1ccc(c(c1)C)NC(=O)C 7a_100000736504_100000747449 [0,2,0,0,0,0|2,0,0]=4 3261 B17R1.1393 COC(=O)CNc1ccc(c(c1)Cl)NC(=O)C 34a_100000244014_100000747449 [0,2,0,0,0,0|2,0,0]=4 3262 B17R1.1393 COC(=O)CNc1ccc(c(c1)Cl)NC(=O)C 7a_100000244014_100000747449 [0,2,0,0,0,0|2,0,0]=4 3263 B17R1.1393 COC(=O)COc1ccc(c(c1)Cl)CC(=O)C 34a_200000084595_100000747449 [0,2,0,0,0,0|2,0,0]=4 3264 B17R1.1393 COC(=O)COc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_100000747449 [0,2,0,0,0,0|2,0,0]=4 3265 B17R1.1393 COC(=O)CSc1ccc(c(c1)C)NC(=O)C 62a_100000747449_100000152120 [0,2,0,0,0,0|2,0,0]=4 3266 B17R1.1393 COC(=O)CSc1ccc(c(c1)Cl)NC(=O)C 62a_100000747449_100011273303 [0,2,0,0,0,0|2,0,0]=4 3267 B17R1.1393 COC(=O)CSc1ccc(c(c1)F)NC(=O)C 62a_100000747449_100000155584 [0,2,0,0,0,0|2,0,0]=4 3268 B17R1.1393 COC(=O)CSc1ccc(c(c1)F)OC(=O)C 62a_100000747449_100009811628 [0,2,0,0,0,0|1,0,0]=3 3269 B17R1.1393 COC(=O)CSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000747449 [0,2,0,0,0,0|1,0,0]=3 3270 B17R1.8326 CCC(=O)C(C)Oc1ccc(cc1)CC(=O)C 7a_100011218180_100000742827 [0,2,0,0,0,0|2,0,0]=4 3271 B17R1.8326 CCC(=O)C(C)Oc1ccc(cc1)NC(=O)C 7a_100000184395_100000742827 [0,2,0,0,0,0|2,0,0]=4 3272 B17R1.8326 CCC(=O)C(C)Sc1ccc(cc1)CC(=O)C 62a_100000691760_100000742827 [0,2,0,0,0,0|2,0,0]=4 3273 B17R1.8326 CCC(=O)C(C)Sc1ccc(cc1)CC(=O)C 62a_100000742827_100000691760 [0,2,0,0,0,0|2,0,0]=4 3274 B17R1.8326 CCC(=O)C(C)Sc1ccc(cc1)NC(=O)C 62a_100000742827_100000155215 [0,2,0,0,0,0|2,0,0]=4 3275 B17R1.8326 CCC(=O)C(C)Sc1ccc(cc1)OC(=O)C 62a_100000742827_100000002173 [0,2,0,0,0,0|1,0,0]=3 3276 B17R1.8326 CCC(=O)C(C)Sc1ccc(cc1)OC(=S)C 62a_100000742827_200009816735 [0,2,0,0,0,0|1,1,0]=4 3277 B17R1.8326 CCC(=O)C(C)Sc1ccc(cc1)SC(=O)C 62a_200009995050_100000742827 [0,2,0,0,0,0|1,1,0]=4 3278 B17R1.8326 CNC(=O)C(=O)Cc1ccc(cc1)NC(=O)C 1458a_100011218921_100000731167 [0,2,0,0,0,0|1,0,1]=4 3279 B17R1.8326 CNC(=O)C(=O)Nc1ccc(cc1)OC(=O)C 1626a_100009829859_100011218921 [0,2,0,0,0,0|1,0,1]=4 3280 B17R1.8326 CNC(=O)C(=O)Nc1ccc(cc1)OC(=O)C 22a_100009829859_100011218921 [0,2,0,0,0,0|1,0,1]=4 3281 B17R1.8326 CNC(=O)C(=O)Nc1ccc(cc1)OC(=O)C 527a_100009829859_100011218921 [0,2,0,0,0,0|1,0,1]=4 3282 B17R1.8326 CNC(=O)C(C)Nc1ccc(cc1)NC(=O)C 34a_100000184111_100000731044 [0,2,0,0,0,0|2,0,0]=4 3283 B17R1.8326 CNC(=O)C(C)Oc1ccc(cc1)CC(=O)C 34a_100011218180_100000731044 [0,2,0,0,0,0|2,0,0]=4 3284 B17R1.8326 CNC(=O)C(C)Oc1ccc(cc1)CC(=O)C 7a_100011218180_100000209862 [0,2,0,0,0,0|2,0,0]=4 3285 B17R1.8326 CNC(=O)C(C)Oc1ccc(cc1)NC(=O)C 34a_100000184395_100000731044 [0,2,0,0,0,0|2,0,0]=4 3286 B17R1.8326 CNC(=O)C(C)Oc1ccc(cc1)NC(=O)C 7a_100000184395_100000209862 [0,2,0,0,0,0|2,0,0]=4 3287 B17R1.8326 CNC(=O)C(C)Sc1ccc(cc1)CC(=O)C 62a_100000209862_100000691760 [0,2,0,0,0,0|2,0,0]=4 3288 B17R1.8326 CNC(=O)C(C)Sc1ccc(cc1)CC(=O)C 62a_100000691760_100000731044 [0,2,0,0,0,0|2,0,0]=4 3289 B17R1.8326 CNC(=O)C(C)Sc1ccc(cc1)NC(=O)C 62a_100000209862_100000155215 [0,2,0,0,0,0|2,0,0]=4 3290 B17R1.8326 CNC(=O)C(C)Sc1ccc(cc1)OC(=O)C 62a_100000209862_100000002173 [0,2,0,0,0,0|1,0,0]=3 3291 B17R1.8326 CNC(=O)C(C)Sc1ccc(cc1)OC(=S)C 62a_100000209862_200009816735 [0,2,0,0,0,0|1,1,0]=4 3292 B17R1.8326 CNC(=O)C(C)Sc1ccc(cc1)SC(=O)C 62a_200009995050_100000731044 [0,2,0,0,0,0|1,1,0]=4 3293 B17R1.8326 CNC(=O)C(F)Nc1ccc(cc1)NC(=O)C 34a_100000184111_100009813575 [0,2,0,0,0,0|2,0,0]=4 3294 B17R1.8326 CNC(=O)C(F)Oc1ccc(cc1)CC(=O)C 34a_100011218180_100009813575 [0,2,0,0,0,0|2,0,0]=4 3295 B17R1.8326 CNC(=O)C(F)Oc1ccc(cc1)CC(=O)C 7a_100011218180_100009813575 [0,2,0,0,0,0|2,0,0]=4 3296 B17R1.8326 CNC(=O)C(F)Oc1ccc(cc1)NC(=O)C 34a_100000184395_100009813575 [0,2,0,0,0,0|2,0,0]=4 3297 B17R1.8326 CNC(=O)C(F)Oc1ccc(cc1)NC(=O)C 7a_100000184395_100009813575 [0,2,0,0,0,0|2,0,0]=4 3298 B17R1.8326 CNC(=O)C(F)Sc1ccc(cc1)CC(=O)C 62a_100000691760_100009813575 [0,2,0,0,0,0|2,0,0]=4 3299 B17R1.8326 CNC(=O)C(F)Sc1ccc(cc1)CC(=O)C 62a_100009813575_100000691760 [0,2,0,0,0,0|2,0,0]=4 3300 B17R1.8326 CNC(=O)C(F)Sc1ccc(cc1)NC(=O)C 62a_100009813575_100000155215 [0,2,0,0,0,0|2,0,0]=4 3301 B17R1.8326 CNC(=O)C(F)Sc1ccc(cc1)OC(=O)C 62a_100009813575_100000002173 [0,2,0,0,0,0|1,0,0]=3 3302 B17R1.8326 CNC(=O)C(F)Sc1ccc(cc1)OC(=S)C 62a_100009813575_200009816735 [0,2,0,0,0,0|1,1,0]=4 3303 B17R1.8326 CNC(=O)C(F)Sc1ccc(cc1)SC(=O)C 62a_200009995050_100009813575 [0,2,0,0,0,0|1,1,0]=4 3304 B17R1.8326 COC(=O)C(=O)Nc1ccc(cc1)OC(=O)C 11a_100009829859_100000024059 [0,2,0,0,0,0|1,0,1]=4 3305 B17R1.8326 COC(=O)C(=O)Nc1ccc(cc1)OC(=O)C 1626a_100009829859_100000024059 [0,2,0,0,0,0|1,0,1]=4 3306 B17R1.8326 COC(=O)C(=O)Nc1ccc(cc1)OC(=O)C 527a_100009829859_100000024059 [0,2,0,0,0,0|1,0,1]=4 3307 B17R1.8326 COC(=O)C(C)Nc1ccc(cc1)NC(=O)C 34a_100000184111_100000211248 [0,2,0,0,0,0|2,0,0]=4 3308 B17R1.8326 COC(=O)C(C)Oc1ccc(cc1)CC(=O)C 34a_100011218180_100000211248 [0,2,0,0,0,0|2,0,0]=4 3309 B17R1.8326 COC(=O)C(C)Oc1ccc(cc1)CC(=O)C 7a_100011218180_100000211248 [0,2,0,0,0,0|2,0,0]=4 3310 B17R1.8326 COC(=O)C(C)Oc1ccc(cc1)NC(=O)C 34a_100000184395_100000211248 [0,2,0,0,0,0|2,0,0]=4 3311 B17R1.8326 COC(=O)C(C)Oc1ccc(cc1)NC(=O)C 7a_100000184395_100000211248 [0,2,0,0,0,0|2,0,0]=4 3312 B17R1.8326 COC(=O)C(C)Sc1ccc(cc1)CC(=O)C 62a_100000211248_100000691760 [0,2,0,0,0,0|2,0,0]=4 3313 B17R1.8326 COC(=O)C(C)Sc1ccc(cc1)CC(=O)C 62a_100000691760_100000211248 [0,2,0,0,0,0|2,0,0]=4 3314 B17R1.8326 COC(=O)C(C)Sc1ccc(cc1)NC(=O)C 62a_100000211248_100000155215 [0,2,0,0,0,0|2,0,0]=4 3315 B17R1.8326 COC(=O)C(C)Sc1ccc(cc1)OC(=O)C 62a_100000211248_100000002173 [0,2,0,0,0,0|1,0,0]=3 3316 B17R1.8326 COC(=O)C(C)Sc1ccc(cc1)OC(=S)C 62a_100000211248_200009816735 [0,2,0,0,0,0|1,1,0]=4 3317 B17R1.8326 COC(=O)C(C)Sc1ccc(cc1)SC(=O)C 62a_200009995050_100000211248 [0,2,0,0,0,0|1,1,0]=4 3318 B17R1.8326 COC(=O)[C@@H](N)Cc1ccc(cc1)C=C(C)C 271570a_100102525489_100032004906 [0,2,0,0,0,0|2,0,0]=4 3319 B17R1.8326 COC(=O)[C@H](N)Cc1ccc(cc1)C=C(C)C 271570a_100102525489_100150708851 [0,2,0,0,0,0|2,0,0]=4 3320 B17R1.8326 COC(=O)[C@H](N)Cc1ccc(cc1)OC(C)C 34a_100012184189_100000210206 [0,2,0,0,0,0|1,0,1]=4 3321 B17R1.1314 CC(=O)Nc1ccc(cc1)C(=O)C(C)C(=O)C 1458a_100000070787_100000185171 [0,2,0,0,0,0|1,0,1]=4 3322 B17R1.1314 CC(=O)Nc1ccc(cc1)C(=O)C(C)C(=O)C 1458a_100000185149_100000179758 [0,2,0,0,0,0|1,0,1]=4 3323 B17R1.1314 CC(=O)Nc1ccc(cc1)N(C)C(C)C(=O)C 2230a_100000219403_100009814033 [0,2,0,0,0,0|2,0,0]=4 3324 B17R1.1314 CC(=O)Nc1ccc(cc1)N(C)C(C)C(=O)C 269982a_100000219403_100009814033 [0,2,0,0,0,0|2,0,0]=4 3325 B17R1.4791 CCC(=O)Nc1ccc(cc1)C(=O)CC(=O)C 1458a_100000070787_100000010380 [0,2,0,0,0,0|1,0,1]=4 3326 B17R1.4791 CCC(=O)Oc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_200009811598 [0,2,0,0,0,0|1,0,1]=4 3327 B17R1.7925 CC(=O)Oc1ccc(cc1F)[C@@H](N)CC(C)C 271570a_100015190218_100009811628 [0,2,0,0,0,0|1,0,1]=4 3328 B17R1.791 CCC(Sc1ccc(cc1)OC(=O)C)C(=O)N 62a_100000750255_100000002173 [0,2,0,0,0,0|2,0,0]=4 3329 B17R1.4792 CC(=O)C(C)Sc1ccc(cc1)NC(=O)CN 62a_100009814033_100000741985 [0,2,0,0,0,0|2,0,0]=4 3330 B17R1.4792 CCC(=O)Nc1ccc(cc1)OC(C)C(=O)C 7a_200000243810_100000179758 [0,2,0,0,0,0|2,0,0]=4 3331 B17R1.4792 CCC(=O)Oc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_200009811598 [0,2,0,0,0,0|1,0,0]=3 3332 B17R1.4792 CCC(=O)Oc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_200009811598 [0,2,0,0,0,0|2,0,0]=4 3333 B17R1.4792 CCC(=O)Oc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_200009811598 [0,2,0,0,0,0|2,0,0]=4 3334 B17R1.4792 CCC(=O)Oc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_200009811598 [0,2,0,0,0,0|2,0,0]=4 3335 B17R1.4792 CNC(=O)Cc1ccc(cc1)NC(C)C(=O)C 2230a_100000736799_100009814033 [0,2,0,0,0,0|2,0,0]=4 3336 B17R1.4792 CNC(=O)Cc1ccc(cc1)SC(C)C(=O)C 62a_100000155101_100009814033 [0,2,0,0,0,0|2,0,0]=4 3337 B17R1.4792 CNC(=O)Cc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000155101 [0,2,0,0,0,0|2,0,0]=4 3338 B17R1.4792 COC(=O)Cc1ccc(cc1)SC(C)C(=O)C 62a_100000149743_100009814033 [0,2,0,0,0,0|2,0,0]=4 3339 B17R1.4792 COC(=O)Cc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000149743 [0,2,0,0,0,0|2,0,0]=4 3340 B17R1.4792 COC(=O)Nc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000181880 [0,2,0,0,0,0|2,0,0]=4 3341 B17R1.7923 CC(=O)Cc1ccc(c(c1)Br)OC(C)C(=O)C 7a_100010141077_100000179758 [0,2,0,0,0,0|2,0,0]=4 3342 B17R1.7923 CC(=O)Cc1ccc(c(c1)C)OC(C)C(=O)C 7a_200000080089_100000179758 [0,2,0,0,0,0|2,0,0]=4 3343 B17R1.7923 CC(=O)Cc1ccc(c(c1)Cl)OC(C)C(=O)C 7a_200000080078_100000179758 [0,2,0,0,0,0|2,0,0]=4 3344 B17R1.7923 CC(=O)Nc1ccc(c(c1)C)OC(C)C(=O)C 7a_100012186693_100000179758 [0,2,0,0,0,0|2,0,0]=4 3345 B17R1.7923 CC(=O)Nc1ccc(c(c1)C)SC(C)C(=O)C 62a_100009814033_100000155607 [0,2,0,0,0,0|2,0,0]=4 3346 B17R1.7923 CC(=O)Nc1ccc(c(c1)Cl)OC(C)C(=O)C 7a_100011215158_100000179758 [0,2,0,0,0,0|2,0,0]=4 3347 B17R1.7923 CC(=O)Nc1ccc(c(c1)F)SC(C)C(=O)C 62a_100009814033_100011219590 [0,2,0,0,0,0|2,0,0]=4 3348 B17R1.7926 CC(=O)Cc1ccc(cc1Cl)OC(C)C(=O)C 7a_200000084595_100000179758 [0,2,0,0,0,0|2,0,0]=4 3349 B17R1.7926 CC(=O)Nc1ccc(cc1C)NC(C)C(=O)C 7a_100000736504_100000179758 [0,2,0,0,0,0|2,0,0]=4 3350 B17R1.7926 CC(=O)Nc1ccc(cc1C)SC(C)C(=O)C 62a_100009814033_100000152120 [0,2,0,0,0,0|2,0,0]=4 3351 B17R1.7926 CC(=O)Nc1ccc(cc1Cl)NC(C)C(=O)C 7a_100000244014_100000179758 [0,2,0,0,0,0|2,0,0]=4 3352 B17R1.7926 CC(=O)Nc1ccc(cc1Cl)SC(C)C(=O)C 62a_100009814033_100011273303 [0,2,0,0,0,0|2,0,0]=4 3353 B17R1.7926 CC(=O)Nc1ccc(cc1F)SC(C)C(=O)C 62a_100009814033_100000155584 [0,2,0,0,0,0|2,0,0]=4 3354 B17R1.7926 CC(=O)Oc1ccc(cc1F)SC(C)C(=O)C 62a_100009811628_100009814033 [0,2,0,0,0,0|1,0,0]=3 3355 B17R1.7926 CC(=O)Oc1ccc(cc1F)SC(C)C(=O)C 62a_100009814033_100009811628 [0,2,0,0,0,0|1,0,0]=3 3356 B17R1.7926 CC(=O)Oc1ccc(cc1F)SC(C)C(=O)N 62a_100000702099_100009811628 [0,2,0,0,0,0|2,0,0]=4 3357 B17R1.7926 CC(=O)Oc1ccc(cc1F)SC(C)C(=O)N 62a_100009811628_100000702099 [0,2,0,0,0,0|2,0,0]=4 3358 B17R1.7926 CC(=O)Oc1ccc(cc1F)SC(F)C(=O)N 62a_100009811628_100009813875 [0,2,0,0,0,0|2,0,0]=4 3359 B17R1.7926 CC(=O)Oc1ccc(cc1F)SC(F)C(=O)N 62a_100009813875_100009811628 [0,2,0,0,0,0|2,0,0]=4 3360 B17R1.7926 CC(=O)Oc1ccc(cc1F)SC(F)C(=O)[O-] 62a_100009811628_100020610796 [0,2,0,0,0,0|2,0,0]=4 3361 B17R1.7926 CC(=O)Oc1ccc(cc1F)SC(F)C(=O)[O-] 62a_100020610796_100009811628 [0,2,0,0,0,0|2,0,0]=4 3362 B17R1.26216 CC(=O)C(C)(C)Sc1ccc(cc1)OC(=S)C 62a_100000075568_200009816735 [0,2,0,0,0,0|1,1,0]=4 3363 B17R1.26216 CC(=O)Cc1ccc(cc1)OC(C)(C)C(=O)C 7a_100011218180_100000075568 [0,2,0,0,0,0|2,0,0]=4 3364 B17R1.26216 CC(=O)Cc1ccc(cc1)SC(C)(C)C(=O)C 62a_100000075568_100000691760 [0,2,0,0,0,0|2,0,0]=4 3365 B17R1.26216 CC(=O)Cc1ccc(cc1)SC(C)(C)C(=O)C 62a_100000691760_100000075568 [0,2,0,0,0,0|2,0,0]=4 3366 B17R1.26216 CC(=O)Nc1ccc(cc1)OC(C)(C)C(=O)C 7a_100000184395_100000075568 [0,2,0,0,0,0|2,0,0]=4 3367 B17R1.26216 CC(=O)Nc1ccc(cc1)SC(C)(C)C(=O)C 62a_100000075568_100000155215 [0,2,0,0,0,0|2,0,0]=4 3368 B17R1.26216 CC(=O)Oc1ccc(cc1)SC(C)(C)C(=O)C 62a_100000075568_100000002173 [0,2,0,0,0,0|1,0,0]=3 3369 B17R1.26216 CC(=O)Oc1ccc(cc1)SC(C)(C)C(=O)N 62a_100000702505_100000002173 [0,2,0,0,0,0|2,0,0]=4 3370 B17R1.26216 CC(=O)Oc1ccc(cc1)SC(F)(F)C(=O)N 62a_100009811971_100000002173 [0,2,0,0,0,0|2,0,0]=4 3371 B17R1.26216 CC(=O)Oc1ccc(cc1)SC(F)(F)C(=O)[O-] 62a_100000745680_100000002173 [0,2,0,0,0,0|2,0,0]=4 3372 B17R1.26216 CC(=O)Sc1ccc(cc1)SC(C)(C)C(=O)C 62a_200009995050_100000075568 [0,2,0,0,0,0|1,1,0]=4 3373 B17R1.1629 C#CCC(=O)Nc1ccc(cc1)CNC(=O)C 1626a_100000755463_100011220946 [0,2,0,0,0,0|2,0,0]=4 3374 B17R1.1629 C#CCC(=O)Nc1ccc(cc1)CNC(=O)C 527a_100000755463_100011220946 [0,2,0,0,0,0|2,0,0]=4 3375 B17R1.1629 C=CCC(=O)Nc1ccc(cc1)CNC(=O)C 11a_100000755463_100000210193 [0,2,0,0,0,0|2,0,0]=4 3376 B17R1.1629 C=CCC(=O)Nc1ccc(cc1)CNC(=O)C 1626a_100000755463_100000210193 [0,2,0,0,0,0|2,0,0]=4 3377 B17R1.1629 C=CCC(=O)Nc1ccc(cc1)CNC(=O)C 22a_100000755463_100000210193 [0,2,0,0,0,0|2,0,0]=4 3378 B17R1.1629 C=CCC(=O)Nc1ccc(cc1)CNC(=O)C 527a_100000755463_100000210193 [0,2,0,0,0,0|2,0,0]=4 3379 B17R1.1629 CC#CC(=O)Nc1ccc(cc1)CNC(=O)C 22a_100000755463_100000763181 [0,2,0,0,0,0|2,0,0]=4 3380 B17R1.1629 CC(=O)CCc1ccc(cc1)OC(C)CC#N 7a_100000198047_100009813641 [0,2,0,0,0,0|1,0,1]=4 3381 B17R1.1629 CC(=O)CCc1ccc(cc1)OC(C)CCO 34a_100000198047_100009893172 [0,2,0,0,0,0|0,0,2]=4 3382 B17R1.1629 CC(=O)CCc1ccc(cc1)OC(C)CCO 7a_100000198047_100009893172 [0,2,0,0,0,0|0,0,2]=4 3383 B17R1.1629 CC(=O)NCc1ccc(cc1)NC(=O)CC#N 1626a_100000755463_100051588842 [0,2,0,0,0,0|2,0,0]=4 3384 B17R1.1629 CC(=O)NCc1ccc(cc1)NC(=O)CC#N 22a_100000755463_100051588842 [0,2,0,0,0,0|2,0,0]=4 3385 B17R1.1629 CC(=O)NCc1ccc(cc1)NC(=O)CCO 22a_100000755463_100011216618 [0,2,0,0,0,0|2,0,0]=4 3386 B17R1.1629 CC=CC(=O)Nc1ccc(cc1)CNC(=O)C 11a_100000755463_100000210699 [0,2,0,0,0,0|2,0,0]=4 3387 B17R1.1629 CC=CC(=O)Nc1ccc(cc1)CNC(=O)C 1626a_100000755463_100000210699 [0,2,0,0,0,0|2,0,0]=4 3388 B17R1.1629 CC=CC(=O)Nc1ccc(cc1)CNC(=O)C 22a_100000755463_100000210699 [0,2,0,0,0,0|2,0,0]=4 3389 B17R1.1629 CCCC(=O)Nc1ccc(cc1)CNC(=O)C 11a_100000755463_100000211992 [0,2,0,0,0,0|2,0,0]=4 3390 B17R1.1629 CCCC(=O)Nc1ccc(cc1)CNC(=O)C 1626a_100000755463_100000211992 [0,2,0,0,0,0|2,0,0]=4 3391 B17R1.1629 CCCC(=O)Nc1ccc(cc1)CNC(=O)C 22a_100000755463_100000211992 [0,2,0,0,0,0|2,0,0]=4 3392 B17R1.1629 CCCC(=O)Nc1ccc(cc1)CNC(=O)C 527a_100000755463_100000211992 [0,2,0,0,0,0|2,0,0]=4 3393 B17R1.1629 CCCC(C)Oc1ccc(cc1)CCC(=O)C 34a_100000198047_100000766640 [0,2,0,0,0,0|1,0,1]=4 3394 B17R1.1629 CCCC(C)Oc1ccc(cc1)CCC(=O)C 7a_100000198047_100000766640 [0,2,0,0,0,0|1,0,1]=4 3395 B17R1.1629 CCNC(=O)Nc1ccc(cc1)CNC(=O)C 2430a_100000755463_100015525214 [0,2,0,0,0,0|2,0,0]=4 3396 B17R1.1629 CCOC(=O)Cc1ccc(cc1)CNC(=O)C 188690a_100016989628_100015343762 [0,2,0,0,0,0|2,0,0]=4 3397 B17R1.1629 COCC(=O)Nc1ccc(cc1)CNC(=O)C 11a_100000755463_100000210968 [0,2,0,0,0,0|2,0,0]=4 3398 B17R1.1629 COCC(=O)Nc1ccc(cc1)CNC(=O)C 1626a_100000755463_100000210968 [0,2,0,0,0,0|2,0,0]=4 3399 B17R1.1629 COCC(=O)Nc1ccc(cc1)CNC(=O)C 22a_100000755463_100000210968 [0,2,0,0,0,0|2,0,0]=4 3400 B17R1.1629 COCC(=O)Nc1ccc(cc1)CNC(=O)C 527a_100000755463_100000210968 [0,2,0,0,0,0|2,0,0]=4 3401 B17R1.1629 COCC(C)Oc1ccc(cc1)CCC(=O)C 34a_100000198047_100000765312 [0,2,0,0,0,0|0,0,2]=4 3402 B17R1.1629 COCC(C)Oc1ccc(cc1)CCC(=O)C 7a_100000198047_100000765312 [0,2,0,0,0,0|0,0,2]=4 3403 B17R1.1629 CSCC(=O)Nc1ccc(cc1)CNC(=O)C 11a_100000755463_100000184570 [0,2,0,0,0,0|2,0,0]=4 3404 B17R1.1629 CSCC(=O)Nc1ccc(cc1)CNC(=O)C 1626a_100000755463_100000184570 [0,2,0,0,0,0|2,0,0]=4 3405 B17R1.1629 CSCC(=O)Nc1ccc(cc1)CNC(=O)C 22a_100000755463_100000184570 [0,2,0,0,0,0|2,0,0]=4 3406 B17R1.1629 CSCC(=O)Nc1ccc(cc1)CNC(=O)C 527a_100000755463_100000184570 [0,2,0,0,0,0|2,0,0]=4 3407 B17R1.13061 C#CC(C)(C)Oc1ccc(cc1)CCC(=O)C 34a_100000198047_100000038118 [0,2,0,0,0,0|1,0,1]=4 3408 B17R1.13061 CC(=O)CCc1ccc(cc1)OC(C)(C)C#N 34a_100000198047_100011162410 [0,2,0,0,0,0|1,0,1]=4 3409 B17R1.13061 CC(=O)CCc1ccc(cc1)OC(C)(C)C#N 7a_100000198047_100011162410 [0,2,0,0,0,0|1,0,1]=4 3410 B17R1.13061 CCC(C)(C)Oc1ccc(cc1)CCC(=O)C 7a_100000198047_100000210677 [0,2,0,0,0,0|1,0,1]=4 3411 B17R1.19374 CC(=O)CCc1ccc(cc1)OC(C=O)C=O 34a_100000198047_100000736813 [0,2,0,0,0,0|0,0,2]=4 3412 B17R1.19374 CCC(CC)Oc1ccc(cc1)CCC(=O)C 7a_100000198047_100000210505 [0,2,0,0,0,0|1,0,1]=4 3413 B17R1.5264 COc1cc(ccc1OC(C)C)CCC(=O)C 34a_100011290831_100000210206 [0,2,0,0,0,0|1,0,1]=4 3414 B17R1.5264 COc1cc(ccc1OC(C)C)CCC(=O)C 7a_100011290831_100000210206 [0,2,0,0,0,0|1,0,1]=4 3415 B17R1.76148 C=C(C)CSc1cc(c(c(c1)C)OC(=O)C)C 62a_100000748629_200009816532 [0,2,0,0,0,0|2,0,0]=4 3416 B17R1.76148 C=C(C)CSc1cc(c(c(c1)C)OC(=O)C)C 62a_200009816532_100000211660 [0,2,0,0,0,0|2,0,0]=4 3417 B17R1.76148 CC(=O)Oc1c(cc(cc1C)SCC(=O)N)C 62a_100000747473_200009816532 [0,2,0,0,0,0|2,0,0]=4 3418 B17R1.76148 CC(=O)Oc1c(cc(cc1C)SCC(=O)N)C 62a_200009816532_100000747473 [0,2,0,0,0,0|2,0,0]=4 3419 B17R1.76148 CC(=O)Oc1c(cc(cc1C)SCC(=O)[O-])C 62a_100020667443_200009816532 [0,2,0,0,0,0|2,0,0]=4 3420 B17R1.76148 CC(=O)Oc1c(cc(cc1C)SCC(=O)[O-])C 62a_200009816532_100020667443 [0,2,0,0,0,0|2,0,0]=4 3421 B17R1.27821 C=C(C)CSc1ccc(cc1C=O)OC(=O)C 62a_100000748629_100009816906 [0,2,0,0,0,0|2,0,0]=4 3422 B17R1.27821 C=C(C)CSc1ccc(cc1C=O)OC(=O)C 62a_100009816906_100000211660 [0,2,0,0,0,0|2,0,0]=4 3423 B17R1.27821 CC(=O)Oc1ccc(c(c1)C=O)SCC(=O)N 62a_100000747473_100009816906 [0,2,0,0,0,0|2,0,0]=4 3424 B17R1.27821 CC(=O)Oc1ccc(c(c1)C=O)SCC(=O)N 62a_100009816906_100000747473 [0,2,0,0,0,0|2,0,0]=4 3425 B17R1.27821 CC(=O)Oc1ccc(c(c1)C=O)SCC(=O)[O-] 62a_100009816906_100020667443 [0,2,0,0,0,0|2,0,0]=4 3426 B17R1.27821 CC(=O)Oc1ccc(c(c1)C=O)SCC(=O)[O-] 62a_100020667443_100009816906 [0,2,0,0,0,0|2,0,0]=4 3427 B15R2.1668 CC(=O)Nc1ccc2c(c1)CCCC2 11a_100011205400_100015343762 [1,0,0,1,0,0|1,0,1]=4 3428 B15R2.1668 CC(=O)Nc1ccc2c(c1)CCCC2 1626a_100011205400_100015343762 [1,0,0,1,0,0|1,0,1]=4 3429 B15R2.1668 CC(=O)Nc1ccc2c(c1)CCCC2 22a_100011205400_100000070787 [1,0,0,1,0,0|1,0,1]=4 3430 B15R2.1668 CC(=O)Nc1ccc2c(c1)CCCC2 527a_100011205400_100103153847 [1,0,0,1,0,0|1,0,1]=4 3431 B15R2.17700 C=CCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100015514636 [1,0,0,1,0,0|1,0,1]=4 3432 B15R2.17700 C=CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100015514636 [1,0,0,1,0,0|1,0,1]=4 3433 B15R2.17700 CCCCc1ccc2c(c1)CC(=O)C2 271570a_100020621405_100010185598 [1,0,0,1,0,0|1,0,1]=4 3434 B15R2.17700 CCCCc1ccc2c(c1)CC(=O)N2 271570a_100020621405_100000754858 [1,0,0,1,0,0|1,0,1]=4 3435 B15R2.17700 CCCCc1ccc2oc(=O)[nH]c2c1 271570a_100020621405_100000764829 [1,0,0,1,0,0|1,0,1]=4 3436 B15R2.17700 CCCCc1ccc2oc(nc2c1)C 271570a_100020621405_100009816932 [1,0,0,1,0,0|1,0,1]=4 3437 B15R2.17700 CCCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000210303 [1,0,0,1,0,0|1,0,1]=4 3438 B15R2.17700 CCCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000210303 [1,0,0,1,0,0|1,0,1]=4 3439 B15R2.17700 CSCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100011218213 [1,0,0,1,0,0|2,0,0]=4 3440 B15R2.17700 Cc1nc2cc(ccc2o1)NCC=O 34a_100000195416_200009817547 [1,0,0,1,0,0|2,0,0]=4 3441 B15R2.17700 Cc1nc2cc(ccc2o1)OCC=O 34a_100000102623_200009817547 [1,0,0,1,0,0|2,0,0]=4 3442 B15R2.17700 Cc1nc2cc(ccc2o1)OCC=O 7a_100000102623_200015260668 [1,0,0,1,0,0|2,0,0]=4 3443 B15R2.17700 Cc1nc2cc(ccc2o1)SCC=O 62a_200015260668_100009816932 [1,0,0,1,0,0|2,0,0]=4 3444 B15R2.17700 O=CCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_200009817547 [1,0,0,1,0,0|1,0,0]=3 3445 B15R2.17700 O=CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_200015260668 [1,0,0,1,0,0|1,0,0]=3 3446 B15R2.17700 O=CCSc1ccc2c(c1)CC(=O)C2 62a_100010185598_200015260668 [1,0,0,1,0,0|2,0,0]=4 3447 B15R2.17700 O=CCSc1ccc2c(c1)CC(=O)N2 62a_200015260668_100000754858 [1,0,0,1,0,0|2,0,0]=4 3448 B15R2.49965 CC(=Cc1ccc2c(c1)C(=O)CC2)C 271570a_100102525489_100000759401 [1,0,0,1,0,0|2,0,0]=4 3449 B15R2.49965 CC(=O)Nc1ccc2c(c1)C(=O)NC2 11a_100000747504_100015343762 [1,0,0,1,0,0|2,0,0]=4 3450 B15R2.49965 CC(=O)Nc1ccc2c(c1)C(=O)NC2 1626a_100000747504_100015343762 [1,0,0,1,0,0|2,0,0]=4 3451 B15R2.49965 CC(=O)Nc1ccc2c(c1)C(=O)NC2 22a_100000747504_100000070787 [1,0,0,1,0,0|2,0,0]=4 3452 B15R2.49965 CC(=O)Nc1ccc2c(c1)C(=O)NC2 527a_100000747504_100103153847 [1,0,0,1,0,0|2,0,0]=4 3453 B15R2.49965 CC(C)Oc1ccc2c(c1)C(=O)CC2 34a_100009827925_100000210206 [1,0,0,1,0,0|1,0,1]=4 3454 B15R2.49965 CC(C)Oc1ccc2c(c1)C(=O)CC2 7a_100009827925_100000210206 [1,0,0,1,0,0|1,0,1]=4 3455 B15R2.1282 CC=Cc1ccc2c(c1)CC(=O)CC2 271570a_100016259895_100010138410 [1,0,0,1,0,0|1,0,0]=3 3456 B15R2.1282 CC=Cc1ccc2c(c1)NC(=O)CC2 271570a_100016259895_100000763451 [1,0,0,1,0,0|2,0,0]=4 3457 B15R2.1282 CCOc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100000210202 [1,0,0,1,0,0|0,0,1]=3 3458 B15R2.1282 CCOc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100000210202 [1,0,0,1,0,0|0,0,1]=3 3459 B15R2.1282 CCOc1ccc2c(c1)NC(=O)CC2 34a_100000708604_100000210202 [1,0,0,1,0,0|1,0,1]=4 3460 B15R2.1282 CCOc1ccc2c(c1)OC(=O)CC2 7a_100000044819_100000210202 [1,0,0,1,0,0|1,0,1]=4 3461 B15R2.1282 CCSc1ccc2c(c1)CC(=O)CC2 62a_100000210202_100010138410 [1,0,0,1,0,0|0,1,1]=4 3462 B15R2.1282 CCSc1ccc2c(c1)CC(=O)CC2 62a_100010138410_100000210202 [1,0,0,1,0,0|0,1,1]=4 3463 B15R2.1282 O=C1CCc2ccc(cc2C1)OCF 34a_200000081095_100015361967 [1,0,0,1,0,0|1,0,1]=4 3464 B15R2.1282 O=C1CCc2ccc(cc2C1)OCF 7a_200000081095_100015361967 [1,0,0,1,0,0|1,0,1]=4 3465 B15R2.2185 CC=Cc1ccc(cc1)C2CC(=O)C2 271570a_100016259895_100000741321 [1,0,0,1,0,0|1,0,0]=3 3466 B15R2.2185 CCSc1ccc(cc1)C2CC(=O)C2 62a_100000210202_100000741321 [1,0,0,1,0,0|0,1,1]=4 3467 B15R2.2185 CCSc1ccc(cc1)C2CC(=O)C2 62a_100000741321_100000210202 [1,0,0,1,0,0|0,1,1]=4 3468 B15R2.7686 CC(=O)CCc1ccc(cc1)C2CC2 271570a_100011220607_100000723691 [1,0,0,1,0,0|1,0,1]=4 3469 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000070787_100000763274 [1,0,0,1,0,0|0,0,1]=3 3470 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200000210301 [1,0,0,1,0,0|0,0,1]=3 3471 B15R2.7688 CC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200000210301 [1,0,0,1,0,0|0,0,2]=4 3472 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 11a_100011219410_100015343762 [1,0,0,1,0,0|1,0,1]=4 3473 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 1626a_100011219410_100015343762 [1,0,0,1,0,0|1,0,1]=4 3474 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 240690a_100011219410_100015343762 [1,0,0,1,0,0|1,0,1]=4 3475 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 527a_100011219410_100103153847 [1,0,0,1,0,0|1,0,1]=4 3476 B15R2.7688 CC(=O)NCc1ccc2occc2c1 11a_100020591328_100015343762 [1,0,0,1,0,0|1,0,1]=4 3477 B15R2.7688 CC(=O)NCc1ccc2occc2c1 1626a_100020591328_100015343762 [1,0,0,1,0,0|1,0,1]=4 3478 B15R2.7688 CC(=O)NCc1ccc2occc2c1 240690a_100020591328_100015343762 [1,0,0,1,0,0|1,0,1]=4 3479 B15R2.7688 CC(=O)NCc1ccc2occc2c1 527a_100020591328_100103153847 [1,0,0,1,0,0|1,0,1]=4 3480 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200025704644 [1,0,0,1,0,0|0,0,1]=3 3481 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200025704644 [1,0,0,1,0,0|0,0,2]=4 3482 B15R2.1081 C=C(C)c1ccc(cc1)C2CC(=O)C2 271570a_100000694244_100000741321 [0,0,0,1,1,0|1,0,0]=3 3483 B15R2.7174 C=C(C)c1ccc2c(c1)CC(=O)CC2 271570a_100000694244_100010138410 [0,0,0,1,1,0|1,0,0]=3 3484 B15R2.7174 C=C(C)c1ccc2c(c1)NC(=O)CC2 271570a_100000694244_100000763451 [0,0,0,1,1,0|2,0,0]=4 3485 B15R2.7174 CC(=O)c1ccc2c(c1)NC(=O)CO2 1458a_100000187493_200000210301 [0,0,0,1,1,0|2,0,0]=4 3486 B15R2.7174 CC(=O)c1ccc2c(c1)NC(=O)CS2 1458a_100000010532_200000210301 [0,0,0,1,1,0|2,0,0]=4 3487 B15R2.7174 [13CH3]C(=O)c1ccc2c(c1)NC(=O)CO2 1458a_100000187493_200025704644 [0,0,0,1,1,0|2,0,0]=4 3488 B15R2.7174 [13CH3]C(=O)c1ccc2c(c1)NC(=O)CS2 1458a_100000010532_200025704644 [0,0,0,1,1,0|2,0,0]=4 3489 B15R2.926 CC(=Cc1ccc2c(c1)CC(=O)C2)C 271570a_100102525489_100010185598 [0,0,0,1,1,0|2,0,0]=4 3490 B15R2.926 CC(=O)Nc1ccc2c(c1)CC(=O)N2 22a_100000747106_100000070787 [0,0,0,1,1,0|2,0,0]=4 3491 B15R2.926 CC(=O)Nc1ccc2c(c1)CC(=O)N2 527a_100000747106_100103153847 [0,0,0,1,1,0|2,0,0]=4 3492 B15R2.926 CC(=O)Nc1ccc2c(c1)NC(=O)C2 22a_100000721629_100000070787 [0,0,0,1,1,0|2,0,0]=4 3493 B15R2.926 CC(=O)Nc1ccc2c(c1)NC(=O)C2 527a_100000721629_100103153847 [0,0,0,1,1,0|2,0,0]=4 3494 B15R2.926 CC(=O)Nc1ccc2oc(nc2c1)C 11a_100000195416_100015343762 [0,0,0,1,1,0|2,0,0]=4 3495 B15R2.926 CC(=O)Nc1ccc2oc(nc2c1)C 1626a_100000195416_100015343762 [0,0,0,1,1,0|2,0,0]=4 3496 B15R2.926 CC(=O)Nc1ccc2oc(nc2c1)C 22a_100000195416_100000070787 [0,0,0,1,1,0|2,0,0]=4 3497 B15R2.926 CC(=O)Nc1ccc2oc(nc2c1)C 527a_100000195416_100103153847 [0,0,0,1,1,0|2,0,0]=4 3498 B17R2.5202 C=C(C)CSc1ccc(cc1)C2CC(=O)C2 62a_100000741321_100000211660 [0,0,0,1,0,1|1,1,0]=4 3499 B17R2.5202 C=C(C)CSc1ccc(cc1)C2CC(=O)C2 62a_100000748629_100000741321 [0,0,0,1,0,1|1,1,0]=4 3500 B17R2.5202 NC(=O)CSc1ccc(cc1)C2CC(=O)C2 62a_100000741321_100000747473 [0,0,0,1,0,1|1,1,0]=4 3501 B17R2.5202 NC(=O)CSc1ccc(cc1)C2CC(=O)C2 62a_100000747473_100000741321 [0,0,0,1,0,1|1,1,0]=4 3502 B17R2.5202 O=C([O-])CSc1ccc(cc1)C2CC(=O)C2 62a_100000741321_100020667443 [0,0,0,1,0,1|1,1,0]=4 3503 B17R2.5202 O=C([O-])CSc1ccc(cc1)C2CC(=O)C2 62a_100020667443_100000741321 [0,0,0,1,0,1|1,1,0]=4 3504 B17R2.19729 C=C(C)COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100000748629 [0,0,0,1,0,1|1,0,0]=3 3505 B17R2.19729 C=C(C)COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100000748629 [0,0,0,1,0,1|1,0,0]=3 3506 B17R2.19729 C=C(C)COc1ccc2c(c1)NC(=O)CC2 34a_100000708604_100000748629 [0,0,0,1,0,1|2,0,0]=4 3507 B17R2.19729 C=C(C)COc1ccc2c(c1)OC(=O)CC2 7a_100000044819_100000748629 [0,0,0,1,0,1|2,0,0]=4 3508 B17R2.19729 C=C(C)CSc1ccc2c(c1)CC(=O)CC2 62a_100000748629_100010138410 [0,0,0,1,0,1|1,1,0]=4 3509 B17R2.19729 C=C(C)CSc1ccc2c(c1)CC(=O)CC2 62a_100010138410_100000211660 [0,0,0,1,0,1|1,1,0]=4 3510 B17R2.19729 C=C(F)COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100009893438 [0,0,0,1,0,1|1,0,1]=4 3511 B17R2.19729 C=C(F)COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100000042424 [0,0,0,1,0,1|1,0,1]=4 3512 B17R2.19729 CC(C)COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100000210624 [0,0,0,1,0,1|1,0,1]=4 3513 B17R2.19729 CC(C)COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100000210760 [0,0,0,1,0,1|1,0,1]=4 3514 B17R2.19729 CC(O)COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100011218427 [0,0,0,1,0,1|0,0,2]=4 3515 B17R2.19729 CC(O)COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100011218427 [0,0,0,1,0,1|0,0,2]=4 3516 B17R2.19729 C[C@@H](O)COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100009817552 [0,0,0,1,0,1|0,0,2]=4 3517 B17R2.19729 C[C@@H](O)COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100009817552 [0,0,0,1,0,1|0,0,2]=4 3518 B17R2.19729 NC(=O)COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100000187820 [0,0,0,1,0,1|1,0,0]=3 3519 B17R2.19729 NC(=O)COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100000187820 [0,0,0,1,0,1|1,0,0]=3 3520 B17R2.19729 NC(=O)COc1ccc2c(c1)NC(=O)CC2 34a_100000708604_100000187820 [0,0,0,1,0,1|2,0,0]=4 3521 B17R2.19729 NC(=O)COc1ccc2c(c1)OC(=O)CC2 7a_100000044819_100000187820 [0,0,0,1,0,1|2,0,0]=4 3522 B17R2.19729 NC(=O)CSc1ccc2c(c1)CC(=O)CC2 62a_100000747473_100010138410 [0,0,0,1,0,1|1,1,0]=4 3523 B17R2.19729 NC(=O)CSc1ccc2c(c1)CC(=O)CC2 62a_100010138410_100000747473 [0,0,0,1,0,1|1,1,0]=4 3524 B17R2.19729 O=C([O-])COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100020667443 [0,0,0,1,0,1|1,0,0]=3 3525 B17R2.19729 O=C([O-])COc1ccc2c(c1)NC(=O)CC2 34a_100000708604_100020667443 [0,0,0,1,0,1|2,0,0]=4 3526 B17R2.19729 O=C([O-])CSc1ccc2c(c1)CC(=O)CC2 62a_100010138410_100020667443 [0,0,0,1,0,1|1,1,0]=4 3527 B17R2.19729 O=C([O-])CSc1ccc2c(c1)CC(=O)CC2 62a_100020667443_100010138410 [0,0,0,1,0,1|1,1,0]=4 3528 B17R2.19729 O=C1CCc2ccc(cc2C1)OC[N+](=O)[O-] 34a_200000081095_100000761209 [0,0,0,1,0,1|2,0,0]=4 3529 B17R2.44905 CC(=O)CCc1ccc(cc1)OCC2CC2 34a_100000198047_100000742324 [0,0,0,1,0,1|1,0,1]=4 3530 B17R2.44905 CC(=O)CCc1ccc(cc1)OCC2CC2 7a_100000198047_100000742324 [0,0,0,1,0,1|1,0,1]=4 3531 B17R2.44905 CC(=O)CCc1ccc(cc1)OCC2CO2 34a_100000198047_102125554688 [0,0,0,1,0,1|0,0,2]=4 3532 B17R2.44905 CC(=O)CCc1ccc(cc1)OCC2CO2 7a_100000198047_102125554688 [0,0,0,1,0,1|0,0,2]=4 3533 B17R2.44905 CC(=O)CCc1ccc(cc1)OCC2CS2 7a_100000198047_100000031435 [0,0,0,1,0,1|0,1,1]=4 3534 B17R2.44905 CC(=O)CCc1ccc(cc1)OC[C@@H]2CO2 7a_100000198047_100000745022 [0,0,0,1,0,1|0,0,2]=4 3535 B17R2.3226 CC(=O)Cc1ccc(cc1)C2=CC(=O)CC2 271570a_100010737933_100000691760 [0,0,0,1,0,1|1,0,1]=4 3536 B17R2.3226 CC(=O)Nc1ccc(cc1)C2=CC(=O)CC2 271570a_100010737933_100000155215 [0,0,0,1,0,1|1,0,1]=4 3537 B17R2.3226 CC(=O)Oc1ccc(cc1)C2=CC(=O)CC2 271570a_100010737933_100000002173 [0,0,0,1,0,1|0,0,1]=3 3538 B17R2.3226 CC(=O)Sc1ccc(cc1)C2=CC(=O)CC2 271570a_100010737933_200009995050 [0,0,0,1,0,1|0,1,1]=4 3539 B17R2.3226 CC(=S)Oc1ccc(cc1)C2=CC(=O)CC2 271570a_100010737933_200009816735 [0,0,0,1,0,1|0,1,1]=4 3540 B17R2.4859 C=C(C)CCNc1ccc2oc(nc2c1)C 34a_100000195416_100000730704 [0,0,0,1,0,1|2,0,0]=4 3541 B17R2.4859 C=C(C)CCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000730704 [0,0,0,1,0,1|1,0,0]=3 3542 B17R2.4859 C=C(C)CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000730704 [0,0,0,1,0,1|1,0,0]=3 3543 B17R2.4859 C=C(C)CCOc1ccc2oc(nc2c1)C 34a_100000102623_100000730704 [0,0,0,1,0,1|2,0,0]=4 3544 B17R2.4859 C=C(C)CCOc1ccc2oc(nc2c1)C 7a_100000102623_100000730704 [0,0,0,1,0,1|2,0,0]=4 3545 B17R2.4859 C=C(C)CCSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000730704 [0,0,0,1,0,1|2,0,0]=4 3546 B17R2.4859 C=C(C)CCSc1ccc2c(c1)CC(=O)N2 62a_100000730704_100000754858 [0,0,0,1,0,1|2,0,0]=4 3547 B17R2.4859 C=C(C)CCSc1ccc2oc(nc2c1)C 62a_100000730704_100009816932 [0,0,0,1,0,1|2,0,0]=4 3548 B17R2.4859 C=C(C)COCc1ccc2oc(nc2c1)C 34a_200009878806_100000748629 [0,0,0,1,0,1|2,0,0]=4 3549 B17R2.4859 C=C(C)COCc1ccc2oc(nc2c1)C 7a_200009878806_100000748629 [0,0,0,1,0,1|2,0,0]=4 3550 B17R2.4859 CC(=CCOc1ccc2c(c1)CC(=O)O2)C 34a_100000035078_100000761012 [0,0,0,1,0,1|1,0,1]=4 3551 B17R2.4859 CC(=CCOc1ccc2c(c1)CC(=O)O2)C 7a_100000035078_100000761012 [0,0,0,1,0,1|1,0,1]=4 3552 B17R2.4859 CC(=O)CCOc1ccc2[nH]c(=O)oc2c1 7a_200000068749_100000053229 [0,0,0,1,0,1|2,0,0]=4 3553 B17R2.4859 CC(=O)CCOc1ccc2[nH]c(cc2c1)C 7a_100000073708_100000053229 [0,0,0,1,0,1|2,0,0]=4 3554 B17R2.4859 CC(=O)CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000053229 [0,0,0,1,0,1|0,0,0]=2 3555 B17R2.4859 CC(=O)CCOc1ccc2cc(oc2c1)C 7a_100000095638_100000053229 [0,0,0,1,0,1|1,0,1]=4 3556 B17R2.4859 CC(=O)CCOc1ccc2nc(oc2c1)C 7a_100000116946_100000053229 [0,0,0,1,0,1|1,0,1]=4 3557 B17R2.4859 CC(=O)CCOc1ccc2nc(sc2c1)C 7a_100000008955_100000053229 [0,0,0,1,0,1|1,1,0]=4 3558 B17R2.4859 CC(=O)CCOc1ccc2oc(nc2c1)C 7a_100000102623_100000053229 [0,0,0,1,0,1|1,0,0]=3 3559 B17R2.4859 CC(=O)CCOc1ccc2oc(nc2c1)Cl 7a_100010673232_100000053229 [0,0,0,1,0,1|2,0,0]=4 3560 B17R2.4859 CC(=O)CCOc1ccc2sc(nc2c1)C 7a_100000031546_100000053229 [0,0,0,1,0,1|1,1,0]=4 3561 B17R2.4859 CC(=O)CCSc1cc2c(cn1)NC(=O)C2 62a_100000053229_100000104063 [0,0,0,1,0,1|2,0,0]=4 3562 B17R2.4859 CC(=O)CCSc1ccc2[nH]c(=O)[nH]c2c1 62a_100000053229_200011356815 [0,0,0,1,0,1|2,0,0]=4 3563 B17R2.4859 CC(=O)CCSc1ccc2[nH]c(=O)oc2c1 62a_100000053229_100000697996 [0,0,0,1,0,1|2,0,0]=4 3564 B17R2.4859 CC(=O)CCSc1ccc2[nH]c(cc2c1)C 62a_100000053229_100011214893 [0,0,0,1,0,1|2,0,0]=4 3565 B17R2.4859 CC(=O)CCSc1ccc2[nH]c(nc2c1)C 62a_100000053229_100011264012 [0,0,0,1,0,1|2,0,0]=4 3566 B17R2.4859 CC(=O)CCSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000053229 [0,0,0,1,0,1|1,0,0]=3 3567 B17R2.4859 CC(=O)CCSc1ccc2c(c1)CC(=O)N2 62a_100000053229_100000754858 [0,0,0,1,0,1|1,0,0]=3 3568 B17R2.4859 CC(=O)CCSc1ccc2c(c1)NC(=O)C2 62a_100000053229_100000760487 [0,0,0,1,0,1|2,0,0]=4 3569 B17R2.4859 CC(=O)CCSc1ccc2c(n1)CC(=O)N2 62a_100000053229_100000087150 [0,0,0,1,0,1|2,0,0]=4 3570 B17R2.4859 CC(=O)CCSc1ccc2cc([nH]c2c1)C 62a_100000053229_100010196937 [0,0,0,1,0,1|2,0,0]=4 3571 B17R2.4859 CC(=O)CCSc1ccc2nc(oc2c1)C 62a_100000053229_100010171164 [0,0,0,1,0,1|1,0,1]=4 3572 B17R2.4859 CC(=O)CCSc1ccc2nc(sc2c1)C 62a_100000053229_100009813144 [0,0,0,1,0,1|1,1,0]=4 3573 B17R2.4859 CC(=O)CCSc1ccc2nc(sc2c1)C 62a_100009813144_100000053229 [0,0,0,1,0,1|1,1,0]=4 3574 B17R2.4859 CC(=O)CCSc1ccc2oc(nc2c1)C 62a_100000053229_100009816932 [0,0,0,1,0,1|1,0,0]=3 3575 B17R2.4859 CC(=O)CCSc1ccc2sc(cc2c1)C 62a_100000053229_100000695401 [0,0,0,1,0,1|1,1,0]=4 3576 B17R2.4859 CC(=O)CCSc1ccc2sc(cc2c1)C 62a_100000695401_100000053229 [0,0,0,1,0,1|1,1,0]=4 3577 B17R2.4859 CC(=O)CCSc1ccc2sc(nc2c1)C 62a_100000053229_100009813953 [0,0,0,1,0,1|1,1,0]=4 3578 B17R2.4859 CC(=O)CCSc1ccc2sc(nc2c1)C 62a_100009813953_100000053229 [0,0,0,1,0,1|1,1,0]=4 3579 B17R2.4859 CC(=O)CCSc1cnc2c(c1)CC(=O)N2 62a_100000053229_100010177629 [0,0,0,1,0,1|2,0,0]=4 3580 B17R2.4859 CC(=O)CCSc1cnc2oc(nc2c1)C 62a_100000053229_100010178690 [0,0,0,1,0,1|2,0,0]=4 3581 B17R2.4859 CC(=O)OCNc1ccc2oc(nc2c1)C 34a_100000195416_100009813279 [0,0,0,1,0,1|2,0,0]=4 3582 B17R2.4859 CC(=O)OCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100009813279 [0,0,0,1,0,1|1,0,0]=3 3583 B17R2.4859 CC(=O)OCOc1ccc2oc(nc2c1)C 34a_100000102623_100009813279 [0,0,0,1,0,1|2,0,0]=4 3584 B17R2.4859 CC(=O)OCSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000076356 [0,0,0,1,0,1|2,0,0]=4 3585 B17R2.4859 CC(=O)OCSc1ccc2c(c1)CC(=O)N2 62a_100000076356_100000754858 [0,0,0,1,0,1|2,0,0]=4 3586 B17R2.4859 CC(=O)OCSc1ccc2oc(nc2c1)C 62a_100000076356_100009816932 [0,0,0,1,0,1|2,0,0]=4 3587 B17R2.4859 CC(C)CCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000210312 [0,0,0,1,0,1|1,0,1]=4 3588 B17R2.4859 CC(C)CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000210626 [0,0,0,1,0,1|1,0,1]=4 3589 B17R2.4859 CC(C)CNCc1ccc2c(c1)CC(=O)O2 26a_100000210953_100000035078 [0,0,0,1,0,1|1,0,1]=4 3590 B17R2.4859 CC(O)CCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100012276601 [0,0,0,1,0,1|0,0,2]=4 3591 B17R2.4859 CC(O)CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100012276601 [0,0,0,1,0,1|0,0,2]=4 3592 B17R2.4859 CN(C)CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000755713 [0,0,0,1,0,1|2,0,0]=4 3593 B17R2.4859 Cc1nc2cc(ccc2o1)COCC(=O)N 34a_200009878806_100000187820 [0,0,0,1,0,1|2,0,0]=4 3594 B17R2.4859 Cc1nc2cc(ccc2o1)COCC(=O)N 7a_200009878806_100000187820 [0,0,0,1,0,1|2,0,0]=4 3595 B17R2.4859 Cc1nc2cc(ccc2o1)COCC(=O)[O-] 34a_200009878806_100020667443 [0,0,0,1,0,1|2,0,0]=4 3596 B17R2.4859 Cc1nc2cc(ccc2o1)NCCC(=O)N 34a_100000195416_100000731001 [0,0,0,1,0,1|2,0,0]=4 3597 B17R2.4859 Cc1nc2cc(ccc2o1)OCCC(=O)N 34a_100000102623_100000731001 [0,0,0,1,0,1|2,0,0]=4 3598 B17R2.4859 Cc1nc2cc(ccc2o1)OCCC(=O)N 7a_100000102623_100000744528 [0,0,0,1,0,1|2,0,0]=4 3599 B17R2.4859 Cc1nc2cc(ccc2o1)SCCC(=O)N 62a_100000744528_100009816932 [0,0,0,1,0,1|2,0,0]=4 3600 B17R2.4859 NC(=O)CCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000731001 [0,0,0,1,0,1|1,0,0]=3 3601 B17R2.4859 NC(=O)CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000744528 [0,0,0,1,0,1|1,0,0]=3 3602 B17R2.4859 NC(=O)CCSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000744528 [0,0,0,1,0,1|2,0,0]=4 3603 B17R2.4859 NC(=O)CCSc1ccc2c(c1)CC(=O)N2 62a_100000744528_100000754858 [0,0,0,1,0,1|2,0,0]=4 3604 B17R2.5095 CC(=O)Oc1ccc(cc1)CN[C@@H]2C[C@@H]2F 2230a_100015190264_100000033664 [0,0,0,1,0,1|1,0,1]=4 3605 B17R2.5095 CC(=O)Oc1ccc(cc1)CN[C@@H]2C[C@H]2F 2230a_100025746932_100000033664 [0,0,0,1,0,1|1,0,1]=4 3606 B17R2.5205 CC(=O)Cc1ccc(cc1)SC2CC(=O)C2 62a_100009894365_100000691760 [0,0,0,1,0,1|1,0,0]=3 3607 B17R2.5205 CC(=O)Nc1ccc(cc1)SC2CC(=O)C2 62a_100009894365_100000155215 [0,0,0,1,0,1|1,0,0]=3 3608 B17R2.5205 CC(=O)Nc1ccc(cn1)SC2CC(=O)C2 62a_100009894365_100000193312 [0,0,0,1,0,1|2,0,0]=4 3609 B17R2.5205 CC(=O)Nc1ccc(nc1)SC2CC(=O)C2 62a_100009894365_100011934715 [0,0,0,1,0,1|2,0,0]=4 3610 B17R2.5205 CC(=O)Oc1ccc(cc1)CN2CC(C2)C 2230a_100000702820_100000033664 [0,0,0,1,0,1|1,0,1]=4 3611 B17R2.5205 CC(=O)Oc1ccc(cc1)CN2CC(C2)C 269982a_100000702820_100000033664 [0,0,0,1,0,1|1,0,1]=4 3612 B17R2.5205 CC(=O)Oc1ccc(cc1)CN2CC(C2)C 270004a_100000702820_100000014718 [0,0,0,1,0,1|1,0,1]=4 3613 B17R2.5205 CC(=O)Oc1ccc(cc1)CN2CC(C2)F 2230a_100000690557_100000033664 [0,0,0,1,0,1|1,0,1]=4 3614 B17R2.5205 CC(=O)Oc1ccc(cc1)CN2CC(C2)F 269982a_100000690557_100000033664 [0,0,0,1,0,1|1,0,1]=4 3615 B17R2.5205 CC(=O)Oc1ccc(cc1)CN2CC(C2)F 270004a_100000690557_100000014718 [0,0,0,1,0,1|1,0,1]=4 3616 B17R2.5205 CC(=O)Oc1ccc(cc1)CN2CC(C2)O 269982a_100000749847_100000033664 [0,0,0,1,0,1|0,0,2]=4 3617 B17R2.5205 CC(=O)Oc1ccc(cc1)SC2CC(=O)C2 62a_100009894365_100000002173 [0,0,0,1,0,1|0,0,0]=2 3618 B17R2.5205 CC(=S)Oc1ccc(cc1)SC2CC(=O)C2 62a_100009894365_200009816735 [0,0,0,1,0,1|0,1,0]=3 3619 B17R2.5205 CC(C)Oc1ccc(cc1)SC2CC(=O)C2 62a_100009894365_100000169947 [0,0,0,1,0,1|1,0,1]=4 3620 B17R2.5205 NC(=O)Cc1ccc(cc1)SC2CC(=O)C2 62a_100009894365_100000162331 [0,0,0,1,0,1|2,0,0]=4 3621 B17R2.5205 NC(=O)Nc1ccc(cc1)SC2CC(=O)C2 62a_100009894365_100000198584 [0,0,0,1,0,1|2,0,0]=4 3622 B17R2.23810 CC(=O)Nc1ccc2c(c1)NC(=O)CCC2 11a_100000081071_100015343762 [0,0,0,1,0,1|2,0,0]=4 3623 B17R2.23810 CC(=O)Nc1ccc2c(c1)NC(=O)CCC2 1626a_100000081071_100015343762 [0,0,0,1,0,1|2,0,0]=4 3624 B17R2.23810 CC(=O)Nc1ccc2c(c1)NC(=O)CCC2 22a_100000081071_100000070787 [0,0,0,1,0,1|2,0,0]=4 3625 B17R2.23810 CC(=O)Nc1ccc2c(c1)NC(=O)CCC2 527a_100000081071_100103153847 [0,0,0,1,0,1|2,0,0]=4 3626 B17R2.60458 CC(=O)Oc1ccc(cc1)CNCC2CC2 207a_100000735609_100000014718 [0,0,0,1,0,1|1,0,1]=4 3627 B17R2.60458 CC(=O)Oc1ccc(cc1)CNCC2CC2 2230a_100000735609_100000033664 [0,0,0,1,0,1|1,0,1]=4 3628 B17R2.60458 CC(=O)Oc1ccc(cc1)CNCC2CC2 270004a_100000735609_100000014718 [0,0,0,1,0,1|1,0,1]=4 3629 B17R2.60458 CC(=O)Oc1ccc(cc1)CSCC2CC2 62a_100000756562_100000033664 [0,0,0,1,0,1|1,0,1]=4 3630 B17R2.60458 CC(=O)Oc1ccc(cc1)CSCC2CO2 62a_102125554688_100000033664 [0,0,0,1,0,1|0,0,2]=4 3631 B17R2.60458 CC(=O)Oc1ccc(cc1)CSCC2CS2 62a_100000031435_100000033664 [0,0,0,1,0,1|0,1,1]=4 3632 B17R2.60458 CC(=O)Oc1ccc(cc1)CSC[C@@H]2CO2 62a_100000745022_100000033664 [0,0,0,1,0,1|0,0,2]=4 3633 B17R2.60458 CC(=O)Oc1ccc(cc1)SCCC2CC2 62a_100000764125_100000002173 [0,0,0,1,0,1|1,0,1]=4 3634 B17R2.60458 CC(=O)Oc1ccc(cc1)SCCC2CO2 62a_100000732470_100000002173 [0,0,0,1,0,1|0,0,2]=4 3635 B17R2.60494 CC(=O)CCSc1ccc(cc1)OC2CC2 62a_100000053229_100000704264 [0,0,0,1,0,1|1,0,1]=4 3636 B17R2.60494 CC(=O)CCSc1ccc(cc1)OC2CC2 62a_100000704264_100000053229 [0,0,0,1,0,1|1,0,1]=4 3637 B17R2.60494 CC(=O)NCCc1ccc(cc1)OC2CC2 34a_100011395907_100000211595 [0,0,0,1,0,1|1,0,1]=4 3638 B17R2.294627 CC(=O)Nc1ccc2c(c1)N(CC2)C(=O)C 11a_100011218573_100015343762 [0,0,0,1,0,1|1,0,0]=3 3639 B17R2.294627 CC(=O)Nc1ccc2c(c1)N(CC2)C(=O)C 1626a_100011218573_100015343762 [0,0,0,1,0,1|1,0,0]=3 3640 B17R2.294627 CC(=O)Nc1ccc2c(c1)N(CC2)C(=O)C 22a_100011218573_100000070787 [0,0,0,1,0,1|1,0,0]=3 3641 B17R2.294627 CC(=O)Nc1ccc2c(c1)N(CC2)C(=O)C 527a_100011218573_100103153847 [0,0,0,1,0,1|1,0,0]=3 3642 B17R2.5201 CC(=C(C)c1ccc(cc1)C2CC(=O)C2)C 271570a_200000049429_100000741321 [0,1,0,1,0,0|2,0,0]=4 3643 B17R2.19728 CC(=C(C)c1ccc2c(c1)CC(=O)CC2)C 271570a_200000049429_100010138410 [0,1,0,1,0,0|2,0,0]=4 3644 B17R2.3964 CC(=O)Cc1ccc(cc1)OC2CCC2=O 34a_100011218180_100009892977 [0,1,0,1,0,0|2,0,0]=4 3645 B17R2.3964 CC(=O)Cc1ccc(cc1)OC2CCC2=O 7a_100011218180_100009892977 [0,1,0,1,0,0|2,0,0]=4 3646 B17R2.3964 CC(=O)Cc1ccc(cc1)SC2CCC2=O 62a_100000691760_100009892977 [0,1,0,1,0,0|2,0,0]=4 3647 B17R2.3964 CC(=O)Cc1ccc(cc1)SC2CCC2=O 62a_100009892977_100000691760 [0,1,0,1,0,0|2,0,0]=4 3648 B17R2.3964 CC(=O)Nc1ccc(cc1)NC2CCC2=O 34a_100000184111_100009892977 [0,1,0,1,0,0|2,0,0]=4 3649 B17R2.3964 CC(=O)Nc1ccc(cc1)OC2CCC2=O 34a_100000184395_100009892977 [0,1,0,1,0,0|2,0,0]=4 3650 B17R2.3964 CC(=O)Nc1ccc(cc1)OC2CCC2=O 7a_100000184395_100009892977 [0,1,0,1,0,0|2,0,0]=4 3651 B17R2.3964 CC(=O)Nc1ccc(cc1)SC2CCC2=O 62a_100009892977_100000155215 [0,1,0,1,0,0|2,0,0]=4 3652 B17R2.3964 CC(=O)Oc1ccc(cc1)SC2CCC2=O 62a_100009892977_100000002173 [0,1,0,1,0,0|1,0,0]=3 3653 B17R2.3964 CC(=O)Sc1ccc(cc1)SC2CCC2=O 62a_200009995050_100009892977 [0,1,0,1,0,0|1,1,0]=4 3654 B17R2.3964 CC(=S)Oc1ccc(cc1)SC2CCC2=O 62a_100009892977_200009816735 [0,1,0,1,0,0|1,1,0]=4 3655 B17R2.19727 CC(=O)Nc1ccc2c(c1)N(C(=O)CO2)C 11a_100000765360_100015343762 [0,1,0,1,0,0|2,0,0]=4 3656 B17R2.19727 CC(=O)Nc1ccc2c(c1)N(C(=O)CO2)C 1626a_100000765360_100015343762 [0,1,0,1,0,0|2,0,0]=4 3657 B17R2.19727 CC(=O)Nc1ccc2c(c1)N(C(=O)CO2)C 22a_100000765360_100000070787 [0,1,0,1,0,0|2,0,0]=4 3658 B17R2.19727 CC(=O)Nc1ccc2c(c1)N(C(=O)CO2)C 527a_100000765360_100103153847 [0,1,0,1,0,0|2,0,0]=4 3659 B17R2.57907 COC(=O)CCc1ccc(cc1)OC2CC2 34a_100000032826_100000211595 [0,1,0,1,0,0|1,0,1]=4 3660 B17R2.60983 CCC(=O)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000747405 [0,1,0,1,0,0|1,0,0]=3 3661 B17R2.60983 CCC(=O)COc1ccc2oc(nc2c1)C 7a_100000102623_100000747405 [0,1,0,1,0,0|2,0,0]=4 3662 B17R2.60983 CCC(=O)CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000747405 [0,1,0,1,0,0|2,0,0]=4 3663 B17R2.60983 CCC(=O)CSc1ccc2c(c1)CC(=O)N2 62a_100000747405_100000754858 [0,1,0,1,0,0|2,0,0]=4 3664 B17R2.60983 CCC(=O)CSc1ccc2oc(nc2c1)C 62a_100000747405_100009816932 [0,1,0,1,0,0|2,0,0]=4 3665 B17R2.60983 CNC(=O)CNc1ccc2oc(nc2c1)C 34a_100000195416_100000183359 [0,1,0,1,0,0|2,0,0]=4 3666 B17R2.60983 CNC(=O)COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000183359 [0,1,0,1,0,0|1,0,0]=3 3667 B17R2.60983 CNC(=O)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000183359 [0,1,0,1,0,0|1,0,0]=3 3668 B17R2.60983 CNC(=O)COc1ccc2oc(nc2c1)C 34a_100000102623_100000183359 [0,1,0,1,0,0|2,0,0]=4 3669 B17R2.60983 CNC(=O)COc1ccc2oc(nc2c1)C 7a_100000102623_100000183359 [0,1,0,1,0,0|2,0,0]=4 3670 B17R2.60983 CNC(=O)CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000183359 [0,1,0,1,0,0|2,0,0]=4 3671 B17R2.60983 CNC(=O)CSc1ccc2c(c1)CC(=O)N2 62a_100000183359_100000754858 [0,1,0,1,0,0|2,0,0]=4 3672 B17R2.60983 CNC(=O)CSc1ccc2oc(nc2c1)C 62a_100000183359_100009816932 [0,1,0,1,0,0|2,0,0]=4 3673 B17R2.60983 COC(=O)CNc1ccc2oc(nc2c1)C 34a_100000195416_100000747449 [0,1,0,1,0,0|2,0,0]=4 3674 B17R2.60983 COC(=O)COc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000747449 [0,1,0,1,0,0|1,0,0]=3 3675 B17R2.60983 COC(=O)COc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000747449 [0,1,0,1,0,0|1,0,0]=3 3676 B17R2.60983 COC(=O)COc1ccc2oc(nc2c1)C 34a_100000102623_100000747449 [0,1,0,1,0,0|2,0,0]=4 3677 B17R2.60983 COC(=O)COc1ccc2oc(nc2c1)C 7a_100000102623_100000747449 [0,1,0,1,0,0|2,0,0]=4 3678 B17R2.60983 COC(=O)CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000747449 [0,1,0,1,0,0|2,0,0]=4 3679 B17R2.60983 COC(=O)CSc1ccc2c(c1)CC(=O)N2 62a_100000747449_100000754858 [0,1,0,1,0,0|2,0,0]=4 3680 B17R2.60983 COC(=O)CSc1ccc2oc(nc2c1)C 62a_100000747449_100009816932 [0,1,0,1,0,0|2,0,0]=4 3681 B17R2.4858 CC(=O)C(C)Oc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000179758 [0,1,0,1,0,0|1,0,0]=3 3682 B17R2.4858 CC(=O)C(C)Oc1ccc2oc(nc2c1)C 7a_100000102623_100000179758 [0,1,0,1,0,0|2,0,0]=4 3683 B17R2.4858 CC(=O)C(C)Sc1ccc2c(c1)CC(=O)C2 62a_100010185598_100009814033 [0,1,0,1,0,0|2,0,0]=4 3684 B17R2.4858 CC(=O)C(C)Sc1ccc2c(c1)CC(=O)N2 62a_100009814033_100000754858 [0,1,0,1,0,0|2,0,0]=4 3685 B17R2.4858 CC(=O)C(C)Sc1ccc2oc(nc2c1)C 62a_100009814033_100009816932 [0,1,0,1,0,0|2,0,0]=4 3686 B17R2.4858 CC(Oc1ccc2c(c1)CC(=O)O2)C(=O)N 34a_100000035078_100000702099 [0,1,0,1,0,0|2,0,0]=4 3687 B17R2.4858 CC(Oc1ccc2c(c1)CC(=O)O2)C(=O)N 7a_100000035078_100000702099 [0,1,0,1,0,0|2,0,0]=4 3688 B17R2.4858 NC(=O)C(F)Oc1ccc2c(c1)CC(=O)O2 34a_100000035078_100009813875 [0,1,0,1,0,0|2,0,0]=4 3689 B17R2.4858 NC(=O)C(F)Oc1ccc2c(c1)CC(=O)O2 7a_100000035078_100009813875 [0,1,0,1,0,0|2,0,0]=4 3690 B17R2.4858 O=C1Cc2cc(ccc2O1)OC(F)C(=O)[O-] 34a_100000035078_100020610796 [0,1,0,1,0,0|2,0,0]=4 3691 B17R2.9611 C#CC(C)Oc1ccc2c(c1)CC(=O)CC2 34a_200000081095_200000035995 [0,1,0,1,0,0|1,0,1]=4 3692 B17R2.9611 CC(C#N)Oc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100000703298 [0,1,0,1,0,0|1,0,1]=4 3693 B17R2.9611 CC(CO)Oc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100012180447 [0,1,0,1,0,0|0,0,2]=4 3694 B17R2.9611 CC(CO)Oc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100012180447 [0,1,0,1,0,0|0,0,2]=4 3695 B17R2.9611 CCC(=O)Nc1ccc2c(c1)NC(=O)CC2 11a_100000055022_100000210414 [0,1,0,1,0,0|2,0,0]=4 3696 B17R2.9611 CCC(=O)Nc1ccc2c(c1)NC(=O)CC2 1626a_100000055022_100000210414 [0,1,0,1,0,0|2,0,0]=4 3697 B17R2.9611 CCC(=O)Nc1ccc2c(c1)NC(=O)CC2 22a_100000055022_100000210414 [0,1,0,1,0,0|2,0,0]=4 3698 B17R2.9611 CCC(=O)Nc1ccc2c(c1)NC(=O)CC2 527a_100000055022_100000210414 [0,1,0,1,0,0|2,0,0]=4 3699 B17R2.9611 CCC(C)Oc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100011215416 [0,1,0,1,0,0|1,0,1]=4 3700 B17R2.9611 CCC(C)Oc1ccc2c(c1)CC(=O)CC2 7a_200000081095_100000758301 [0,1,0,1,0,0|1,0,1]=4 3701 B17R2.9611 CNC(=O)Nc1ccc2c(c1)NC(=O)CC2 2430a_100000055022_100102657272 [0,1,0,1,0,0|2,0,0]=4 3702 B17R2.9611 O=C(CO)Nc1ccc2c(c1)NC(=O)CC2 22a_100000055022_100000210174 [0,1,0,1,0,0|2,0,0]=4 3703 B17R2.9611 O=C(CO)Nc1ccc2c(c1)NC(=O)CC2 527a_100000055022_100000210174 [0,1,0,1,0,0|2,0,0]=4 3704 B17R2.19759 C=C(C)CSc1ccc2c(c1)CCC(=O)O2 62a_100000748629_100010179853 [0,1,0,1,0,0|2,0,0]=4 3705 B17R2.19759 C=C(C)CSc1ccc2c(c1)CCC(=O)O2 62a_100010179853_100000211660 [0,1,0,1,0,0|2,0,0]=4 3706 B17R2.19759 CC(=O)COc1ccc2c(c1)CCC(=O)N2 1458a_100000735738_200000210301 [0,1,0,1,0,0|2,0,0]=4 3707 B17R2.19759 NC(=O)CSc1ccc2c(c1)CCC(=O)O2 62a_100000747473_100010179853 [0,1,0,1,0,0|2,0,0]=4 3708 B17R2.19759 NC(=O)CSc1ccc2c(c1)CCC(=O)O2 62a_100010179853_100000747473 [0,1,0,1,0,0|2,0,0]=4 3709 B17R2.19759 O=C([O-])CSc1ccc2c(c1)CCC(=O)O2 62a_100010179853_100020667443 [0,1,0,1,0,0|2,0,0]=4 3710 B17R2.19759 O=C([O-])CSc1ccc2c(c1)CCC(=O)O2 62a_100020667443_100010179853 [0,1,0,1,0,0|2,0,0]=4 3711 B17R2.19759 [13CH3]C(=O)COc1ccc2c(c1)CCC(=O)N2 1458a_100000735738_200025704644 [0,1,0,1,0,0|2,0,0]=4 3712 B17R2.290661 CC(=O)CCc1ccc(cc1)OC2CCC2 34a_100000198047_100000749161 [0,1,0,1,0,0|1,0,1]=4 3713 B17R2.290661 CC(=O)CCc1ccc(cc1)OC2COC2 34a_100000198047_100009818527 [0,1,0,1,0,0|0,0,2]=4 3714 B17R2.290661 CC(=O)CCc1ccc(cc1)OC2COC2 7a_100000198047_100009818527 [0,1,0,1,0,0|0,0,2]=4 3715 B17R2.159229 CC(=O)CCc1ccc2c(c1)OC(O2)(C)C 1458a_100020778203_200000210301 [0,1,0,1,0,0|0,0,2]=4 3716 B17R2.159229 CC1(Oc2ccc(cc2O1)CCC(=O)[13CH3])C 1458a_100020778203_200025704644 [0,1,0,1,0,0|0,0,2]=4 3717 B17R2.19718 CC(C)(C)Oc1ccc2c(c1)CC(=O)CC2 34a_200000081095_100000210625 [0,1,0,1,0,0|1,0,1]=4 3718 B17R2.900658 CC(=O)CCc1cc2c(cc1Cl)NC(=O)C2 1458a_100000070787_100010007137 [0,1,0,1,0,0|1,0,0]=3 3719 B17R3.18499 O=C1CCc2ccc(cc2C1)OC3CC3 34a_200000081095_100000211595 [0,0,0,2,0,0|1,0,1]=4 3720 B13R1.74 C=C(C)c1ccc(cc1)CCC=O 271570a_100000694244_100011361538 [1,0,0,0,1,0|1,0,0]=3 3721 B13R1.74 C=C(C)c1ccc(cc1)CCCC 271570a_100000694244_100011215597 [1,0,0,0,1,0|1,0,1]=4 3722 B13R1.74 C=C(C)c1ccc(cc1)CCCC 271570a_100020621405_100000185454 [1,0,0,0,1,0|1,0,1]=4 3723 B13R1.74 C=C(C)c1ccc(cc1)CCNC 271570a_100000694244_100000752880 [1,0,0,0,1,0|2,0,0]=4 3724 B13R1.74 C=C(C)c1ccc(cc1)CCOC 271570a_100000694244_100000739703 [1,0,0,0,1,0|2,0,0]=4 3725 B13R1.74 C=C(C)c1ccc(cc1)OCC=O 34a_100009880102_200009817547 [1,0,0,0,1,0|2,0,0]=4 3726 B13R1.74 C=C(C)c1ccc(cc1)OCC=O 7a_100009880102_200015260668 [1,0,0,0,1,0|2,0,0]=4 3727 B13R1.74 C=C(C)c1ccc(cc1)SCC=O 62a_100000185454_200015260668 [1,0,0,0,1,0|2,0,0]=4 3728 B13R1.74 C=C(C)c1ccc(cc1)SCC=O 62a_200015260668_100000185454 [1,0,0,0,1,0|2,0,0]=4 3729 B13R1.74 C=CCOc1ccc(cc1)C(=O)C 1458a_100000216320_200000210301 [1,0,0,0,1,0|1,0,1]=4 3730 B13R1.74 C=CCOc1ccc(cc1)C(=O)C 34a_100000185113_100015514636 [1,0,0,0,1,0|1,0,1]=4 3731 B13R1.74 C=CCOc1ccc(cc1)C(=O)C 7a_100000185113_100015514636 [1,0,0,0,1,0|1,0,1]=4 3732 B13R1.74 C=CCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000216320_200025704644 [1,0,0,0,1,0|1,0,1]=4 3733 B13R1.74 C=CCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210623 [1,0,0,0,1,0|1,0,1]=4 3734 B13R1.74 C=CCSc1ccc(cc1)C(=O)C 62a_100000210623_100000185465 [1,0,0,0,1,0|1,0,1]=4 3735 B13R1.74 CC(=O)c1ccc(cc1)CCS[13CH3] 62a_200000038727_200025704644 [1,0,0,0,1,0|1,0,0]=3 3736 B13R1.74 CC(=O)c1ccc(cc1)CCS[13CH3] 62a_200025704644_200000038727 [1,0,0,0,1,0|1,0,0]=3 3737 B13R1.74 CC(=O)c1ccc(cc1)OCC=O 34a_100000185113_200009817547 [1,0,0,0,1,0|1,0,0]=3 3738 B13R1.74 CC(=O)c1ccc(cc1)OCC=O 7a_100000185113_200015260668 [1,0,0,0,1,0|1,0,0]=3 3739 B13R1.74 CC(=O)c1ccc(cc1)SCC=O 62a_100000185465_200015260668 [1,0,0,0,1,0|1,0,0]=3 3740 B13R1.74 CC(=O)c1ccc(cc1)SCC=O 62a_200015260668_100000185465 [1,0,0,0,1,0|1,0,0]=3 3741 B13R1.74 CC(=O)c1ccc(cn1)OCC=O 34a_100012001710_200009817547 [1,0,0,0,1,0|2,0,0]=4 3742 B13R1.74 CC(=O)c1ccc(cn1)OCC=O 7a_100012001710_200015260668 [1,0,0,0,1,0|2,0,0]=4 3743 B13R1.74 CC(=O)c1ccc(cn1)SCC=O 62a_100000686046_200015260668 [1,0,0,0,1,0|2,0,0]=4 3744 B13R1.74 CC(=O)c1ccc(cn1)SCC=O 62a_200015260668_100000686046 [1,0,0,0,1,0|2,0,0]=4 3745 B13R1.74 CC(=O)c1ccc(nc1)SCC=O 62a_100000684857_200015260668 [1,0,0,0,1,0|2,0,0]=4 3746 B13R1.74 CC(=O)c1ccc(nc1)SCC=O 62a_200015260668_100000684857 [1,0,0,0,1,0|2,0,0]=4 3747 B13R1.74 CCCCc1ccc(cc1)C(=O)C 1458a_100000186158_200000210301 [1,0,0,0,1,0|0,0,1]=3 3748 B13R1.74 CCCCc1ccc(cc1)C(=O)C 271570a_100020621405_100000185465 [1,0,0,0,1,0|0,0,1]=3 3749 B13R1.74 CCCCc1ccc(cc1)C(=O)N 271570a_100020621405_100000162191 [1,0,0,0,1,0|1,0,1]=4 3750 B13R1.74 CCCCc1ccc(cc1)C(=O)[13CH3] 1458a_100000186158_200025704644 [1,0,0,0,1,0|0,0,1]=3 3751 B13R1.74 CCCCc1ccc(cc1)S(=O)C 271570a_100020621405_100009816266 [1,0,0,0,1,0|1,0,1]=4 3752 B13R1.74 CCCCc1ccc(cn1)C(=O)C 271570a_100020621405_100000684857 [1,0,0,0,1,0|1,0,1]=4 3753 B13R1.74 CCCCc1ccc(nc1)C(=O)C 271570a_100020621405_100000686046 [1,0,0,0,1,0|1,0,1]=4 3754 B13R1.74 CCCOc1ccc(cc1)C(=O)C 1458a_100000182924_200000210301 [1,0,0,0,1,0|1,0,1]=4 3755 B13R1.74 CCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210303 [1,0,0,0,1,0|1,0,1]=4 3756 B13R1.74 CCCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210303 [1,0,0,0,1,0|1,0,1]=4 3757 B13R1.74 CCCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000182924_200025704644 [1,0,0,0,1,0|1,0,1]=4 3758 B13R1.74 CCCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210303 [1,0,0,0,1,0|1,0,1]=4 3759 B13R1.74 CCCSc1ccc(cc1)C(=O)C 62a_100000210303_100000185465 [1,0,0,0,1,0|1,0,1]=4 3760 B13R1.74 CCNCc1ccc(cc1)C(=O)C 2230a_100015525214_100000756337 [1,0,0,0,1,0|1,0,1]=4 3761 B13R1.74 CCOCc1ccc(cc1)C(=O)C 34a_100121572206_100000756337 [1,0,0,0,1,0|1,0,1]=4 3762 B13R1.74 CCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000210202 [1,0,0,0,1,0|1,0,1]=4 3763 B13R1.74 CCSCc1ccc(cc1)C(=O)C 1458a_100000193729_200000210301 [1,0,0,0,1,0|1,0,1]=4 3764 B13R1.74 CCSCc1ccc(cc1)C(=O)C 62a_100000210202_100000756337 [1,0,0,0,1,0|1,0,1]=4 3765 B13R1.74 CCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000210202 [1,0,0,0,1,0|1,0,1]=4 3766 B13R1.74 CCSCc1ccc(cc1)C(=O)[13CH3] 1458a_100000193729_200025704644 [1,0,0,0,1,0|1,0,1]=4 3767 B13R1.74 CNCCc1ccc(cc1)C(=O)C 2230a_106832991635_200000038727 [1,0,0,0,1,0|1,0,0]=3 3768 B13R1.74 CNCCc1ccc(cc1)C(=O)C 34a_100102657272_200000038727 [1,0,0,0,1,0|1,0,0]=3 3769 B13R1.74 CNCCc1ccc(cc1)C(=O)C 7a_106832991635_200000038727 [1,0,0,0,1,0|1,0,0]=3 3770 B13R1.74 CNCCc1ccc(cc1)C(=O)O 269956a_100000704756_200000210301 [1,0,0,0,1,0|2,0,0]=4 3771 B13R1.74 COCCc1ccc(cc1)C(=O)C 34a_100138415774_200000038727 [1,0,0,0,1,0|1,0,0]=3 3772 B13R1.74 COCOc1ccc(cc1)C(=O)C 1458a_100000230389_200000210301 [1,0,0,0,1,0|2,0,0]=4 3773 B13R1.74 COCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000230389_200025704644 [1,0,0,0,1,0|2,0,0]=4 3774 B13R1.74 COCSc1ccc(cc1)C(=O)C 62a_100000185465_100000766300 [1,0,0,0,1,0|2,0,0]=4 3775 B13R1.74 COCSc1ccc(cc1)C(=O)C 62a_100000766300_100000185465 [1,0,0,0,1,0|2,0,0]=4 3776 B13R1.74 CS(=O)c1ccc(cc1)OCC=O 34a_200000064373_200009817547 [1,0,0,0,1,0|2,0,0]=4 3777 B13R1.74 CS(=O)c1ccc(cc1)OCC=O 7a_200000064373_200015260668 [1,0,0,0,1,0|2,0,0]=4 3778 B13R1.74 CS(=O)c1ccc(cc1)SCC=O 62a_100009816266_200015260668 [1,0,0,0,1,0|2,0,0]=4 3779 B13R1.74 CSCCc1ccc(cc1)C(=O)C 62a_200000038727_200000210301 [1,0,0,0,1,0|1,0,0]=3 3780 B13R1.74 CSCCc1ccc(cc1)C(=O)C 62a_200000210301_200000038727 [1,0,0,0,1,0|1,0,0]=3 3781 B13R1.74 CSCOc1ccc(cc1)C(=O)C 34a_100000185113_100011218213 [1,0,0,0,1,0|2,0,0]=4 3782 B13R1.74 CSCSc1ccc(cc1)C(=O)C 62a_100000185465_100011218213 [1,0,0,0,1,0|2,0,0]=4 3783 B13R1.74 CSCSc1ccc(cc1)C(=O)C 62a_100011218213_100000185465 [1,0,0,0,1,0|2,0,0]=4 3784 B13R1.74 NC(=O)c1ccc(cc1)NCC=O 34a_100000210537_200009817547 [1,0,0,0,1,0|2,0,0]=4 3785 B13R1.74 NC(=O)c1ccc(cc1)OCC=O 34a_100000746352_200009817547 [1,0,0,0,1,0|2,0,0]=4 3786 B13R1.74 NC(=O)c1ccc(cc1)OCC=O 7a_100000746352_200015260668 [1,0,0,0,1,0|2,0,0]=4 3787 B13R1.74 NC(=O)c1ccc(cc1)SCC=O 62a_100000162191_200015260668 [1,0,0,0,1,0|2,0,0]=4 3788 B13R1.74 NC(=O)c1ccc(cc1)SCC=O 62a_200015260668_100000162191 [1,0,0,0,1,0|2,0,0]=4 3789 B13R1.74 [13CH3]NCCc1ccc(cc1)C(=O)O 269956a_100000704756_200025704644 [1,0,0,0,1,0|2,0,0]=4 3790 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)C 271570a_100000694244_100000691760 [0,0,0,0,2,0|1,0,0]=3 3791 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)N 271570a_100000694244_100000162331 [0,0,0,0,2,0|2,0,0]=4 3792 B13R1.585 C=C(C)c1ccc(cc1)NC(=O)C 271570a_100000694244_100000155215 [0,0,0,0,2,0|2,0,0]=4 3793 B13R1.585 C=C(C)c1ccc(cc1)OC(=O)C 271570a_100000694244_100000002173 [0,0,0,0,2,0|2,0,0]=4 3794 B13R1.585 C=C(C)c1ccc(cc1)SC(=O)C 271570a_100000694244_200009995050 [0,0,0,0,2,0|2,0,0]=4 3795 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000070787_100000756337 [0,0,0,0,2,0|0,0,0]=2 3796 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000070787_100000231043 [0,0,0,0,2,0|1,0,0]=3 3797 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000070787_100000181262 [0,0,0,0,2,0|1,0,1]=4 3798 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000689720_200000210301 [0,0,0,0,2,0|1,0,1]=4 3799 B13R1.585 CC(=O)Cc1ccc(cc1)N(C)C 1458a_100011218386_200000210301 [0,0,0,0,2,0|2,0,0]=4 3800 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000181861 [0,0,0,0,2,0|2,0,0]=4 3801 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_200000210301 [0,0,0,0,2,0|2,0,0]=4 3802 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)C 1458a_100000185149_200000210301 [0,0,0,0,2,0|1,0,0]=3 3803 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 11a_100000210537_100015343762 [0,0,0,0,2,0|2,0,0]=4 3804 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 1626a_100000210537_100015343762 [0,0,0,0,2,0|2,0,0]=4 3805 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 22a_100000210537_100000070787 [0,0,0,0,2,0|2,0,0]=4 3806 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 527a_100000210537_100103153847 [0,0,0,0,2,0|2,0,0]=4 3807 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)[13CH3] 1458a_100000185149_200025704644 [0,0,0,0,2,0|1,0,0]=3 3808 B13R1.585 CC(=O)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000185465 [0,0,0,0,2,0|1,0,1]=4 3809 B13R1.585 CC(=O)c1ccc(cc1)CC(C)C 1458a_100000185289_200000210301 [0,0,0,0,2,0|1,0,1]=4 3810 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 1458a_100000749272_200000210301 [0,0,0,0,2,0|2,0,0]=4 3811 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 2230a_100102631434_100000756337 [0,0,0,0,2,0|2,0,0]=4 3812 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 269982a_100102631434_100000756337 [0,0,0,0,2,0|2,0,0]=4 3813 B13R1.585 CC(C)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000185289_200025704644 [0,0,0,0,2,0|1,0,1]=4 3814 B13R1.585 CC(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100000689720_200025704644 [0,0,0,0,2,0|1,0,1]=4 3815 B13R1.585 CN(C)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000749272_200025704644 [0,0,0,0,2,0|2,0,0]=4 3816 B13R1.585 CN(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100011218386_200025704644 [0,0,0,0,2,0|2,0,0]=4 3817 B13R1.585 [13CH3]C(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_200025704644 [0,0,0,0,2,0|2,0,0]=4 3818 B15R1.17 C/C=C/c1ccc(cc1)SCCC(=O)C 62a_100000053229_100016259036 [1,0,0,0,0,1|1,0,0]=3 3819 B15R1.17 C/C=C/c1ccc(cc1)SCCC(=O)C 62a_100016259036_100000053229 [1,0,0,0,0,1|1,0,0]=3 3820 B15R1.17 C/C=C/c1ccc(cc1)SCCC(=O)N 62a_100000744528_100016259036 [1,0,0,0,0,1|2,0,0]=4 3821 B15R1.17 C/C=C/c1ccc(cc1)SCCC(=O)N 62a_100016259036_100000744528 [1,0,0,0,0,1|2,0,0]=4 3822 B15R1.17 C/C=C/c1ccc(cc1)SCOC(=O)C 62a_100000076356_100016259036 [1,0,0,0,0,1|2,0,0]=4 3823 B15R1.17 C/C=C/c1ccc(cc1)SCOC(=O)C 62a_100016259036_100000076356 [1,0,0,0,0,1|2,0,0]=4 3824 B15R1.17 C=C(C)CCNc1ccc(cc1)OCC 2230a_100000739623_100000730704 [1,0,0,0,0,1|1,0,1]=4 3825 B15R1.17 C=C(C)CCNc1ccc(cc1)OCC 34a_100000739623_100000730704 [1,0,0,0,0,1|1,0,1]=4 3826 B15R1.17 C=C(C)CCOc1ccc(cc1)OCC 34a_100000185467_100000730704 [1,0,0,0,0,1|1,0,1]=4 3827 B15R1.17 C=C(C)CCSc1ccc(cc1)/C=C/C 62a_100000730704_100016259036 [1,0,0,0,0,1|2,0,0]=4 3828 B15R1.17 C=C(C)CCSc1ccc(cc1)/C=C/C 62a_100016259036_100000730704 [1,0,0,0,0,1|2,0,0]=4 3829 B15R1.17 C=C(C)CCSc1ccc(cc1)CC=O 62a_100000730704_100011361690 [1,0,0,0,0,1|2,0,0]=4 3830 B15R1.17 C=C(C)CCSc1ccc(cc1)CC=O 62a_100011361690_100000730704 [1,0,0,0,0,1|2,0,0]=4 3831 B15R1.17 C=C(C)CCSc1ccc(cc1)OCC 62a_100000730704_100000171712 [1,0,0,0,0,1|1,0,1]=4 3832 B15R1.17 C=C(C)CNCc1ccc(cc1)OCC 2230a_100000185588_100000748629 [1,0,0,0,0,1|1,0,1]=4 3833 B15R1.17 C=C(C)CNCc1ccc(cc1)OCC 34a_100000185588_100000748629 [1,0,0,0,0,1|1,0,1]=4 3834 B15R1.17 C=C(C)COCc1ccc(cc1)OCC 34a_100000173027_100000748629 [1,0,0,0,0,1|1,0,1]=4 3835 B15R1.17 C=C(C)COCc1ccc(cc1)OCC 7a_100000173027_100000748629 [1,0,0,0,0,1|1,0,1]=4 3836 B15R1.17 C=CCc1ccc(cc1)OCCC(=O)C 7a_100000078792_100000053229 [1,0,0,0,0,1|1,0,1]=4 3837 B15R1.17 C=COc1ccc(cc1)SCCC(=C)C 62a_100000704263_100000730704 [1,0,0,0,0,1|1,0,1]=4 3838 B15R1.17 C=COc1ccc(cc1)SCCC(=C)C 62a_100000730704_100000704263 [1,0,0,0,0,1|1,0,1]=4 3839 B15R1.17 C=COc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000704263 [1,0,0,0,0,1|0,0,1]=3 3840 B15R1.17 C=COc1ccc(cc1)SCCC(=O)C 62a_100000704263_100000053229 [1,0,0,0,0,1|0,0,1]=3 3841 B15R1.17 C=COc1ccc(cc1)SCCC(=O)N 62a_100000704263_100000744528 [1,0,0,0,0,1|1,0,1]=4 3842 B15R1.17 C=COc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000704263 [1,0,0,0,0,1|1,0,1]=4 3843 B15R1.17 C=COc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000704263 [1,0,0,0,0,1|1,0,1]=4 3844 B15R1.17 C=COc1ccc(cc1)SCOC(=O)C 62a_100000704263_100000076356 [1,0,0,0,0,1|1,0,1]=4 3845 B15R1.17 CC(=O)CCSc1ccc(cc1)/C=C/Br 62a_100000053229_200016255901 [1,0,0,0,0,1|2,0,0]=4 3846 B15R1.17 CC(=O)CCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000053229 [1,0,0,0,0,1|2,0,0]=4 3847 B15R1.17 CC(=O)CCSc1ccc(cc1)CC=O 62a_100000053229_100011361690 [1,0,0,0,0,1|1,0,0]=3 3848 B15R1.17 CC(=O)CCSc1ccc(cc1)CC=O 62a_100011361690_100000053229 [1,0,0,0,0,1|1,0,0]=3 3849 B15R1.17 CC(=O)NCCc1ccc(cc1)OCF 34a_100011395907_100015361967 [1,0,0,0,0,1|1,0,1]=4 3850 B15R1.17 CC(=O)NCCc1ccc(cc1)OCF 7a_100011395907_100015361967 [1,0,0,0,0,1|1,0,1]=4 3851 B15R1.17 CC(=O)OCSc1ccc(cc1)CC=O 62a_100000076356_100011361690 [1,0,0,0,0,1|2,0,0]=4 3852 B15R1.17 CC(=O)OCSc1ccc(cc1)CC=O 62a_100011361690_100000076356 [1,0,0,0,0,1|2,0,0]=4 3853 B15R1.17 CC=Cc1ccc(cc1)CCOC(=O)C 271570a_100016259895_200016374084 [1,0,0,0,0,1|1,0,0]=3 3854 B15R1.17 CCCc1ccc(cc1)COCC(=O)C 34a_100000211253_100011982809 [1,0,0,0,0,1|1,0,1]=4 3855 B15R1.17 CCCc1ccc(cc1)OCCC(=O)C 7a_100000749406_100000053229 [1,0,0,0,0,1|1,0,1]=4 3856 B15R1.17 CCCc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000750032 [1,0,0,0,0,1|1,0,1]=4 3857 B15R1.17 CCCc1ccc(cc1)SCCC(=O)C 62a_100000750032_100000053229 [1,0,0,0,0,1|1,0,1]=4 3858 B15R1.17 CCNc1ccc(cc1)OCCC(=O)C 7a_100011337800_100000053229 [1,0,0,0,0,1|1,0,1]=4 3859 B15R1.17 CCNc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000219632 [1,0,0,0,0,1|1,0,1]=4 3860 B15R1.17 CCOc1ccc(cc1)CCNC(=O)C 11a_100011194255_100015343762 [1,0,0,0,0,1|0,0,1]=3 3861 B15R1.17 CCOc1ccc(cc1)CCNC(=O)C 1626a_100011194255_100015343762 [1,0,0,0,0,1|0,0,1]=3 3862 B15R1.17 CCOc1ccc(cc1)CCNC(=O)C 240690a_100011194255_100015343762 [1,0,0,0,0,1|0,0,1]=3 3863 B15R1.17 CCOc1ccc(cc1)CCNC(=O)C 34a_100011395907_100000210202 [1,0,0,0,0,1|0,0,1]=3 3864 B15R1.17 CCOc1ccc(cc1)CCNC(=O)C 527a_100011194255_100103153847 [1,0,0,0,0,1|0,0,1]=3 3865 B15R1.17 CCOc1ccc(cc1)CCNC(=O)C 7a_100011395907_100000210202 [1,0,0,0,0,1|0,0,1]=3 3866 B15R1.17 CCOc1ccc(cc1)CNCC(=O)N 2230a_100000185588_100000747473 [1,0,0,0,0,1|1,0,1]=4 3867 B15R1.17 CCOc1ccc(cc1)CNCC(=O)N 34a_100000185588_100000187820 [1,0,0,0,0,1|1,0,1]=4 3868 B15R1.17 CCOc1ccc(cc1)CNCC(=O)[O-] 34a_100000185588_100020667443 [1,0,0,0,0,1|1,0,1]=4 3869 B15R1.17 CCOc1ccc(cc1)COCC(=O)N 34a_100000173027_100000187820 [1,0,0,0,0,1|1,0,1]=4 3870 B15R1.17 CCOc1ccc(cc1)COCC(=O)N 7a_100000173027_100000187820 [1,0,0,0,0,1|1,0,1]=4 3871 B15R1.17 CCOc1ccc(cc1)COCC(=O)[O-] 34a_100000173027_100020667443 [1,0,0,0,0,1|1,0,1]=4 3872 B15R1.17 CCOc1ccc(cc1)NCCC(=O)N 2230a_100000739623_100000744528 [1,0,0,0,0,1|1,0,1]=4 3873 B15R1.17 CCOc1ccc(cc1)NCCC(=O)N 34a_100000739623_100000731001 [1,0,0,0,0,1|1,0,1]=4 3874 B15R1.17 CCOc1ccc(cc1)NCOC(=O)C 34a_100000739623_100009813279 [1,0,0,0,0,1|1,0,1]=4 3875 B15R1.17 CCOc1ccc(cc1)OCCC(=O)C 1458a_100000070787_100000183166 [1,0,0,0,0,1|0,0,1]=3 3876 B15R1.17 CCOc1ccc(cc1)OCCC(=O)N 34a_100000185467_100000731001 [1,0,0,0,0,1|1,0,1]=4 3877 B15R1.17 CCOc1ccc(cc1)OCOC(=O)C 34a_100000185467_100009813279 [1,0,0,0,0,1|1,0,1]=4 3878 B15R1.17 CCOc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000171712 [1,0,0,0,0,1|0,0,1]=3 3879 B15R1.17 CCOc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000171712 [1,0,0,0,0,1|1,0,1]=4 3880 B15R1.17 CCOc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000171712 [1,0,0,0,0,1|1,0,1]=4 3881 B15R1.17 CCOc1ccc(cn1)SCCC(=O)C 62a_100000053229_100011219444 [1,0,0,0,0,1|1,0,1]=4 3882 B15R1.17 CCOc1ccc(cn1)SCCC(=O)C 62a_100011219444_100000053229 [1,0,0,0,0,1|1,0,1]=4 3883 B15R1.17 CCOc1ccc(nc1)SCCC(=O)C 62a_100000053229_100000753957 [1,0,0,0,0,1|1,0,1]=4 3884 B15R1.17 CCOc1ccc(nc1)SCCC(=O)C 62a_100012355646_100000053229 [1,0,0,0,0,1|1,0,1]=4 3885 B15R1.17 CCSc1ccc(cc1)CCOC(=O)C 62a_100000210202_200016374084 [1,0,0,0,0,1|0,1,1]=4 3886 B15R1.17 CCSc1ccc(cc1)CCOC(=O)C 62a_200016374084_100000210202 [1,0,0,0,0,1|0,1,1]=4 3887 B15R1.17 CCSc1ccc(cc1)SCCC(=O)C 62a_100000053229_200009811893 [1,0,0,0,0,1|0,1,1]=4 3888 B15R1.17 CCSc1ccc(cc1)SCCC(=O)C 62a_200009811893_100000053229 [1,0,0,0,0,1|0,1,1]=4 3889 B15R1.17 CNCc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000180866 [1,0,0,0,0,1|2,0,0]=4 3890 B15R1.17 CNCc1ccc(cc1)SCCC(=O)C 62a_100000180866_100000053229 [1,0,0,0,0,1|2,0,0]=4 3891 B15R1.17 COCc1ccc(cc1)OCCC(=O)C 7a_200011995677_100000053229 [1,0,0,0,0,1|2,0,0]=4 3892 B15R1.17 COCc1ccc(cc1)SCCC(=O)C 62a_100000053229_100011493685 [1,0,0,0,0,1|2,0,0]=4 3893 B15R1.17 COCc1ccc(cc1)SCCC(=O)C 62a_100011493685_100000053229 [1,0,0,0,0,1|2,0,0]=4 3894 B15R1.17 CSCc1ccc(cc1)NCCC(=O)C 7a_106726388226_100000053229 [1,0,0,0,0,1|2,0,0]=4 3895 B15R1.17 NC(=O)CCSc1ccc(cc1)CC=O 62a_100000744528_100011361690 [1,0,0,0,0,1|2,0,0]=4 3896 B15R1.17 NC(=O)CCSc1ccc(cc1)CC=O 62a_100011361690_100000744528 [1,0,0,0,0,1|2,0,0]=4 3897 B15R1.1080 C=C(C)CCNc1ccc(cc1)C(=O)N 34a_100000210537_100000730704 [0,0,0,0,1,1|2,0,0]=4 3898 B15R1.1080 C=C(C)CCOc1ccc(cc1)C(=C)C 34a_100009880102_100000730704 [0,0,0,0,1,1|2,0,0]=4 3899 B15R1.1080 C=C(C)CCOc1ccc(cc1)C(=C)C 7a_100009880102_100000730704 [0,0,0,0,1,1|2,0,0]=4 3900 B15R1.1080 C=C(C)CCOc1ccc(cc1)C(=O)C 34a_100000185113_100000730704 [0,0,0,0,1,1|1,0,0]=3 3901 B15R1.1080 C=C(C)CCOc1ccc(cc1)C(=O)C 7a_100000185113_100000730704 [0,0,0,0,1,1|1,0,0]=3 3902 B15R1.1080 C=C(C)CCOc1ccc(cc1)C(=O)N 34a_100000746352_100000730704 [0,0,0,0,1,1|2,0,0]=4 3903 B15R1.1080 C=C(C)CCOc1ccc(cc1)C(=O)N 7a_100000746352_100000730704 [0,0,0,0,1,1|2,0,0]=4 3904 B15R1.1080 C=C(C)CCOc1ccc(cc1)S(=O)C 34a_200000064373_100000730704 [0,0,0,0,1,1|2,0,0]=4 3905 B15R1.1080 C=C(C)CCOc1ccc(cc1)S(=O)C 7a_200000064373_100000730704 [0,0,0,0,1,1|2,0,0]=4 3906 B15R1.1080 C=C(C)CCOc1ccc(nc1)C(=O)C 34a_100012001710_100000730704 [0,0,0,0,1,1|2,0,0]=4 3907 B15R1.1080 C=C(C)CCOc1ccc(nc1)C(=O)C 7a_100012001710_100000730704 [0,0,0,0,1,1|2,0,0]=4 3908 B15R1.1080 C=C(C)CCSc1ccc(cc1)C(=C)C 62a_100000185454_100000730704 [0,0,0,0,1,1|2,0,0]=4 3909 B15R1.1080 C=C(C)CCSc1ccc(cc1)C(=C)C 62a_100000730704_100000185454 [0,0,0,0,1,1|2,0,0]=4 3910 B15R1.1080 C=C(C)CCSc1ccc(cc1)C(=O)C 62a_100000185465_100000730704 [0,0,0,0,1,1|1,0,0]=3 3911 B15R1.1080 C=C(C)CCSc1ccc(cc1)C(=O)C 62a_100000730704_100000185465 [0,0,0,0,1,1|1,0,0]=3 3912 B15R1.1080 C=C(C)CCSc1ccc(cc1)C(=O)N 62a_100000162191_100000730704 [0,0,0,0,1,1|2,0,0]=4 3913 B15R1.1080 C=C(C)CCSc1ccc(cc1)C(=O)N 62a_100000730704_100000162191 [0,0,0,0,1,1|2,0,0]=4 3914 B15R1.1080 C=C(C)CCSc1ccc(cc1)S(=O)C 62a_100009816266_100000730704 [0,0,0,0,1,1|2,0,0]=4 3915 B15R1.1080 C=C(C)CCSc1ccc(cn1)C(=O)C 62a_100000684857_100000730704 [0,0,0,0,1,1|2,0,0]=4 3916 B15R1.1080 C=C(C)CCSc1ccc(cn1)C(=O)C 62a_100000730704_100000684857 [0,0,0,0,1,1|2,0,0]=4 3917 B15R1.1080 C=C(C)CCSc1ccc(nc1)C(=O)C 62a_100000686046_100000730704 [0,0,0,0,1,1|2,0,0]=4 3918 B15R1.1080 C=C(C)CCSc1ccc(nc1)C(=O)C 62a_100000730704_100000686046 [0,0,0,0,1,1|2,0,0]=4 3919 B15R1.1080 C=C(C)CNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000748629 [0,0,0,0,1,1|2,0,0]=4 3920 B15R1.1080 C=C(C)COCc1ccc(cc1)C(=O)C 34a_100000210245_100000756337 [0,0,0,0,1,1|1,0,0]=3 3921 B15R1.1080 C=C(C)COCc1ccc(cc1)C(=O)C 7a_100000082505_100000748629 [0,0,0,0,1,1|1,0,0]=3 3922 B15R1.1080 C=C(C)COCc1ccc(cc1)C(=O)N 34a_100000162016_100000748629 [0,0,0,0,1,1|2,0,0]=4 3923 B15R1.1080 C=C(C)COCc1ccc(cc1)C(=O)N 34a_100000210245_100000231043 [0,0,0,0,1,1|2,0,0]=4 3924 B15R1.1080 C=C(C)COCc1ccc(cc1)C(=O)N 7a_100000162016_100000748629 [0,0,0,0,1,1|2,0,0]=4 3925 B15R1.1080 C=C(C)CSCc1ccc(cc1)C(=O)C 62a_100000748629_100000756337 [0,0,0,0,1,1|1,0,0]=3 3926 B15R1.1080 C=C(C)CSCc1ccc(cc1)C(=O)C 62a_100000756337_100000211660 [0,0,0,0,1,1|1,0,0]=3 3927 B15R1.1080 C=C(C)CSCc1ccc(cc1)C(=O)N 62a_100000231043_100000211660 [0,0,0,0,1,1|2,0,0]=4 3928 B15R1.1080 C=C(C)CSCc1ccc(cc1)C(=O)N 62a_100000748629_100000231043 [0,0,0,0,1,1|2,0,0]=4 3929 B15R1.1080 C=C(C)c1ccc(cc1)CCOC(=O)C 271570a_100000694244_200016374084 [0,0,0,0,1,1|1,0,0]=3 3930 B15R1.1080 C=C(C)c1ccc(cc1)OCCC(=O)C 7a_100009880102_100000053229 [0,0,0,0,1,1|1,0,0]=3 3931 B15R1.1080 C=C(C)c1ccc(cc1)OCCC(=O)N 34a_100009880102_100000731001 [0,0,0,0,1,1|2,0,0]=4 3932 B15R1.1080 C=C(C)c1ccc(cc1)OCCC(=O)N 7a_100009880102_100000744528 [0,0,0,0,1,1|2,0,0]=4 3933 B15R1.1080 C=C(C)c1ccc(cc1)OCOC(=O)C 34a_100009880102_100009813279 [0,0,0,0,1,1|2,0,0]=4 3934 B15R1.1080 C=C(C)c1ccc(cc1)SCCC(=O)C 62a_100000053229_100000185454 [0,0,0,0,1,1|1,0,0]=3 3935 B15R1.1080 C=C(C)c1ccc(cc1)SCCC(=O)C 62a_100000185454_100000053229 [0,0,0,0,1,1|1,0,0]=3 3936 B15R1.1080 C=C(C)c1ccc(cc1)SCCC(=O)N 62a_100000185454_100000744528 [0,0,0,0,1,1|2,0,0]=4 3937 B15R1.1080 C=C(C)c1ccc(cc1)SCCC(=O)N 62a_100000744528_100000185454 [0,0,0,0,1,1|2,0,0]=4 3938 B15R1.1080 C=C(C)c1ccc(cc1)SCOC(=O)C 62a_100000076356_100000185454 [0,0,0,0,1,1|2,0,0]=4 3939 B15R1.1080 C=C(C)c1ccc(cc1)SCOC(=O)C 62a_100000185454_100000076356 [0,0,0,0,1,1|2,0,0]=4 3940 B15R1.1080 C=C(F)COCc1ccc(cc1)C(=O)C 34a_200010262243_100000756337 [0,0,0,0,1,1|1,0,1]=4 3941 B15R1.1080 C=C(F)COCc1ccc(cc1)C(=O)C 7a_100000082505_100000042424 [0,0,0,0,1,1|1,0,1]=4 3942 B15R1.1080 C=C(F)CSCc1ccc(cc1)C(=O)C 62a_100000042424_100000756337 [0,0,0,0,1,1|1,0,1]=4 3943 B15R1.1080 C=C(F)CSCc1ccc(cc1)C(=O)C 62a_100000756337_100000042424 [0,0,0,0,1,1|1,0,1]=4 3944 B15R1.1080 CC(=O)CCCc1ccc(cc1)C(C)C 1458a_100011399506_200000210301 [0,0,0,0,1,1|1,0,1]=4 3945 B15R1.1080 CC(=O)CCCc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100010167727 [0,0,0,0,1,1|2,0,0]=4 3946 B15R1.1080 CC(=O)CCCc1ccc(cc1)[N+](=O)[O-] 1458a_100011214885_200000210301 [0,0,0,0,1,1|2,0,0]=4 3947 B15R1.1080 CC(=O)CCNc1ccc(cc1)C(C)C 7a_100000210773_100000053229 [0,0,0,0,1,1|1,0,1]=4 3948 B15R1.1080 CC(=O)CCOc1ccc(cc1)C(=O)C 7a_100000185113_100000053229 [0,0,0,0,1,1|0,0,0]=2 3949 B15R1.1080 CC(=O)CCOc1ccc(cc1)C(=O)N 7a_100000746352_100000053229 [0,0,0,0,1,1|1,0,0]=3 3950 B15R1.1080 CC(=O)CCOc1ccc(cc1)C(C)C 7a_100000181308_100000053229 [0,0,0,0,1,1|1,0,1]=4 3951 B15R1.1080 CC(=O)CCOc1ccc(cc1)C(C)O 7a_100000754508_100000053229 [0,0,0,0,1,1|0,0,2]=4 3952 B15R1.1080 CC(=O)CCOc1ccc(cc1)S(=O)C 7a_200000064373_100000053229 [0,0,0,0,1,1|1,0,0]=3 3953 B15R1.1080 CC(=O)CCOc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000742347 [0,0,0,0,1,1|2,0,0]=4 3954 B15R1.1080 CC(=O)CCOc1ccc(cc1)[N+](=O)[O-] 1458a_100000738207_200000210301 [0,0,0,0,1,1|2,0,0]=4 3955 B15R1.1080 CC(=O)CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000053229 [0,0,0,0,1,1|2,0,0]=4 3956 B15R1.1080 CC(=O)CCOc1ccc(cc1)[S+](C)C 7a_100010188728_100000053229 [0,0,0,0,1,1|2,0,0]=4 3957 B15R1.1080 CC(=O)CCOc1ccc(nc1)C(=O)C 7a_100012001710_100000053229 [0,0,0,0,1,1|1,0,0]=3 3958 B15R1.1080 CC(=O)CCSc1ccc(cc1)C(=O)C 62a_100000053229_100000185465 [0,0,0,0,1,1|0,0,0]=2 3959 B15R1.1080 CC(=O)CCSc1ccc(cc1)C(=O)C 62a_100000185465_100000053229 [0,0,0,0,1,1|0,0,0]=2 3960 B15R1.1080 CC(=O)CCSc1ccc(cc1)C(=O)N 62a_100000053229_100000162191 [0,0,0,0,1,1|1,0,0]=3 3961 B15R1.1080 CC(=O)CCSc1ccc(cc1)C(=O)N 62a_100000162191_100000053229 [0,0,0,0,1,1|1,0,0]=3 3962 B15R1.1080 CC(=O)CCSc1ccc(cc1)C(C)C 62a_100000053229_100000750031 [0,0,0,0,1,1|1,0,1]=4 3963 B15R1.1080 CC(=O)CCSc1ccc(cc1)C(C)C 62a_100000750031_100000053229 [0,0,0,0,1,1|1,0,1]=4 3964 B15R1.1080 CC(=O)CCSc1ccc(cc1)C(C)O 62a_100000053229_100000745893 [0,0,0,0,1,1|0,0,2]=4 3965 B15R1.1080 CC(=O)CCSc1ccc(cc1)C(C)O 62a_100000745893_100000053229 [0,0,0,0,1,1|0,0,2]=4 3966 B15R1.1080 CC(=O)CCSc1ccc(cc1)N(C)C 62a_100000053229_100000210421 [0,0,0,0,1,1|2,0,0]=4 3967 B15R1.1080 CC(=O)CCSc1ccc(cc1)N(C)C 62a_100000210421_100000053229 [0,0,0,0,1,1|2,0,0]=4 3968 B15R1.1080 CC(=O)CCSc1ccc(cc1)S(=O)C 62a_100009816266_100000053229 [0,0,0,0,1,1|1,0,0]=3 3969 B15R1.1080 CC(=O)CCSc1ccc(cc1)[C@@H](C)N 62a_100000053229_100000720352 [0,0,0,0,1,1|1,0,1]=4 3970 B15R1.1080 CC(=O)CCSc1ccc(cc1)[C@@H](C)N 62a_100000720352_100000053229 [0,0,0,0,1,1|1,0,1]=4 3971 B15R1.1080 CC(=O)CCSc1ccc(cc1)[C@H](C)N 62a_100000053229_100000753911 [0,0,0,0,1,1|1,0,1]=4 3972 B15R1.1080 CC(=O)CCSc1ccc(cc1)[C@H](C)N 62a_100000753911_100000053229 [0,0,0,0,1,1|1,0,1]=4 3973 B15R1.1080 CC(=O)CCSc1ccc(cn1)C(=O)C 62a_100000053229_100000684857 [0,0,0,0,1,1|1,0,0]=3 3974 B15R1.1080 CC(=O)CCSc1ccc(cn1)C(=O)C 62a_100000684857_100000053229 [0,0,0,0,1,1|1,0,0]=3 3975 B15R1.1080 CC(=O)CCSc1ccc(cn1)C(=O)N 62a_100000053229_100000162237 [0,0,0,0,1,1|2,0,0]=4 3976 B15R1.1080 CC(=O)CCSc1ccc(cn1)C(=O)N 62a_100000162237_100000053229 [0,0,0,0,1,1|2,0,0]=4 3977 B15R1.1080 CC(=O)CCSc1ccc(nc1)C(=O)C 62a_100000053229_100000686046 [0,0,0,0,1,1|1,0,0]=3 3978 B15R1.1080 CC(=O)CCSc1ccc(nc1)C(=O)C 62a_100000686046_100000053229 [0,0,0,0,1,1|1,0,0]=3 3979 B15R1.1080 CC(=O)CCSc1ccc(nc1)C(=O)N 62a_100000053229_100011219284 [0,0,0,0,1,1|2,0,0]=4 3980 B15R1.1080 CC(=O)CCSc1ccc(nc1)C(=O)N 62a_100011219284_100000053229 [0,0,0,0,1,1|2,0,0]=4 3981 B15R1.1080 CC(=O)CCSc1cnc(cn1)C(=O)C 62a_100000053229_100009883172 [0,0,0,0,1,1|2,0,0]=4 3982 B15R1.1080 CC(=O)CCSc1cnc(cn1)C(=O)C 62a_100009883172_100000053229 [0,0,0,0,1,1|2,0,0]=4 3983 B15R1.1080 CC(=O)CCSc1cnc(nc1)C(=O)C 62a_100000053229_100010077182 [0,0,0,0,1,1|2,0,0]=4 3984 B15R1.1080 CC(=O)CCSc1cnc(nc1)C(=O)C 62a_100010077182_100000053229 [0,0,0,0,1,1|2,0,0]=4 3985 B15R1.1080 CC(=O)CCSc1ncc(cn1)C(=O)C 62a_100000053229_100000099681 [0,0,0,0,1,1|2,0,0]=4 3986 B15R1.1080 CC(=O)CCSc1ncc(cn1)C(=O)C 62a_100000099681_100000053229 [0,0,0,0,1,1|2,0,0]=4 3987 B15R1.1080 CC(=O)COCc1ccc(cc1)C(=O)C 34a_100000211253_100000756337 [0,0,0,0,1,1|0,0,0]=2 3988 B15R1.1080 CC(=O)COCc1ccc(cc1)C(=O)N 34a_100000211253_100000231043 [0,0,0,0,1,1|1,0,0]=3 3989 B15R1.1080 CC(=O)COCc1ccc(cc1)C(C)C 34a_100000211253_100000181262 [0,0,0,0,1,1|1,0,1]=4 3990 B15R1.1080 CC(=O)COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211253_100000181861 [0,0,0,0,1,1|2,0,0]=4 3991 B15R1.1080 CC(=O)CSCc1ccc(cc1)[N+](=O)[O-] 1458a_100000150263_200000210301 [0,0,0,0,1,1|2,0,0]=4 3992 B15R1.1080 CC(=O)NCCc1ccc(cc1)C(C)C 11a_100000181363_100015343762 [0,0,0,0,1,1|1,0,1]=4 3993 B15R1.1080 CC(=O)NCCc1ccc(cc1)C(C)C 1626a_100000181363_100015343762 [0,0,0,0,1,1|1,0,1]=4 3994 B15R1.1080 CC(=O)NCCc1ccc(cc1)C(C)C 240690a_100000181363_100015343762 [0,0,0,0,1,1|1,0,1]=4 3995 B15R1.1080 CC(=O)NCCc1ccc(cc1)C(C)C 527a_100000181363_100103153847 [0,0,0,0,1,1|1,0,1]=4 3996 B15R1.1080 CC(=O)NCCc1ccc(cc1)N(C)C 11a_200103168616_100015343762 [0,0,0,0,1,1|2,0,0]=4 3997 B15R1.1080 CC(=O)NCCc1ccc(cc1)N(C)C 1626a_200103168616_100015343762 [0,0,0,0,1,1|2,0,0]=4 3998 B15R1.1080 CC(=O)NCCc1ccc(cc1)N(C)C 240690a_200103168616_100015343762 [0,0,0,0,1,1|2,0,0]=4 3999 B15R1.1080 CC(=O)NCCc1ccc(cc1)N(C)C 527a_200103168616_100103153847 [0,0,0,0,1,1|2,0,0]=4 4000 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] 11a_100000744123_100015343762 [0,0,0,0,1,1|2,0,0]=4 4001 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] 1626a_100000744123_100015343762 [0,0,0,0,1,1|2,0,0]=4 4002 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] 240690a_100000744123_100015343762 [0,0,0,0,1,1|2,0,0]=4 4003 B15R1.1080 CC(=O)NCCc1ccc(cc1)[N+](=O)[O-] 527a_100000744123_100103153847 [0,0,0,0,1,1|2,0,0]=4 4004 B15R1.1080 CC(=O)OCNc1ccc(cc1)C(=O)N 34a_100000210537_100009813279 [0,0,0,0,1,1|2,0,0]=4 4005 B15R1.1080 CC(=O)OCOc1ccc(cc1)C(=O)C 34a_100000185113_100009813279 [0,0,0,0,1,1|1,0,0]=3 4006 B15R1.1080 CC(=O)OCOc1ccc(cc1)C(=O)N 34a_100000746352_100009813279 [0,0,0,0,1,1|2,0,0]=4 4007 B15R1.1080 CC(=O)OCOc1ccc(cc1)S(=O)C 34a_200000064373_100009813279 [0,0,0,0,1,1|2,0,0]=4 4008 B15R1.1080 CC(=O)OCOc1ccc(nc1)C(=O)C 34a_100012001710_100009813279 [0,0,0,0,1,1|2,0,0]=4 4009 B15R1.1080 CC(=O)OCSc1ccc(cc1)C(=O)C 62a_100000076356_100000185465 [0,0,0,0,1,1|1,0,0]=3 4010 B15R1.1080 CC(=O)OCSc1ccc(cc1)C(=O)C 62a_100000185465_100000076356 [0,0,0,0,1,1|1,0,0]=3 4011 B15R1.1080 CC(=O)OCSc1ccc(cc1)C(=O)N 62a_100000076356_100000162191 [0,0,0,0,1,1|2,0,0]=4 4012 B15R1.1080 CC(=O)OCSc1ccc(cc1)C(=O)N 62a_100000162191_100000076356 [0,0,0,0,1,1|2,0,0]=4 4013 B15R1.1080 CC(=O)OCSc1ccc(cc1)S(=O)C 62a_100009816266_100000076356 [0,0,0,0,1,1|2,0,0]=4 4014 B15R1.1080 CC(=O)OCSc1ccc(cn1)C(=O)C 62a_100000076356_100000684857 [0,0,0,0,1,1|2,0,0]=4 4015 B15R1.1080 CC(=O)OCSc1ccc(cn1)C(=O)C 62a_100000684857_100000076356 [0,0,0,0,1,1|2,0,0]=4 4016 B15R1.1080 CC(=O)OCSc1ccc(nc1)C(=O)C 62a_100000076356_100000686046 [0,0,0,0,1,1|2,0,0]=4 4017 B15R1.1080 CC(=O)OCSc1ccc(nc1)C(=O)C 62a_100000686046_100000076356 [0,0,0,0,1,1|2,0,0]=4 4018 B15R1.1080 CC(=O)c1ccc(cc1)CCNC(C)C 2230a_100138425928_200000038727 [0,0,0,0,1,1|1,0,1]=4 4019 B15R1.1080 CC(=O)c1ccc(cc1)CCNC(C)C 34a_100138425928_200000038727 [0,0,0,0,1,1|1,0,1]=4 4020 B15R1.1080 CC(=O)c1ccc(cc1)CCOC(C)C 34a_100000212225_200000038727 [0,0,0,0,1,1|1,0,1]=4 4021 B15R1.1080 CC(=O)c1ccc(cc1)CCSC(C)C 62a_100000210206_200000038727 [0,0,0,0,1,1|1,0,1]=4 4022 B15R1.1080 CC(=O)c1ccc(cc1)CCSC(C)C 62a_200000038727_100000210206 [0,0,0,0,1,1|1,0,1]=4 4023 B15R1.1080 CC(=O)c1ccc(cc1)CNCC(=O)N 2230a_100000711301_100000756337 [0,0,0,0,1,1|1,0,0]=3 4024 B15R1.1080 CC(=O)c1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000756337 [0,0,0,0,1,1|1,0,0]=3 4025 B15R1.1080 CC(=O)c1ccc(cc1)CNCC(C)C 2230a_100000210953_100000756337 [0,0,0,0,1,1|1,0,1]=4 4026 B15R1.1080 CC(=O)c1ccc(cc1)CNCC(C)C 26a_100000210953_100000185113 [0,0,0,0,1,1|1,0,1]=4 4027 B15R1.1080 CC(=O)c1ccc(cc1)CNCC(C)C 34a_100000210953_100000756337 [0,0,0,0,1,1|1,0,1]=4 4028 B15R1.1080 CC(=O)c1ccc(cc1)CNCC(C)O 2230a_100000210904_100000756337 [0,0,0,0,1,1|0,0,2]=4 4029 B15R1.1080 CC(=O)c1ccc(cc1)CNCC(C)O 34a_100000210904_100000756337 [0,0,0,0,1,1|0,0,2]=4 4030 B15R1.1080 CC(=O)c1ccc(cc1)COCC(=O)N 7a_100000082505_100000187820 [0,0,0,0,1,1|1,0,0]=3 4031 B15R1.1080 CC(=O)c1ccc(cc1)COCC(C)Br 34a_100012180447_100000756337 [0,0,0,0,1,1|1,0,1]=4 4032 B15R1.1080 CC(=O)c1ccc(cc1)COCC(C)C 34a_100000210257_100000756337 [0,0,0,0,1,1|1,0,1]=4 4033 B15R1.1080 CC(=O)c1ccc(cc1)COCC(C)C 7a_100000082505_100000210760 [0,0,0,0,1,1|1,0,1]=4 4034 B15R1.1080 CC(=O)c1ccc(cc1)COCC(C)F 34a_100015925927_100000756337 [0,0,0,0,1,1|1,0,1]=4 4035 B15R1.1080 CC(=O)c1ccc(cc1)COCC(C)O 7a_100000082505_100011218427 [0,0,0,0,1,1|0,0,2]=4 4036 B15R1.1080 CC(=O)c1ccc(cc1)COC[C@@H](C)Cl 34a_100016084084_100000756337 [0,0,0,0,1,1|1,0,1]=4 4037 B15R1.1080 CC(=O)c1ccc(cc1)COC[C@@H](C)N 34a_100000737577_100000756337 [0,0,0,0,1,1|1,0,1]=4 4038 B15R1.1080 CC(=O)c1ccc(cc1)COC[C@@H](C)O 7a_100000082505_100009817552 [0,0,0,0,1,1|0,0,2]=4 4039 B15R1.1080 CC(=O)c1ccc(cc1)CSCC(=O)N 62a_100000747473_100000756337 [0,0,0,0,1,1|1,0,0]=3 4040 B15R1.1080 CC(=O)c1ccc(cc1)CSCC(=O)N 62a_100000756337_100000747473 [0,0,0,0,1,1|1,0,0]=3 4041 B15R1.1080 CC(=O)c1ccc(cc1)CSCC(=O)[O-] 62a_100000756337_100020667443 [0,0,0,0,1,1|1,0,0]=3 4042 B15R1.1080 CC(=O)c1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100000756337 [0,0,0,0,1,1|1,0,0]=3 4043 B15R1.1080 CC(=O)c1ccc(cc1)CSCC(C)C 62a_100000210624_100000756337 [0,0,0,0,1,1|1,0,1]=4 4044 B15R1.1080 CC(=O)c1ccc(cc1)CSCC(C)C 62a_100000756337_100000210760 [0,0,0,0,1,1|1,0,1]=4 4045 B15R1.1080 CC(=O)c1ccc(cc1)CSCC(C)O 62a_100000756337_100011218427 [0,0,0,0,1,1|0,0,2]=4 4046 B15R1.1080 CC(=O)c1ccc(cc1)CSCC(C)O 62a_100011218427_100000756337 [0,0,0,0,1,1|0,0,2]=4 4047 B15R1.1080 CC(=O)c1ccc(cc1)CSC[C@@H](C)O 62a_100000756337_100009817552 [0,0,0,0,1,1|0,0,2]=4 4048 B15R1.1080 CC(=O)c1ccc(cc1)CSC[C@@H](C)O 62a_100009817552_100000756337 [0,0,0,0,1,1|0,0,2]=4 4049 B15R1.1080 CC(=O)c1ccc(cc1)CSC[N+](=O)[O-] 62a_100000756337_100000761209 [0,0,0,0,1,1|2,0,0]=4 4050 B15R1.1080 CC(=O)c1ccc(cc1)OCC=C(C)C 34a_100000185113_100000761012 [0,0,0,0,1,1|1,0,1]=4 4051 B15R1.1080 CC(=O)c1ccc(cc1)OCC=C(C)C 7a_100000185113_100000761012 [0,0,0,0,1,1|1,0,1]=4 4052 B15R1.1080 CC(=O)c1ccc(cc1)OCCC(=O)N 34a_100000185113_100000731001 [0,0,0,0,1,1|1,0,0]=3 4053 B15R1.1080 CC(=O)c1ccc(cc1)OCCC(=O)N 7a_100000185113_100000744528 [0,0,0,0,1,1|1,0,0]=3 4054 B15R1.1080 CC(=O)c1ccc(cc1)OCCC(C)C 1458a_100000182916_200000210301 [0,0,0,0,1,1|1,0,1]=4 4055 B15R1.1080 CC(=O)c1ccc(cc1)OCCC(C)C 34a_100000185113_100000210312 [0,0,0,0,1,1|1,0,1]=4 4056 B15R1.1080 CC(=O)c1ccc(cc1)OCCC(C)C 7a_100000185113_100000210626 [0,0,0,0,1,1|1,0,1]=4 4057 B15R1.1080 CC(=O)c1ccc(cc1)OCCC(C)O 34a_100000185113_100012276601 [0,0,0,0,1,1|0,0,2]=4 4058 B15R1.1080 CC(=O)c1ccc(cc1)OCCC(C)O 7a_100000185113_100012276601 [0,0,0,0,1,1|0,0,2]=4 4059 B15R1.1080 CC(=O)c1ccc(cc1)OCCN(C)C 7a_100000185113_100000755713 [0,0,0,0,1,1|2,0,0]=4 4060 B15R1.1080 CC(=O)c1ccc(cc1)SCC=C(C)C 62a_100000185465_100000761012 [0,0,0,0,1,1|1,0,1]=4 4061 B15R1.1080 CC(=O)c1ccc(cc1)SCC=C(C)C 62a_100000761012_100000185465 [0,0,0,0,1,1|1,0,1]=4 4062 B15R1.1080 CC(=O)c1ccc(cc1)SCCC(=O)N 62a_100000185465_100000744528 [0,0,0,0,1,1|1,0,0]=3 4063 B15R1.1080 CC(=O)c1ccc(cc1)SCCC(=O)N 62a_100000744528_100000185465 [0,0,0,0,1,1|1,0,0]=3 4064 B15R1.1080 CC(=O)c1ccc(cc1)SCCC(C)C 62a_100000185465_100000210312 [0,0,0,0,1,1|1,0,1]=4 4065 B15R1.1080 CC(=O)c1ccc(cc1)SCCC(C)C 62a_100000210312_100000185465 [0,0,0,0,1,1|1,0,1]=4 4066 B15R1.1080 CC(=O)c1ccc(cc1)SCCC(C)O 62a_100000185465_100012276601 [0,0,0,0,1,1|0,0,2]=4 4067 B15R1.1080 CC(=O)c1ccc(cc1)SCCC(C)O 62a_100012276601_100000185465 [0,0,0,0,1,1|0,0,2]=4 4068 B15R1.1080 CC(=O)c1ccc(cc1)SCCN(C)C 62a_100000185465_100000755713 [0,0,0,0,1,1|2,0,0]=4 4069 B15R1.1080 CC(=O)c1ccc(cn1)OCCC(=O)N 34a_100012001710_100000731001 [0,0,0,0,1,1|2,0,0]=4 4070 B15R1.1080 CC(=O)c1ccc(cn1)OCCC(=O)N 7a_100012001710_100000744528 [0,0,0,0,1,1|2,0,0]=4 4071 B15R1.1080 CC(=O)c1ccc(cn1)SCCC(=O)N 62a_100000686046_100000744528 [0,0,0,0,1,1|2,0,0]=4 4072 B15R1.1080 CC(=O)c1ccc(cn1)SCCC(=O)N 62a_100000744528_100000686046 [0,0,0,0,1,1|2,0,0]=4 4073 B15R1.1080 CC(=O)c1ccc(nc1)NCCC(=O)N 27a_100000740010_100000690552 [0,0,0,0,1,1|2,0,0]=4 4074 B15R1.1080 CC(=O)c1ccc(nc1)SCCC(=O)N 62a_100000684857_100000744528 [0,0,0,0,1,1|2,0,0]=4 4075 B15R1.1080 CC(=O)c1ccc(nc1)SCCC(=O)N 62a_100000744528_100000684857 [0,0,0,0,1,1|2,0,0]=4 4076 B15R1.1080 CC(C)CCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000182916_200025704644 [0,0,0,0,1,1|1,0,1]=4 4077 B15R1.1080 CC(C)c1ccc(cc1)CCCC(=O)[13CH3] 1458a_100011399506_200025704644 [0,0,0,0,1,1|1,0,1]=4 4078 B15R1.1080 CS(=O)c1ccc(cc1)OCCC(=O)N 34a_200000064373_100000731001 [0,0,0,0,1,1|2,0,0]=4 4079 B15R1.1080 CS(=O)c1ccc(cc1)OCCC(=O)N 7a_200000064373_100000744528 [0,0,0,0,1,1|2,0,0]=4 4080 B15R1.1080 CS(=O)c1ccc(cc1)SCCC(=O)N 62a_100009816266_100000744528 [0,0,0,0,1,1|2,0,0]=4 4081 B15R1.1080 NC(=O)CCNc1ccc(cc1)C(=O)N 27a_100000740010_100000162191 [0,0,0,0,1,1|2,0,0]=4 4082 B15R1.1080 NC(=O)CCNc1ccc(cc1)C(=O)N 34a_100000210537_100000731001 [0,0,0,0,1,1|2,0,0]=4 4083 B15R1.1080 NC(=O)CCOc1ccc(cc1)C(=O)N 34a_100000746352_100000731001 [0,0,0,0,1,1|2,0,0]=4 4084 B15R1.1080 NC(=O)CCOc1ccc(cc1)C(=O)N 7a_100000746352_100000744528 [0,0,0,0,1,1|2,0,0]=4 4085 B15R1.1080 NC(=O)CCSc1ccc(cc1)C(=O)N 62a_100000162191_100000744528 [0,0,0,0,1,1|2,0,0]=4 4086 B15R1.1080 NC(=O)CCSc1ccc(cc1)C(=O)N 62a_100000744528_100000162191 [0,0,0,0,1,1|2,0,0]=4 4087 B15R1.1080 NC(=O)CNCc1ccc(cc1)C(=O)N 2230a_100000711301_100000231043 [0,0,0,0,1,1|2,0,0]=4 4088 B15R1.1080 NC(=O)CNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000187820 [0,0,0,0,1,1|2,0,0]=4 4089 B15R1.1080 NC(=O)COCc1ccc(cc1)C(=O)N 34a_100000162016_100000187820 [0,0,0,0,1,1|2,0,0]=4 4090 B15R1.1080 NC(=O)COCc1ccc(cc1)C(=O)N 7a_100000162016_100000187820 [0,0,0,0,1,1|2,0,0]=4 4091 B15R1.1080 NC(=O)CSCc1ccc(cc1)C(=O)N 62a_100000231043_100000747473 [0,0,0,0,1,1|2,0,0]=4 4092 B15R1.1080 NC(=O)CSCc1ccc(cc1)C(=O)N 62a_100000747473_100000231043 [0,0,0,0,1,1|2,0,0]=4 4093 B15R1.1080 NC(=O)c1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000231043 [0,0,0,0,1,1|2,0,0]=4 4094 B15R1.1080 NC(=O)c1ccc(cc1)COCC(=O)[O-] 34a_100000162016_100020667443 [0,0,0,0,1,1|2,0,0]=4 4095 B15R1.1080 NC(=O)c1ccc(cc1)CSCC(=O)[O-] 62a_100000231043_100020667443 [0,0,0,0,1,1|2,0,0]=4 4096 B15R1.1080 NC(=O)c1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100000231043 [0,0,0,0,1,1|2,0,0]=4 4097 B15R1.1080 O=C([O-])CNCc1ccc(cc1)C(=O)O 269956a_100000181780_100020667443 [0,0,0,0,1,1|2,0,0]=4 4098 B15R1.1080 [13CH3]C(=O)CCCc1ccc(cc1)[N+](=O)[O-] 1458a_100011214885_200025704644 [0,0,0,0,1,1|2,0,0]=4 4099 B15R1.1080 [13CH3]C(=O)CCOc1ccc(cc1)[N+](=O)[O-] 1458a_100000738207_200025704644 [0,0,0,0,1,1|2,0,0]=4 4100 B15R1.1080 [13CH3]C(=O)CSCc1ccc(cc1)[N+](=O)[O-] 1458a_100000150263_200025704644 [0,0,0,0,1,1|2,0,0]=4 4101 B15R1.8936 C=C(C)COc1cccc(c1)OC(=O)C 7a_100011218754_100000748629 [0,0,0,0,1,1|2,0,0]=4 4102 B15R1.8936 C=C(C)CSc1cccc(c1)OC(=O)C 62a_100000748629_100009811612 [0,0,0,0,1,1|2,0,0]=4 4103 B15R1.8936 CC(=O)CCc1cccc(c1)C=C(C)C 271570a_100102525489_100011279149 [0,0,0,0,1,1|2,0,0]=4 4104 B15R1.8936 CC(=O)NCc1cccc(c1)NC(=O)C 11a_100000740035_100015343762 [0,0,0,0,1,1|2,0,0]=4 4105 B15R1.8936 CC(=O)NCc1cccc(c1)NC(=O)C 1626a_100000740035_100015343762 [0,0,0,0,1,1|2,0,0]=4 4106 B15R1.8936 CC(=O)NCc1cccc(c1)NC(=O)C 240690a_100000740035_100015343762 [0,0,0,0,1,1|2,0,0]=4 4107 B15R1.8936 CC(=O)NCc1cccc(c1)NC(=O)C 527a_100000740035_100103153847 [0,0,0,0,1,1|2,0,0]=4 4108 B15R1.8936 CC(=O)Oc1cccc(c1)OCC(=O)N 7a_100011218754_100000187820 [0,0,0,0,1,1|2,0,0]=4 4109 B15R1.8936 CC(=O)Oc1cccc(c1)SCC(=O)N 62a_100000747473_100009811612 [0,0,0,0,1,1|2,0,0]=4 4110 B15R1.8936 CC(=O)Oc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100009811612 [0,0,0,0,1,1|2,0,0]=4 4111 B17R1.1319 C=C(C)CCNc1ccc(cc1)CNC(=O)C 34a_100000755463_100000730704 [0,0,0,0,0,2|2,0,0]=4 4112 B17R1.1319 C=C(C)CCNc1ccc(cc1)OCC(=C)C 2230a_200015186533_100000730704 [0,0,0,0,0,2|2,0,0]=4 4113 B17R1.1319 C=C(C)CCNc1ccc(cc1)OCC(=C)C 34a_200015186533_100000730704 [0,0,0,0,0,2|2,0,0]=4 4114 B17R1.1319 C=C(C)CCNc1ccc(cc1)OCC(=O)N 2230a_100000238760_100000730704 [0,0,0,0,0,2|2,0,0]=4 4115 B17R1.1319 C=C(C)CCNc1ccc(cc1)OCC(=O)N 34a_100000238760_100000730704 [0,0,0,0,0,2|2,0,0]=4 4116 B17R1.1319 C=C(C)CCOc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_100000730704 [0,0,0,0,0,2|2,0,0]=4 4117 B17R1.1319 C=C(C)CCOc1ccc(cc1)CCC(=O)C 34a_100000198047_100000730704 [0,0,0,0,0,2|1,0,0]=3 4118 B17R1.1319 C=C(C)CCOc1ccc(cc1)CCC(=O)C 7a_100000198047_100000730704 [0,0,0,0,0,2|1,0,0]=3 4119 B17R1.1319 C=C(C)CCSc1ccc(cc1)/C=C/C(=O)C 62a_100000730704_200016259395 [0,0,0,0,0,2|2,0,0]=4 4120 B17R1.1319 C=C(C)CCSc1ccc(cc1)/C=C/C(=O)C 62a_200016259395_100000730704 [0,0,0,0,0,2|2,0,0]=4 4121 B17R1.1319 C=C(C)CCSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000730704 [0,0,0,0,0,2|1,1,0]=4 4122 B17R1.1319 C=C(C)CCSc1ccc(cc1)CCC(=O)C 62a_100000730704_100000723691 [0,0,0,0,0,2|1,1,0]=4 4123 B17R1.1319 C=C(C)CCSc1ccc(cc1)CNC(=O)C 62a_100000730704_200000685173 [0,0,0,0,0,2|2,0,0]=4 4124 B17R1.1319 C=C(C)CCSc1ccc(cc1)CNC(=O)C 62a_200000685173_100000730704 [0,0,0,0,0,2|2,0,0]=4 4125 B17R1.1319 C=C(C)CCSc1ccc(cc1)NNC(=O)C 62a_100000730704_200009815283 [0,0,0,0,0,2|2,0,0]=4 4126 B17R1.1319 C=C(C)CCSc1ccc(cc1)NNC(=O)C 62a_200009815283_100000730704 [0,0,0,0,0,2|2,0,0]=4 4127 B17R1.1319 C=C(C)CNCc1ccc(cc1)OCC(=O)N 2230a_100000244766_100000748629 [0,0,0,0,0,2|2,0,0]=4 4128 B17R1.1319 C=C(C)COCc1ccc(cc1)OCC(=C)C 34a_100000173090_100000748629 [0,0,0,0,0,2|2,0,0]=4 4129 B17R1.1319 C=C(C)COCc1ccc(cc1)OCC(=C)C 7a_100000173090_100000748629 [0,0,0,0,0,2|2,0,0]=4 4130 B17R1.1319 C=C(C)COc1ccc(cc1)CCNC(=O)C 34a_100011395907_100000748629 [0,0,0,0,0,2|1,0,0]=3 4131 B17R1.1319 C=C(C)COc1ccc(cc1)CCNC(=O)C 7a_100011395907_100000748629 [0,0,0,0,0,2|1,0,0]=3 4132 B17R1.1319 C=C(C)COc1ccc(cc1)COCC(=O)N 34a_100000173090_100000187820 [0,0,0,0,0,2|2,0,0]=4 4133 B17R1.1319 C=C(C)COc1ccc(cc1)COCC(=O)N 7a_100000173090_100000187820 [0,0,0,0,0,2|2,0,0]=4 4134 B17R1.1319 C=C(C)COc1ccc(cc1)COCC(=O)[O-] 34a_100000173090_100020667443 [0,0,0,0,0,2|2,0,0]=4 4135 B17R1.1319 C=C(C)COc1ccc(cc1)NCCC(=O)N 2230a_200015186533_100000744528 [0,0,0,0,0,2|2,0,0]=4 4136 B17R1.1319 C=C(C)COc1ccc(cc1)NCCC(=O)N 34a_200015186533_100000731001 [0,0,0,0,0,2|2,0,0]=4 4137 B17R1.1319 C=C(C)COc1ccc(cc1)NCOC(=O)C 34a_200015186533_100009813279 [0,0,0,0,0,2|2,0,0]=4 4138 B17R1.1319 C=C(C)CSc1ccc(cc1)CCOC(=O)C 62a_100000748629_200016374084 [0,0,0,0,0,2|1,1,0]=4 4139 B17R1.1319 C=C(C)CSc1ccc(cc1)CCOC(=O)C 62a_200016374084_100000211660 [0,0,0,0,0,2|1,1,0]=4 4140 B17R1.1319 C=C(F)COc1ccc(cc1)CCNC(=O)C 34a_100011395907_100009893438 [0,0,0,0,0,2|1,0,1]=4 4141 B17R1.1319 C=C(F)COc1ccc(cc1)CCNC(=O)C 7a_100011395907_100000042424 [0,0,0,0,0,2|1,0,1]=4 4142 B17R1.1319 CC(=O)/C=C/c1ccc(cc1)OCCC(=O)N 34a_100000189429_100000731001 [0,0,0,0,0,2|2,0,0]=4 4143 B17R1.1319 CC(=O)/C=C/c1ccc(cc1)OCOC(=O)C 34a_100000189429_100009813279 [0,0,0,0,0,2|0,0,2]=4 4144 B17R1.1319 CC(=O)/C=C/c1ccc(cc1)SCCC(=O)C 62a_100000053229_200016259395 [0,0,0,0,0,2|1,0,0]=3 4145 B17R1.1319 CC(=O)/C=C/c1ccc(cc1)SCCC(=O)C 62a_200016259395_100000053229 [0,0,0,0,0,2|1,0,0]=3 4146 B17R1.1319 CC(=O)/C=C/c1ccc(cc1)SCCC(=O)N 62a_100000744528_200016259395 [0,0,0,0,0,2|2,0,0]=4 4147 B17R1.1319 CC(=O)/C=C/c1ccc(cc1)SCCC(=O)N 62a_200016259395_100000744528 [0,0,0,0,0,2|2,0,0]=4 4148 B17R1.1319 CC(=O)/C=C/c1ccc(cc1)SCOC(=O)C 62a_100000076356_200016259395 [0,0,0,0,0,2|0,0,2]=4 4149 B17R1.1319 CC(=O)/C=C/c1ccc(cc1)SCOC(=O)C 62a_200016259395_100000076356 [0,0,0,0,0,2|0,0,2]=4 4150 B17R1.1319 CC(=O)CCOc1ccc(cc1)CCC(=O)C 7a_100000198047_100000053229 [0,0,0,0,0,2|0,0,0]=2 4151 B17R1.1319 CC(=O)CCOc1ccc(cc1)CCC(C)O 7a_100000189425_100000053229 [0,0,0,0,0,2|0,0,2]=4 4152 B17R1.1319 CC(=O)CCSc1ccc(cc1)CCC(=O)C 62a_100000053229_100000723691 [0,0,0,0,0,2|0,1,0]=3 4153 B17R1.1319 CC(=O)CCSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000053229 [0,0,0,0,0,2|0,1,0]=3 4154 B17R1.1319 CC(=O)CCSc1ccc(cc1)CCC(=O)N 62a_100000053229_200010110666 [0,0,0,0,0,2|1,1,0]=4 4155 B17R1.1319 CC(=O)CCSc1ccc(cc1)CCC(=O)N 62a_200010110666_100000053229 [0,0,0,0,0,2|1,1,0]=4 4156 B17R1.1319 CC(=O)CCSc1ccc(cc1)CNC(=O)C 62a_100000053229_200000685173 [0,0,0,0,0,2|1,0,0]=3 4157 B17R1.1319 CC(=O)CCSc1ccc(cc1)CNC(=O)C 62a_200000685173_100000053229 [0,0,0,0,0,2|1,0,0]=3 4158 B17R1.1319 CC(=O)CCSc1ccc(cc1)COC(C)C 62a_100000053229_100000758563 [0,0,0,0,0,2|1,0,1]=4 4159 B17R1.1319 CC(=O)CCSc1ccc(cc1)COC(C)C 62a_100000758563_100000053229 [0,0,0,0,0,2|1,0,1]=4 4160 B17R1.1319 CC(=O)CCSc1ccc(cc1)NNC(=O)C 62a_100000053229_200009815283 [0,0,0,0,0,2|1,0,0]=3 4161 B17R1.1319 CC(=O)CCSc1ccc(cc1)NNC(=O)C 62a_200009815283_100000053229 [0,0,0,0,0,2|1,0,0]=3 4162 B17R1.1319 CC(=O)CCSc1ccc(cc1)OCC(C)C 62a_100000053229_200000169949 [0,0,0,0,0,2|1,0,1]=4 4163 B17R1.1319 CC(=O)CCSc1ccc(cc1)OCC(C)C 62a_200000169949_100000053229 [0,0,0,0,0,2|1,0,1]=4 4164 B17R1.1319 CC(=O)CCSc1ccc(cc1)SCC(=O)N 62a_100000053229_100000149456 [0,0,0,0,0,2|1,1,0]=4 4165 B17R1.1319 CC(=O)CCSc1ccc(cc1)SCC(=O)N 62a_100000149456_100000053229 [0,0,0,0,0,2|1,1,0]=4 4166 B17R1.1319 CC(=O)CCSc1ccc(nc1)NNC(=O)C 62a_100000053229_200010175596 [0,0,0,0,0,2|2,0,0]=4 4167 B17R1.1319 CC(=O)CCSc1ccc(nc1)NNC(=O)C 62a_200010175596_100000053229 [0,0,0,0,0,2|2,0,0]=4 4168 B17R1.1319 CC(=O)CCc1ccc(cc1)OCC=C(C)C 34a_100000198047_100000761012 [0,0,0,0,0,2|1,0,0]=3 4169 B17R1.1319 CC(=O)CCc1ccc(cc1)OCC=C(C)C 7a_100000198047_100000761012 [0,0,0,0,0,2|1,0,0]=3 4170 B17R1.1319 CC(=O)CCc1ccc(cc1)OCCC(=O)N 34a_100000198047_100000731001 [0,0,0,0,0,2|1,0,0]=3 4171 B17R1.1319 CC(=O)CCc1ccc(cc1)OCCC(=O)N 7a_100000198047_100000744528 [0,0,0,0,0,2|1,0,0]=3 4172 B17R1.1319 CC(=O)CCc1ccc(cc1)OCCC(C)C 34a_100000198047_100000210312 [0,0,0,0,0,2|1,0,1]=4 4173 B17R1.1319 CC(=O)CCc1ccc(cc1)OCCC(C)C 7a_100000198047_100000210626 [0,0,0,0,0,2|1,0,1]=4 4174 B17R1.1319 CC(=O)CCc1ccc(cc1)OCCC(C)O 34a_100000198047_100012276601 [0,0,0,0,0,2|0,0,2]=4 4175 B17R1.1319 CC(=O)CCc1ccc(cc1)OCCC(C)O 7a_100000198047_100012276601 [0,0,0,0,0,2|0,0,2]=4 4176 B17R1.1319 CC(=O)CCc1ccc(cc1)OCCN(C)C 7a_100000198047_100000755713 [0,0,0,0,0,2|2,0,0]=4 4177 B17R1.1319 CC(=O)CCc1ccc(cc1)OCOC(=O)C 34a_100000198047_100009813279 [0,0,0,0,0,2|0,0,0]=2 4178 B17R1.1319 CC(=O)CCc1ccc(cc1)OCOC(C)C 34a_100000198047_100000709892 [0,0,0,0,0,2|1,0,1]=4 4179 B17R1.1319 CC(=O)CCc1ccc(cc1)SCC=C(C)C 62a_100000723691_100000761012 [0,0,0,0,0,2|1,1,0]=4 4180 B17R1.1319 CC(=O)CCc1ccc(cc1)SCC=C(C)C 62a_100000761012_100000723691 [0,0,0,0,0,2|1,1,0]=4 4181 B17R1.1319 CC(=O)CCc1ccc(cc1)SCCC(=O)N 62a_100000723691_100000744528 [0,0,0,0,0,2|1,1,0]=4 4182 B17R1.1319 CC(=O)CCc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000723691 [0,0,0,0,0,2|1,1,0]=4 4183 B17R1.1319 CC(=O)CCc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000723691 [0,0,0,0,0,2|0,0,0]=2 4184 B17R1.1319 CC(=O)CCc1ccc(cc1)SCOC(=O)C 62a_100000723691_100000076356 [0,0,0,0,0,2|0,0,0]=2 4185 B17R1.1319 CC(=O)CCc1ccc(cc1)SCOC(C)C 62a_100000709892_100000723691 [0,0,0,0,0,2|1,0,1]=4 4186 B17R1.1319 CC(=O)CCc1ccc(cc1)SCOC(C)C 62a_100000723691_100000709892 [0,0,0,0,0,2|1,0,1]=4 4187 B17R1.1319 CC(=O)NCCc1ccc(cc1)OCC(=O)N 34a_100011395907_100000187820 [0,0,0,0,0,2|1,0,0]=3 4188 B17R1.1319 CC(=O)NCCc1ccc(cc1)OCC(=O)N 7a_100011395907_100000187820 [0,0,0,0,0,2|1,0,0]=3 4189 B17R1.1319 CC(=O)NCCc1ccc(cc1)OCC(=O)[O-] 34a_100011395907_100020667443 [0,0,0,0,0,2|1,0,0]=3 4190 B17R1.1319 CC(=O)NCCc1ccc(cc1)OCC(C)C 34a_100011395907_100000210624 [0,0,0,0,0,2|1,0,1]=4 4191 B17R1.1319 CC(=O)NCCc1ccc(cc1)OCC(C)C 7a_100011395907_100000210760 [0,0,0,0,0,2|1,0,1]=4 4192 B17R1.1319 CC(=O)NCCc1ccc(cc1)OCC(C)O 34a_100011395907_100011218427 [0,0,0,0,0,2|0,0,2]=4 4193 B17R1.1319 CC(=O)NCCc1ccc(cc1)OCC(C)O 7a_100011395907_100011218427 [0,0,0,0,0,2|0,0,2]=4 4194 B17R1.1319 CC(=O)NCCc1ccc(cc1)OC[C@@H](C)O 34a_100011395907_100009817552 [0,0,0,0,0,2|0,0,2]=4 4195 B17R1.1319 CC(=O)NCCc1ccc(cc1)OC[C@@H](C)O 7a_100011395907_100009817552 [0,0,0,0,0,2|0,0,2]=4 4196 B17R1.1319 CC(=O)NCCc1ccc(cc1)OC[N+](=O)[O-] 34a_100011395907_100000761209 [0,0,0,0,0,2|2,0,0]=4 4197 B17R1.1319 CC(=O)NCc1ccc(cc1)NCCC(=O)N 34a_100000755463_100000731001 [0,0,0,0,0,2|2,0,0]=4 4198 B17R1.1319 CC(=O)NCc1ccc(cc1)NCOC(=O)C 34a_100000755463_100009813279 [0,0,0,0,0,2|1,0,0]=3 4199 B17R1.1319 CC(=O)NCc1ccc(cc1)SCCC(=O)N 62a_100000744528_200000685173 [0,0,0,0,0,2|2,0,0]=4 4200 B17R1.1319 CC(=O)NCc1ccc(cc1)SCCC(=O)N 62a_200000685173_100000744528 [0,0,0,0,0,2|2,0,0]=4 4201 B17R1.1319 CC(=O)NCc1ccc(cc1)SCOC(=O)C 62a_100000076356_200000685173 [0,0,0,0,0,2|1,0,0]=3 4202 B17R1.1319 CC(=O)NCc1ccc(cc1)SCOC(=O)C 62a_200000685173_100000076356 [0,0,0,0,0,2|1,0,0]=3 4203 B17R1.1319 CC(=O)NNc1ccc(cc1)SCCC(=O)N 62a_100000744528_200009815283 [0,0,0,0,0,2|2,0,0]=4 4204 B17R1.1319 CC(=O)NNc1ccc(cc1)SCCC(=O)N 62a_200009815283_100000744528 [0,0,0,0,0,2|2,0,0]=4 4205 B17R1.1319 CC(=O)NNc1ccc(cc1)SCOC(=O)C 62a_100000076356_200009815283 [0,0,0,0,0,2|2,0,0]=4 4206 B17R1.1319 CC(=O)NNc1ccc(cc1)SCOC(=O)C 62a_200009815283_100000076356 [0,0,0,0,0,2|2,0,0]=4 4207 B17R1.1319 CC(=O)OCCc1ccc(cc1)SCC(=O)N 62a_100000747473_200016374084 [0,0,0,0,0,2|1,1,0]=4 4208 B17R1.1319 CC(=O)OCCc1ccc(cc1)SCC(=O)N 62a_200016374084_100000747473 [0,0,0,0,0,2|1,1,0]=4 4209 B17R1.1319 CC(=O)OCCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200016374084 [0,0,0,0,0,2|1,1,0]=4 4210 B17R1.1319 CC(=O)OCCc1ccc(cc1)SCC(=O)[O-] 62a_200016374084_100020667443 [0,0,0,0,0,2|1,1,0]=4 4211 B17R1.1319 CC(=O)OCNc1ccc(cc1)CNC(=O)N 34a_100000747042_100009813279 [0,0,0,0,0,2|2,0,0]=4 4212 B17R1.1319 CC(=O)OCNc1ccc(cc1)OCC(=O)N 34a_100000238760_100009813279 [0,0,0,0,0,2|2,0,0]=4 4213 B17R1.1319 CC(=O)OCOc1ccc(cc1)CCC(C)O 34a_100000189425_100009813279 [0,0,0,0,0,2|0,0,2]=4 4214 B17R1.1319 CC(=O)OCSc1ccc(cc1)CCC(=O)N 62a_100000076356_200010110666 [0,0,0,0,0,2|1,0,0]=3 4215 B17R1.1319 CC(=O)OCSc1ccc(cc1)CCC(=O)N 62a_200010110666_100000076356 [0,0,0,0,0,2|1,0,0]=3 4216 B17R1.1319 CC(=O)OCSc1ccc(cc1)SCC(=O)N 62a_100000076356_100000149456 [0,0,0,0,0,2|2,0,0]=4 4217 B17R1.1319 CC(=O)OCSc1ccc(cc1)SCC(=O)N 62a_100000149456_100000076356 [0,0,0,0,0,2|2,0,0]=4 4218 B17R1.1319 NC(=O)CCNc1ccc(cc1)OCC(=O)N 2230a_100000238760_100000744528 [0,0,0,0,0,2|2,0,0]=4 4219 B17R1.1319 NC(=O)CCNc1ccc(cc1)OCC(=O)N 34a_100000238760_100000731001 [0,0,0,0,0,2|2,0,0]=4 4220 B17R1.1319 NC(=O)CNCc1ccc(cc1)OCC(=O)N 2230a_100000244766_100000747473 [0,0,0,0,0,2|2,0,0]=4 4221 B17R1.1309 C=C(C)CCNCc1ccc(cc1)NC(=O)C 34a_100000735448_100000730704 [0,0,0,0,0,2|2,0,0]=4 4222 B17R1.1309 C=C(C)CCOCc1ccc(cc1)NC(=O)C 34a_100000246270_100000730704 [0,0,0,0,0,2|2,0,0]=4 4223 B17R1.1309 C=C(C)CCOCc1ccc(cc1)NC(=O)C 34a_100000764851_100000731167 [0,0,0,0,0,2|2,0,0]=4 4224 B17R1.1309 C=C(C)CCOCc1ccc(cc1)NC(=O)C 7a_100000246270_100000730704 [0,0,0,0,0,2|2,0,0]=4 4225 B17R1.1309 C=C(C)CCSCc1ccc(cc1)NC(=O)C 62a_100000730704_100000731167 [0,0,0,0,0,2|2,0,0]=4 4226 B17R1.1309 C=C(C)CCSCc1ccc(cc1)OC(=O)C 62a_100000730704_100000033664 [0,0,0,0,0,2|1,0,0]=3 4227 B17R1.1309 C=C(C)COCCc1ccc(cc1)NC(=O)C 34a_100000752260_100000748629 [0,0,0,0,0,2|2,0,0]=4 4228 B17R1.1309 C=C(C)COCCc1ccc(cc1)NC(=O)C 7a_100000752260_100000748629 [0,0,0,0,0,2|2,0,0]=4 4229 B17R1.1309 CC(=O)CCCNc1ccc(cc1)CC(=O)N 34a_100000738315_100000685027 [0,0,0,0,0,2|2,0,0]=4 4230 B17R1.1309 CC(=O)CCCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000685027 [0,0,0,0,0,2|1,0,0]=3 4231 B17R1.1309 CC(=O)CCCNc1ccc(cc1)OC(C)C 34a_100011194259_100000685027 [0,0,0,0,0,2|1,0,1]=4 4232 B17R1.1309 CC(=O)CCCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000685027 [0,0,0,0,0,2|1,0,0]=3 4233 B17R1.1309 CC(=O)CCCOc1ccc(cc1)CC(=O)C 7a_100011218180_100011215641 [0,0,0,0,0,2|1,0,0]=3 4234 B17R1.1309 CC(=O)CCCOc1ccc(cc1)CC(=O)N 34a_100000020825_100000685027 [0,0,0,0,0,2|2,0,0]=4 4235 B17R1.1309 CC(=O)CCCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000685027 [0,0,0,0,0,2|1,0,0]=3 4236 B17R1.1309 CC(=O)CCCOc1ccc(cc1)NC(=O)C 7a_100000184395_100011215641 [0,0,0,0,0,2|1,0,0]=3 4237 B17R1.1309 CC(=O)CCCOc1ccc(cc1)OC(C)C 34a_100000757185_100000685027 [0,0,0,0,0,2|1,0,1]=4 4238 B17R1.1309 CC(=O)CCCOc1ccc(cc1)OC(C)C 7a_100000757185_100011215641 [0,0,0,0,0,2|1,0,1]=4 4239 B17R1.1309 CC(=O)CCCOc1ccc(nc1)NC(=O)C 34a_200000094647_100000685027 [0,0,0,0,0,2|2,0,0]=4 4240 B17R1.1309 CC(=O)CCCOc1ccc(nc1)NC(=O)C 7a_200000094647_100011215641 [0,0,0,0,0,2|2,0,0]=4 4241 B17R1.1309 CC(=O)CCCSc1ccc(cc1)CC(=O)C 62a_100000691760_100011215641 [0,0,0,0,0,2|1,0,0]=3 4242 B17R1.1309 CC(=O)CCCSc1ccc(cc1)CC(=O)C 62a_100011215641_100000691760 [0,0,0,0,0,2|1,0,0]=3 4243 B17R1.1309 CC(=O)CCCSc1ccc(cc1)CC(=O)N 62a_100000162331_100011215641 [0,0,0,0,0,2|2,0,0]=4 4244 B17R1.1309 CC(=O)CCCSc1ccc(cc1)CC(=O)N 62a_100011215641_100000162331 [0,0,0,0,0,2|2,0,0]=4 4245 B17R1.1309 CC(=O)CCCSc1ccc(cc1)NC(=O)C 62a_100011215641_100000155215 [0,0,0,0,0,2|1,0,0]=3 4246 B17R1.1309 CC(=O)CCCSc1ccc(cc1)NC(=O)N 62a_100011215641_100000198584 [0,0,0,0,0,2|2,0,0]=4 4247 B17R1.1309 CC(=O)CCCSc1ccc(cc1)OC(=O)C 62a_100011215641_100000002173 [0,0,0,0,0,2|0,0,0]=2 4248 B17R1.1309 CC(=O)CCCSc1ccc(cc1)OC(=S)C 62a_100011215641_200009816735 [0,0,0,0,0,2|0,1,0]=3 4249 B17R1.1309 CC(=O)CCCSc1ccc(cc1)OC(C)C 62a_100000169947_100011215641 [0,0,0,0,0,2|1,0,1]=4 4250 B17R1.1309 CC(=O)CCCSc1ccc(cc1)OC(C)C 62a_100011215641_100000169947 [0,0,0,0,0,2|1,0,1]=4 4251 B17R1.1309 CC(=O)CCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100011215641 [0,0,0,0,0,2|0,1,0]=3 4252 B17R1.1309 CC(=O)CCCSc1ccc(cn1)NC(=O)C 62a_100011215641_100011934715 [0,0,0,0,0,2|2,0,0]=4 4253 B17R1.1309 CC(=O)CCCSc1ccc(nc1)NC(=O)C 62a_100011215641_100000193312 [0,0,0,0,0,2|2,0,0]=4 4254 B17R1.1309 CC(=O)CCNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100000053229 [0,0,0,0,0,2|2,0,0]=4 4255 B17R1.1309 CC(=O)CCOCc1ccc(cc1)NC(=O)C 34a_100000759926_100000731167 [0,0,0,0,0,2|1,0,0]=3 4256 B17R1.1309 CC(=O)CCOCc1ccc(cc1)NC(=O)C 7a_100000246270_100000053229 [0,0,0,0,0,2|1,0,0]=3 4257 B17R1.1309 CC(=O)CCOCc1ccc(cc1)NC(=O)C 7a_100000759926_100000731167 [0,0,0,0,0,2|1,0,0]=3 4258 B17R1.1309 CC(=O)CCOCc1ccc(cc1)OC(=O)C 7a_100000759926_100000033664 [0,0,0,0,0,2|0,0,0]=2 4259 B17R1.1309 CC(=O)CCOCc1ccc(cc1)OC(C)C 7a_100000173089_100000053229 [0,0,0,0,0,2|1,0,1]=4 4260 B17R1.1309 CC(=O)CCSCc1ccc(cc1)NC(=O)C 62a_100000053229_100000731167 [0,0,0,0,0,2|1,0,0]=3 4261 B17R1.1309 CC(=O)CCSCc1ccc(cc1)OC(=O)C 62a_100000053229_100000033664 [0,0,0,0,0,2|0,0,0]=2 4262 B17R1.1309 CC(=O)Cc1ccc(cc1)C=CCOC(=O)C 271570a_200000047263_100000691760 [0,0,0,0,0,2|1,0,1]=4 4263 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCC=C(C)C 34a_100011218180_100011217483 [0,0,0,0,0,2|2,0,0]=4 4264 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCC=C(C)C 7a_100011218180_100011217483 [0,0,0,0,0,2|2,0,0]=4 4265 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCCC(=O)N 34a_100011218180_100102525003 [0,0,0,0,0,2|2,0,0]=4 4266 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCCC(=O)N 7a_100011218180_100102525003 [0,0,0,0,0,2|2,0,0]=4 4267 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCNC(=O)C 7a_100011218180_100000189650 [0,0,0,0,0,2|1,0,0]=3 4268 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCNC(=O)N 7a_100011218180_200000034859 [0,0,0,0,0,2|2,0,0]=4 4269 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCOC(=O)C 34a_100011218180_100009814007 [0,0,0,0,0,2|1,0,0]=3 4270 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCOC(=O)C 7a_100011218180_100009814007 [0,0,0,0,0,2|1,0,0]=3 4271 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCOC(=O)N 34a_100011218180_200011214921 [0,0,0,0,0,2|2,0,0]=4 4272 B17R1.1309 CC(=O)Cc1ccc(cc1)OCCOC(=O)N 7a_100011218180_200011214921 [0,0,0,0,0,2|2,0,0]=4 4273 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCC=C(C)C 62a_100000691760_100011217483 [0,0,0,0,0,2|2,0,0]=4 4274 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCC=C(C)C 62a_100011217483_100000691760 [0,0,0,0,0,2|2,0,0]=4 4275 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCCC(=O)N 62a_100000691760_100102525003 [0,0,0,0,0,2|2,0,0]=4 4276 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100000691760 [0,0,0,0,0,2|2,0,0]=4 4277 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCNC(=O)C 62a_100000189650_100000691760 [0,0,0,0,0,2|1,0,0]=3 4278 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCNC(=O)C 62a_100000691760_100000189650 [0,0,0,0,0,2|1,0,0]=3 4279 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCNC(=O)N 62a_100000691760_200000034859 [0,0,0,0,0,2|2,0,0]=4 4280 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCNC(=O)N 62a_200000034859_100000691760 [0,0,0,0,0,2|2,0,0]=4 4281 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCOC(=O)C 62a_100000691760_100009814007 [0,0,0,0,0,2|1,0,0]=3 4282 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCOC(=O)C 62a_100009814007_100000691760 [0,0,0,0,0,2|1,0,0]=3 4283 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCOC(=O)N 62a_100000691760_200011214921 [0,0,0,0,0,2|2,0,0]=4 4284 B17R1.1309 CC(=O)Cc1ccc(cc1)SCCOC(=O)N 62a_200011214921_100000691760 [0,0,0,0,0,2|2,0,0]=4 4285 B17R1.1309 CC(=O)NCCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000189650 [0,0,0,0,0,2|2,0,0]=4 4286 B17R1.1309 CC(=O)NCCNc1ccc(cc1)OC(C)C 2230a_100011194259_100000189650 [0,0,0,0,0,2|1,0,1]=4 4287 B17R1.1309 CC(=O)NCCOc1ccc(cc1)C=C(C)C 271570a_100102525489_200009814669 [0,0,0,0,0,2|2,0,0]=4 4288 B17R1.1309 CC(=O)NCCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000189650 [0,0,0,0,0,2|1,0,0]=3 4289 B17R1.1309 CC(=O)NCCOc1ccc(cc1)OC(C)C 7a_100000757185_100000189650 [0,0,0,0,0,2|1,0,1]=4 4290 B17R1.1309 CC(=O)NCCOc1ccc(nc1)NC(=O)C 7a_200000094647_100000189650 [0,0,0,0,0,2|2,0,0]=4 4291 B17R1.1309 CC(=O)NCCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000189650 [0,0,0,0,0,2|2,0,0]=4 4292 B17R1.1309 CC(=O)NCCSc1ccc(cc1)CC(=O)N 62a_100000189650_100000162331 [0,0,0,0,0,2|2,0,0]=4 4293 B17R1.1309 CC(=O)NCCSc1ccc(cc1)NC(=O)C 62a_100000189650_100000155215 [0,0,0,0,0,2|1,0,0]=3 4294 B17R1.1309 CC(=O)NCCSc1ccc(cc1)NC(=O)N 62a_100000189650_100000198584 [0,0,0,0,0,2|2,0,0]=4 4295 B17R1.1309 CC(=O)NCCSc1ccc(cc1)OC(=O)C 62a_100000189650_100000002173 [0,0,0,0,0,2|0,0,0]=2 4296 B17R1.1309 CC(=O)NCCSc1ccc(cc1)OC(=S)C 62a_100000189650_200009816735 [0,0,0,0,0,2|0,1,0]=3 4297 B17R1.1309 CC(=O)NCCSc1ccc(cc1)OC(C)C 34a_100000750885_100000210206 [0,0,0,0,0,2|1,0,1]=4 4298 B17R1.1309 CC(=O)NCCSc1ccc(cc1)OC(C)C 62a_100000169947_100000189650 [0,0,0,0,0,2|1,0,1]=4 4299 B17R1.1309 CC(=O)NCCSc1ccc(cc1)OC(C)C 62a_100000189650_100000169947 [0,0,0,0,0,2|1,0,1]=4 4300 B17R1.1309 CC(=O)NCCSc1ccc(cc1)OC(C)C 7a_100000750885_100000210206 [0,0,0,0,0,2|1,0,1]=4 4301 B17R1.1309 CC(=O)NCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000189650 [0,0,0,0,0,2|0,1,0]=3 4302 B17R1.1309 CC(=O)NCCSc1ccc(cn1)NC(=O)C 62a_100000189650_100011934715 [0,0,0,0,0,2|2,0,0]=4 4303 B17R1.1309 CC(=O)NCCSc1ccc(nc1)NC(=O)C 62a_100000189650_100000193312 [0,0,0,0,0,2|2,0,0]=4 4304 B17R1.1309 CC(=O)Nc1ccc(cc1)C=CCOC(=O)C 271570a_200000047263_100000155215 [0,0,0,0,0,2|1,0,1]=4 4305 B17R1.1309 CC(=O)Nc1ccc(cc1)CCOCC(=O)N 34a_100000752260_100000187820 [0,0,0,0,0,2|2,0,0]=4 4306 B17R1.1309 CC(=O)Nc1ccc(cc1)CCOCC(=O)N 7a_100000752260_100000187820 [0,0,0,0,0,2|2,0,0]=4 4307 B17R1.1309 CC(=O)Nc1ccc(cc1)CCOCC(=O)[O-] 34a_100000752260_100020667443 [0,0,0,0,0,2|2,0,0]=4 4308 B17R1.1309 CC(=O)Nc1ccc(cc1)CNCC=C(C)C 34a_100000718196_100000731167 [0,0,0,0,0,2|2,0,0]=4 4309 B17R1.1309 CC(=O)Nc1ccc(cc1)CNCC=C(C)C 34a_100000735448_100000761012 [0,0,0,0,0,2|2,0,0]=4 4310 B17R1.1309 CC(=O)Nc1ccc(cc1)CNCCC(=O)N 207a_100000740010_100000210072 [0,0,0,0,0,2|2,0,0]=4 4311 B17R1.1309 CC(=O)Nc1ccc(cc1)CNCCC(=O)N 34a_100000735448_100000731001 [0,0,0,0,0,2|2,0,0]=4 4312 B17R1.1309 CC(=O)Nc1ccc(cc1)CNCOC(=O)C 34a_100000735448_100009813279 [0,0,0,0,0,2|1,0,0]=3 4313 B17R1.1309 CC(=O)Nc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000731167 [0,0,0,0,0,2|2,0,0]=4 4314 B17R1.1309 CC(=O)Nc1ccc(cc1)COCC=C(C)C 34a_100000246270_100000761012 [0,0,0,0,0,2|2,0,0]=4 4315 B17R1.1309 CC(=O)Nc1ccc(cc1)COCC=C(C)C 34a_100000753907_100000731167 [0,0,0,0,0,2|2,0,0]=4 4316 B17R1.1309 CC(=O)Nc1ccc(cc1)COCC=C(C)C 7a_100000246270_100000761012 [0,0,0,0,0,2|2,0,0]=4 4317 B17R1.1309 CC(=O)Nc1ccc(cc1)COCCC(=O)N 34a_100000246270_100000731001 [0,0,0,0,0,2|2,0,0]=4 4318 B17R1.1309 CC(=O)Nc1ccc(cc1)COCCC(=O)N 34a_100000757172_100000731167 [0,0,0,0,0,2|2,0,0]=4 4319 B17R1.1309 CC(=O)Nc1ccc(cc1)COCCC(=O)N 7a_100000246270_100000744528 [0,0,0,0,0,2|2,0,0]=4 4320 B17R1.1309 CC(=O)Nc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000731167 [0,0,0,0,0,2|2,0,0]=4 4321 B17R1.1309 CC(=O)Nc1ccc(cc1)COCOC(=O)C 34a_100000246270_100009813279 [0,0,0,0,0,2|1,0,0]=3 4322 B17R1.1309 CC(=O)Nc1ccc(cc1)CSCC=C(C)C 62a_100000761012_100000731167 [0,0,0,0,0,2|2,0,0]=4 4323 B17R1.1309 CC(=O)Nc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000731167 [0,0,0,0,0,2|2,0,0]=4 4324 B17R1.1309 CC(=O)Nc1ccc(cc1)CSCOC(=O)C 62a_100000076356_100000731167 [0,0,0,0,0,2|1,0,0]=3 4325 B17R1.1309 CC(=O)Nc1ccc(cc1)NCCC=C(C)C 34a_100000184111_100011217483 [0,0,0,0,0,2|2,0,0]=4 4326 B17R1.1309 CC(=O)Nc1ccc(cc1)NCCCC(=O)N 34a_100000184111_100102525003 [0,0,0,0,0,2|2,0,0]=4 4327 B17R1.1309 CC(=O)Nc1ccc(cc1)NCCOC(=O)C 34a_100000184111_100009814007 [0,0,0,0,0,2|1,0,0]=3 4328 B17R1.1309 CC(=O)Nc1ccc(cc1)NCCOC(=O)N 34a_100000184111_200011214921 [0,0,0,0,0,2|2,0,0]=4 4329 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCC=C(C)C 34a_100000184395_100011217483 [0,0,0,0,0,2|2,0,0]=4 4330 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCC=C(C)C 7a_100000184395_100011217483 [0,0,0,0,0,2|2,0,0]=4 4331 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCCC(=O)N 34a_100000184395_100102525003 [0,0,0,0,0,2|2,0,0]=4 4332 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCCC(=O)N 7a_100000184395_100102525003 [0,0,0,0,0,2|2,0,0]=4 4333 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCNC(=O)N 7a_100000184395_200000034859 [0,0,0,0,0,2|2,0,0]=4 4334 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCOC(=O)C 34a_100000184395_100009814007 [0,0,0,0,0,2|1,0,0]=3 4335 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCOC(=O)C 7a_100000184395_100009814007 [0,0,0,0,0,2|1,0,0]=3 4336 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCOC(=O)N 34a_100000184395_200011214921 [0,0,0,0,0,2|2,0,0]=4 4337 B17R1.1309 CC(=O)Nc1ccc(cc1)OCCOC(=O)N 7a_100000184395_200011214921 [0,0,0,0,0,2|2,0,0]=4 4338 B17R1.1309 CC(=O)Nc1ccc(cc1)SCCC=C(C)C 62a_100011217483_100000155215 [0,0,0,0,0,2|2,0,0]=4 4339 B17R1.1309 CC(=O)Nc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100000155215 [0,0,0,0,0,2|2,0,0]=4 4340 B17R1.1309 CC(=O)Nc1ccc(cc1)SCCNC(=O)N 62a_200000034859_100000155215 [0,0,0,0,0,2|2,0,0]=4 4341 B17R1.1309 CC(=O)Nc1ccc(cc1)SCCOC(=O)C 62a_100009814007_100000155215 [0,0,0,0,0,2|1,0,0]=3 4342 B17R1.1309 CC(=O)Nc1ccc(cc1)SCCOC(=O)N 62a_200011214921_100000155215 [0,0,0,0,0,2|2,0,0]=4 4343 B17R1.1309 CC(=O)Nc1ccc(cn1)OCCOC(=O)C 34a_200000094647_100009814007 [0,0,0,0,0,2|2,0,0]=4 4344 B17R1.1309 CC(=O)Nc1ccc(cn1)OCCOC(=O)C 7a_200000094647_100009814007 [0,0,0,0,0,2|2,0,0]=4 4345 B17R1.1309 CC(=O)Nc1ccc(cn1)SCCOC(=O)C 62a_100009814007_100000193312 [0,0,0,0,0,2|2,0,0]=4 4346 B17R1.1309 CC(=O)Nc1ccc(nc1)SCCOC(=O)C 62a_100009814007_100011934715 [0,0,0,0,0,2|2,0,0]=4 4347 B17R1.1309 CC(=O)OCC=Cc1ccc(cc1)OC(=O)C 271570a_200000047263_100000002173 [0,0,0,0,0,2|0,0,1]=3 4348 B17R1.1309 CC(=O)OCC=Cc1ccc(cc1)OC(=S)C 271570a_200000047263_200009816735 [0,0,0,0,0,2|0,1,1]=4 4349 B17R1.1309 CC(=O)OCC=Cc1ccc(cc1)SC(=O)C 271570a_200000047263_200009995050 [0,0,0,0,0,2|0,1,1]=4 4350 B17R1.1309 CC(=O)OCCNc1ccc(cc1)CC(=O)N 34a_100000738315_100009814007 [0,0,0,0,0,2|2,0,0]=4 4351 B17R1.1309 CC(=O)OCCNc1ccc(cc1)OC(C)C 34a_100011194259_100009814007 [0,0,0,0,0,2|1,0,1]=4 4352 B17R1.1309 CC(=O)OCCOc1ccc(cc1)CC(=O)N 34a_100000020825_100009814007 [0,0,0,0,0,2|2,0,0]=4 4353 B17R1.1309 CC(=O)OCCOc1ccc(cc1)OC(C)C 34a_100000757185_100009814007 [0,0,0,0,0,2|1,0,1]=4 4354 B17R1.1309 CC(=O)OCCOc1ccc(cc1)OC(C)C 7a_100000757185_100009814007 [0,0,0,0,0,2|1,0,1]=4 4355 B17R1.1309 CC(=O)OCCSc1ccc(cc1)CC(=O)N 62a_100000162331_100009814007 [0,0,0,0,0,2|2,0,0]=4 4356 B17R1.1309 CC(=O)OCCSc1ccc(cc1)CC(=O)N 62a_100009814007_100000162331 [0,0,0,0,0,2|2,0,0]=4 4357 B17R1.1309 CC(=O)OCCSc1ccc(cc1)NC(=O)N 62a_100009814007_100000198584 [0,0,0,0,0,2|2,0,0]=4 4358 B17R1.1309 CC(=O)OCCSc1ccc(cc1)OC(=O)C 62a_100009814007_100000002173 [0,0,0,0,0,2|0,0,0]=2 4359 B17R1.1309 CC(=O)OCCSc1ccc(cc1)OC(=S)C 62a_100009814007_200009816735 [0,0,0,0,0,2|0,1,0]=3 4360 B17R1.1309 CC(=O)OCCSc1ccc(cc1)OC(C)C 62a_100000169947_100009814007 [0,0,0,0,0,2|1,0,1]=4 4361 B17R1.1309 CC(=O)OCCSc1ccc(cc1)OC(C)C 62a_100009814007_100000169947 [0,0,0,0,0,2|1,0,1]=4 4362 B17R1.1309 CC(=O)OCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100009814007 [0,0,0,0,0,2|0,1,0]=3 4363 B17R1.1309 CC(=O)OCNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100000076356 [0,0,0,0,0,2|2,0,0]=4 4364 B17R1.1309 CC(=O)OCNCc1ccc(cc1)OC(C)C 34a_100020586559_100009813279 [0,0,0,0,0,2|1,0,1]=4 4365 B17R1.1309 CC(=O)OCOCc1ccc(cc1)OC(C)C 34a_100000173089_100009813279 [0,0,0,0,0,2|1,0,1]=4 4366 B17R1.1309 CC(=O)OCSCc1ccc(cc1)OC(=O)C 62a_100000076356_100000033664 [0,0,0,0,0,2|0,0,0]=2 4367 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCC=C(C)C 270004a_100000718196_100000014718 [0,0,0,0,0,2|1,0,0]=3 4368 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCCC(=O)N 207a_100000740010_100000014718 [0,0,0,0,0,2|1,0,0]=3 4369 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCCC(C)C 207a_100000210545_100000014718 [0,0,0,0,0,2|1,0,1]=4 4370 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCCC(C)C 270004a_100000210545_100000014718 [0,0,0,0,0,2|1,0,1]=4 4371 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCCC(C)O 207a_200000755665_100000014718 [0,0,0,0,0,2|0,0,2]=4 4372 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCCC(C)O 2230a_200000755665_100000033664 [0,0,0,0,0,2|0,0,2]=4 4373 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCCC(C)O 270004a_200000755665_100000014718 [0,0,0,0,0,2|0,0,2]=4 4374 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCCN(C)C 207a_100000210585_100000014718 [0,0,0,0,0,2|2,0,0]=4 4375 B17R1.1309 CC(=O)Oc1ccc(cc1)CNCCN(C)C 270004a_100000210585_100000014718 [0,0,0,0,0,2|2,0,0]=4 4376 B17R1.1309 CC(=O)Oc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000033664 [0,0,0,0,0,2|1,0,0]=3 4377 B17R1.1309 CC(=O)Oc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000033664 [0,0,0,0,0,2|1,0,0]=3 4378 B17R1.1309 CC(=O)Oc1ccc(cc1)COCCC(C)C 7a_100000210254_100000033664 [0,0,0,0,0,2|1,0,1]=4 4379 B17R1.1309 CC(=O)Oc1ccc(cc1)CSCC=C(C)C 62a_100000761012_100000033664 [0,0,0,0,0,2|1,0,0]=3 4380 B17R1.1309 CC(=O)Oc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000033664 [0,0,0,0,0,2|1,0,0]=3 4381 B17R1.1309 CC(=O)Oc1ccc(cc1)CSCCC(C)C 62a_100000210312_100000033664 [0,0,0,0,0,2|1,0,1]=4 4382 B17R1.1309 CC(=O)Oc1ccc(cc1)CSCCC(C)O 62a_100012276601_100000033664 [0,0,0,0,0,2|0,0,2]=4 4383 B17R1.1309 CC(=O)Oc1ccc(cc1)CSCOC(C)C 62a_100000709892_100000033664 [0,0,0,0,0,2|1,0,1]=4 4384 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCC=C(C)C 62a_100011217483_100000002173 [0,0,0,0,0,2|1,0,0]=3 4385 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCC=C(F)F 62a_200009816681_100000002173 [0,0,0,0,0,2|2,0,0]=4 4386 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100000002173 [0,0,0,0,0,2|1,0,0]=3 4387 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCCC(C)C 62a_100011214892_100000002173 [0,0,0,0,0,2|1,0,1]=4 4388 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCCC(C)O 62a_200000718107_100000002173 [0,0,0,0,0,2|0,0,2]=4 4389 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCNC(=O)N 62a_200000034859_100000002173 [0,0,0,0,0,2|1,0,0]=3 4390 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCOC(=O)N 62a_200011214921_100000002173 [0,0,0,0,0,2|1,0,0]=3 4391 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCOC(C)C 62a_100000211751_100000002173 [0,0,0,0,0,2|1,0,1]=4 4392 B17R1.1309 CC(=O)Oc1ccc(cc1)SCCSC(C)C 62a_100000730970_100000002173 [0,0,0,0,0,2|1,0,1]=4 4393 B17R1.1309 CC(=O)Sc1ccc(cc1)SCCC=C(C)C 62a_200009995050_100011217483 [0,0,0,0,0,2|1,1,0]=4 4394 B17R1.1309 CC(=O)Sc1ccc(cc1)SCCCC(=O)N 62a_200009995050_100102525003 [0,0,0,0,0,2|1,1,0]=4 4395 B17R1.1309 CC(=O)Sc1ccc(cc1)SCCNC(=O)N 62a_200009995050_200000034859 [0,0,0,0,0,2|1,1,0]=4 4396 B17R1.1309 CC(=O)Sc1ccc(cc1)SCCOC(=O)N 62a_200009995050_200011214921 [0,0,0,0,0,2|1,1,0]=4 4397 B17R1.1309 CC(=S)Oc1ccc(cc1)SCCC=C(C)C 62a_100011217483_200009816735 [0,0,0,0,0,2|1,1,0]=4 4398 B17R1.1309 CC(=S)Oc1ccc(cc1)SCCCC(=O)N 62a_100102525003_200009816735 [0,0,0,0,0,2|1,1,0]=4 4399 B17R1.1309 CC(=S)Oc1ccc(cc1)SCCNC(=O)N 62a_200000034859_200009816735 [0,0,0,0,0,2|1,1,0]=4 4400 B17R1.1309 CC(=S)Oc1ccc(cc1)SCCOC(=O)N 62a_200011214921_200009816735 [0,0,0,0,0,2|1,1,0]=4