0 B11R1.74 C=C(C)c1cc(=O)[nH]c(=O)[nH]1 271570a_100000694244_100000015670 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.74 CC(=O)C1CC(=O)NC(=O)C1 1458a_100000044373_200000210301 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.74 CC(=O)N1CC(=O)NC(=O)C1 11a_100000763381_100015343762 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.74 CC(=O)N1CC(=O)NC(=O)C1 1626a_100000763381_100015343762 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.74 CC(=O)N1CC(=O)NC(=O)C1 240690a_100000763381_100015343762 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.74 CC(=O)[C@@H]1CC(=O)NC(=O)N1 1458a_100000732592_200000210301 [0,0,0,0,0,0|1,0,0]=1 6 B11R1.74 CC(=O)[C@@H]1C[C@H](NC(=S)N1)C 1458a_200015347995_200000210301 [0,0,0,0,0,0|2,1,1]=4 7 B11R1.74 C[C@@H]1C[C@H](NC(=S)N1)C(=O)[13CH3] 1458a_200015347995_200025704644 [0,0,0,0,0,0|2,1,1]=4 8 B11R1.74 [13CH3]C(=O)C1CC(=O)NC(=O)C1 1458a_100000044373_200025704644 [0,0,0,0,0,0|2,0,0]=2 9 B11R1.74 [13CH3]C(=O)[C@@H]1CC(=O)NC(=O)N1 1458a_100000732592_200025704644 [0,0,0,0,0,0|1,0,0]=1 10 B10R1.8 C=Cc1cc(=O)[nH]c(=O)[nH]1 271570a_100011290941_100000015670 [1,0,0,0,0,0|1,0,2]=4 11 B10R1.113 CC(=O)C1CCNC(=O)C1 1458a_100000132800_200000210301 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.113 CC(=O)C1CSCC(=O)N1 1458a_100000045068_200000210301 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.113 CC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_200000210301 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.113 [13CH3]C(=O)C1CCNC(=O)C1 1458a_100000132800_200025704644 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.113 [13CH3]C(=O)C1CSCC(=O)N1 1458a_100000045068_200025704644 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.113 [13CH3]C(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_200025704644 [1,0,0,0,0,0|2,0,1]=4 17 B12R1.358 C=CC(=O)N1CC(=O)NC(=O)C1 1626a_100000763381_100000185746 [0,1,0,0,0,0|3,0,0]=4 18 B12R1.358 C=CC(=O)N1CC(=O)NC(=O)C1 240690a_100000763381_200121576911 [0,1,0,0,0,0|3,0,0]=4 19 B12R1.358 CCC(=O)C1CC(=O)NC(=O)C1 1458a_100000044373_100000210202 [0,1,0,0,0,0|2,0,0]=3 20 B12R1.358 CCC(=O)N1CC(=O)NC(=O)C1 11a_100000763381_100000210414 [0,1,0,0,0,0|3,0,0]=4 21 B12R1.358 CCC(=O)N1CC(=O)NC(=O)C1 1626a_100000763381_100000210414 [0,1,0,0,0,0|3,0,0]=4 22 B12R1.358 CCC(=O)N1CC(=O)NC(=O)C1 240690a_100000763381_100000210414 [0,1,0,0,0,0|3,0,0]=4 23 B12R1.358 CCC(=O)[C@@H]1CC(=O)NC(=O)N1 1458a_100000732592_100000210202 [0,1,0,0,0,0|1,0,0]=2 24 B12R1.358 CNC(=O)C1CC(=O)NC(=O)C1 11a_106832991635_100000044373 [0,1,0,0,0,0|2,0,0]=3 25 B12R1.358 CNC(=O)C1CC(=O)NC(=O)C1 1626a_100102657272_100000044373 [0,1,0,0,0,0|2,0,0]=3 26 B12R1.358 CNC(=O)C1CC(=O)NC(=O)C1 240690a_100102657272_100000044373 [0,1,0,0,0,0|2,0,0]=3 27 B12R1.358 CNC(=O)C1CC(=O)NC(=O)C1 527a_100102657272_100000044373 [0,1,0,0,0,0|2,0,0]=3 28 B12R1.358 CNC(=O)N1CC(=O)NC(=O)C1 2708a_100102657272_100000763381 [0,1,0,0,0,0|3,0,0]=4 29 B12R1.358 CNC(=O)N1CC(=O)NC(=O)C1 273464a_100102657272_100000763381 [0,1,0,0,0,0|3,0,0]=4 30 B12R1.358 CNC(=O)[C@@H]1CC(=O)NC(=O)N1 1626a_100102657272_100000732592 [0,1,0,0,0,0|1,0,0]=2 31 B12R1.358 CNC(=O)[C@@H]1CC(=O)NC(=O)N1 240690a_100102657272_100000732592 [0,1,0,0,0,0|1,0,0]=2 32 B12R1.358 O=C1CC(CC(=O)N1)C(=O)CF 1458a_100000044373_100015361967 [0,1,0,0,0,0|2,0,0]=3 33 B12R1.358 O=C1CN(CC(=O)N1)C(=O)CO 240690a_100000763381_100000210174 [0,1,0,0,0,0|2,0,0]=3 34 B12R1.358 O=C1C[C@H](NC(=O)N1)C(=O)CF 1458a_100000732592_100015361967 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.1005 CC(=O)[C@@H]1CC(=O)N(C(=O)N1)C 1458a_100015231322_200000210301 [0,1,0,0,0,0|1,0,0]=2 36 B12R1.1005 CN1C(=O)C[C@H](NC1=O)C(=O)[13CH3] 1458a_100015231322_200025704644 [0,1,0,0,0,0|1,0,0]=2 37 B10R0.23 C=CCC(NC(=O)C)C(=O)C 1458a_100000741017_200000210301 [0,0,1,0,0,0|3,0,0]=4 38 B10R0.23 C=CCC(NC(=O)C)C(=O)[13CH3] 1458a_100000741017_200025704644 [0,0,1,0,0,0|3,0,0]=4 39 B10R0.23 CCN[C@@H](CC(=O)N)C(=O)N 2230a_100000143228_100000210202 [0,0,1,0,0,0|2,0,1]=4 40 B10R0.26 C=CCC(=O)N[C@H](C)C(=O)N 11a_100000119354_100000210193 [0,0,1,0,0,0|3,0,0]=4 41 B10R0.26 C=CCC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000210193 [0,0,1,0,0,0|3,0,0]=4 42 B10R0.26 C=CCC(=O)N[C@H](C)C(=O)N 527a_100000119354_100000210193 [0,0,1,0,0,0|3,0,0]=4 43 B10R0.26 CC=CC(=O)N[C@H](C)C(=O)N 11a_100000119354_100000210699 [0,0,1,0,0,0|3,0,0]=4 44 B10R0.26 CC=CC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000210699 [0,0,1,0,0,0|3,0,0]=4 45 B10R0.26 CCNC(=O)N[C@H](C)C(=O)N 273464a_100000119354_100015525214 [0,0,1,0,0,0|2,0,1]=4 46 B10R0.26 CCNC(=O)N[C@H](C)C(=O)N 273464a_100015525214_100000119354 [0,0,1,0,0,0|2,0,1]=4 47 B10R0.26 CCNC(=O)N[C@H](C)C(=O)N 512a_100000119354_100015525214 [0,0,1,0,0,0|2,0,1]=4 48 B10R0.26 CCNC(=O)N[C@H](C)C(=O)N 512a_100015525214_100000119354 [0,0,1,0,0,0|2,0,1]=4 49 B10R0.26 CNCC(=O)N[C@@H](C)C(=O)O 269956a_100011417567_200000210301 [0,0,1,0,0,0|3,0,0]=4 50 B10R0.26 CNNC(=O)N[C@H](C)C(=O)N 273464a_100000119354_100016993582 [0,0,1,0,0,0|3,0,0]=4 51 B10R0.26 CNNC(=O)N[C@H](C)C(=O)N 512a_100000119354_100016993582 [0,0,1,0,0,0|3,0,0]=4 52 B10R0.26 CNNC(=O)N[C@H](C)C(=O)N 512a_100016993582_100000119354 [0,0,1,0,0,0|3,0,0]=4 53 B10R0.26 C[C@@H](NC(=O)C=CBr)C(=O)N 240690a_100000119354_100016273825 [0,0,1,0,0,0|3,0,0]=4 54 B10R0.26 C[C@@H](NC(=O)C=CCl)C(=O)N 11a_100000119354_200016279998 [0,0,1,0,0,0|3,0,0]=4 55 B10R0.26 C[C@@H](NC(=O)C=CCl)C(=O)N 240690a_100000119354_200016279998 [0,0,1,0,0,0|3,0,0]=4 56 B10R0.26 C[C@H](NC(=O)CN[13CH3])C(=O)O 269956a_100011417567_200025704644 [0,0,1,0,0,0|3,0,0]=4 57 B10R0.96 C=C(C)CCC(=O)CC(=O)N 1458a_100134613110_100000730704 [0,0,1,0,0,0|3,0,0]=4 58 B10R0.96 C=C(C)CCC(=O)CC(=O)N 1458a_200000688413_100000187820 [0,0,1,0,0,0|3,0,0]=4 59 B10R0.96 CC(=CC(=O)NCC(=O)N)C 11a_100000711301_100000211388 [0,0,1,0,0,0|3,0,0]=4 60 B10R0.96 CC(=CC(=O)NCC(=O)N)C 240690a_100000711301_100000211388 [0,0,1,0,0,0|3,0,0]=4 61 B10R0.96 CC(=CC(=O)NCC(=O)N)Cl 11a_100000711301_200042562850 [0,0,1,0,0,0|3,0,0]=4 62 B10R0.96 CC(=CC(=O)NCC(=O)N)Cl 240690a_100000711301_200042562850 [0,0,1,0,0,0|3,0,0]=4 63 B10R0.96 CC(=CC(=O)NCC(=O)N)I 11a_100000711301_100025716642 [0,0,1,0,0,0|3,0,0]=4 64 B10R0.96 CC(=O)CC(=O)NNC(=O)C 1458a_100000070787_100000181415 [0,0,1,0,0,0|3,0,0]=4 65 B10R0.96 CC(=O)NCC(=O)CC(=O)N 1458a_100000194580_100000187820 [0,0,1,0,0,0|3,0,0]=4 66 B10R0.96 CC(=O)OC(C)NCC(=O)O 269956a_100016091260_100009818208 [0,0,1,0,0,0|2,0,1]=4 67 B10R0.96 CC(=O)OCC(=O)CC(=O)N 1458a_100000183556_100000187820 [0,0,1,0,0,0|3,0,0]=4 68 B10R0.96 CC(=O)SCC(=O)CC(=O)N 1458a_100000049016_100000187820 [0,0,1,0,0,0|3,0,0]=4 69 B10R0.96 CC(C)NC(=O)NCC(=O)N 2708a_100138425928_100000711301 [0,0,1,0,0,0|2,0,1]=4 70 B10R0.96 CC(C)NC(=O)NCC(=O)N 273464a_100138425928_100000711301 [0,0,1,0,0,0|2,0,1]=4 71 B10R0.96 CC(C)NC(=O)NCC(=O)N 512a_100138425928_100000711301 [0,0,1,0,0,0|2,0,1]=4 72 B10R0.96 CC(O)CCC(=O)CC(=O)N 1458a_100134613110_100012276601 [0,0,1,0,0,0|2,0,1]=4 73 B10R0.96 CN(C)CCC(=O)NC(=O)N 2230a_100102631434_100000237605 [0,0,1,0,0,0|3,0,0]=4 74 B10R0.96 CN(C)CCC(=O)NC(=O)N 269982a_100102631434_100000237605 [0,0,1,0,0,0|3,0,0]=4 75 B10R0.96 NC(=O)CC(=O)CC[N+](=O)[O-] 1458a_200000064761_100000187820 [0,0,1,0,0,0|2,0,1]=4 76 B10R0.96 NC(=O)CC(=O)CNC(=O)N 1458a_100000184981_100000187820 [0,0,1,0,0,0|3,0,0]=4 77 B10R0.96 NC(=O)CCC(=O)CC(=O)N 1458a_100011215257_100000187820 [0,0,1,0,0,0|2,0,0]=3 78 B10R0.96 NC(=O)CCC(=O)CC(=O)[O-] 1458a_100011215257_100020667443 [0,0,1,0,0,0|3,0,0]=4 79 B10R0.96 NC(=O)CNC(=O)CC(=O)N 240690a_100000711301_100134613110 [0,0,1,0,0,0|3,0,0]=4 80 B10R0.96 NC(=O)CNC(=O)CC(=O)N 527a_100000711301_100134613110 [0,0,1,0,0,0|3,0,0]=4 81 B12R1.101 CC(=O)CC1CC(=O)NC(=O)C1 1458a_100000049033_200000210301 [0,0,0,0,0,1|2,0,0]=3 82 B12R1.101 [13CH3]C(=O)CC1CC(=O)NC(=O)C1 1458a_100000049033_200025704644 [0,0,0,0,0,1|2,0,0]=3 83 B9R0.39 CCC(NC(=O)N)C(=O)C 1458a_100000203762_200000210301 [1,0,1,0,0,0|1,0,1]=4 84 B9R0.39 CCC(NC(=O)N)C(=O)[13CH3] 1458a_100000203762_200025704644 [1,0,1,0,0,0|1,0,1]=4 85 B9R0.39 CN[C@@H](CC(=O)N)C(=O)N 2230a_100000143228_200000210301 [1,0,1,0,0,0|1,0,1]=4 86 B9R0.39 [13CH3]N[C@@H](CC(=O)N)C(=O)N 2230a_100000143228_200025704644 [1,0,1,0,0,0|1,0,1]=4 87 B9R0.42 C=CC(=O)N[C@H](C)C(=O)N 240690a_100000119354_200121576911 [1,0,1,0,0,0|2,0,0]=4 88 B9R0.42 CNC(=O)N[C@H](C)C(=O)N 273464a_100000119354_100102657272 [1,0,1,0,0,0|1,0,1]=4 89 B9R0.42 CNC(=O)N[C@H](C)C(=O)N 273464a_100102657272_100000119354 [1,0,1,0,0,0|1,0,1]=4 90 B9R0.42 CNC(=O)N[C@H](C)C(=O)N 512a_100000119354_100102657272 [1,0,1,0,0,0|1,0,1]=4 91 B9R0.42 CNC(=O)N[C@H](C)C(=O)N 512a_106832991638_100000119354 [1,0,1,0,0,0|1,0,1]=4 92 B9R0.48 CC=CC(=O)NCC(=O)N 11a_100000711301_100000210699 [1,0,1,0,0,0|2,0,0]=4 93 B9R0.48 CC=CC(=O)NCC(=O)N 240690a_100000711301_100000210699 [1,0,1,0,0,0|2,0,0]=4 94 B9R0.48 CCNC(=O)NCC(=O)N 2708a_100015525214_100000711301 [1,0,1,0,0,0|1,0,1]=4 95 B9R0.48 CCNC(=O)NCC(=O)N 273464a_100000711301_100015525214 [1,0,1,0,0,0|1,0,1]=4 96 B9R0.48 CCNC(=O)NCC(=O)N 273464a_100015525214_100000711301 [1,0,1,0,0,0|1,0,1]=4 97 B9R0.48 CCNC(=O)NCC(=O)N 512a_100015525214_100000711301 [1,0,1,0,0,0|1,0,1]=4 98 B9R0.48 CNCC(=O)NCC(=O)O 269956a_100000183575_200000210301 [1,0,1,0,0,0|2,0,0]=4 99 B9R0.48 CNNC(=O)NCC(=O)N 273464a_100000711301_100016993582 [1,0,1,0,0,0|2,0,0]=4 100 B9R0.48 CNNC(=O)NCC(=O)N 512a_100016993582_100000711301 [1,0,1,0,0,0|2,0,0]=4 101 B9R0.48 [13CH3]NCC(=O)NCC(=O)O 269956a_100000183575_200025704644 [1,0,1,0,0,0|2,0,0]=4 102 B9R0.4 C=CCCC(=O)CC(=O)N 1458a_100000749702_100000187820 [1,0,1,0,0,0|2,0,0]=4 103 B9R0.4 C=CCCC(=O)CC(=O)N 1458a_100134613110_100000754431 [1,0,1,0,0,0|2,0,0]=4 104 B9R0.4 C=CCNC(=O)CC(=O)C 1458a_100000070787_100000183597 [1,0,1,0,0,0|2,0,0]=4 105 B9R0.4 CNCCC(=O)NC(=O)N 2230a_106832991635_100000237605 [1,0,1,0,0,0|2,0,0]=4 106 B9R0.4 CNCCC(=O)NC(=O)N 7a_106832991635_100000237605 [1,0,1,0,0,0|2,0,0]=4 107 B9R0.4 CSCCC(=O)NC(=O)N 62a_200000210301_100000237605 [1,0,1,0,0,0|2,0,0]=4 108 B9R0.4 NC(=O)CC(=O)CCCO 1458a_100134613110_100011215043 [1,0,1,0,0,0|1,0,1]=4 109 B9R0.4 [13CH3]SCCC(=O)NC(=O)N 62a_200025704644_100000237605 [1,0,1,0,0,0|2,0,0]=4 110 B9R0.55 CC(=O)CCNCC(=O)O 269956a_100016091260_100000053229 [1,0,1,0,0,0|1,0,1]=4 111 B9R0.55 CC(=O)OCNCC(=O)O 269956a_100016091260_100000076356 [1,0,1,0,0,0|1,0,1]=4 112 B9R1.34 O=c1cc([nH]c(=O)[nH]1)O 271570a_203496583355_100000015670 [2,0,0,0,0,0|0,0,2]=4 113 B11R0.32 CC(=O)NC(CC(=O)N)C(=O)C 1458a_200000195199_200000210301 [0,1,1,0,0,0|1,0,0]=3 114 B11R0.32 CC(=O)NC(CC(=O)N)C(=O)[13CH3] 1458a_200000195199_200025704644 [0,1,1,0,0,0|1,0,0]=3 115 B11R0.32 CC(=O)N[C@@H](CC(=O)N)C(=O)N 11a_100000143228_100015343762 [0,1,1,0,0,0|1,0,0]=3 116 B11R0.32 CC(=O)N[C@@H](CC(=O)N)C(=O)N 1626a_100000143228_100015343762 [0,1,1,0,0,0|1,0,0]=3 117 B11R0.32 CC(=O)N[C@@H](CC(=O)N)C(=O)N 240690a_100000143228_100015343762 [0,1,1,0,0,0|1,0,0]=3 118 B11R0.32 CC(=O)N[C@@H](CC(=O)N)C(=O)N 527a_100000143228_100103153847 [0,1,1,0,0,0|1,0,0]=3 119 B11R0.39 C=CC[C@@H](NC(=O)C)C(=O)OC 188690a_100020629983_100015343762 [0,1,1,0,0,0|2,0,0]=4 120 B11R0.160 C=CCN[C@@H](CC(=O)N)C(=O)N 2230a_100000143228_100000210623 [0,1,1,0,0,0|2,0,0]=4 121 B11R0.160 CS(=O)C[C@H](NCC=O)C(=O)O 269956a_100009817418_200015260668 [0,1,1,0,0,0|2,0,0]=4 122 B11R0.160 NC(=O)C[C@H](NCC=O)C(=O)N 2230a_100000143228_200015260668 [0,1,1,0,0,0|1,0,0]=3 123 B11R0.33 C[C@@H](NC(=O)CC(=O)N)C(=O)N 240690a_100000119354_100134613110 [0,1,1,0,0,0|2,0,0]=4 124 B11R0.33 C[C@@H](NC(=O)CC(=O)N)C(=O)N 527a_100000119354_100134613110 [0,1,1,0,0,0|2,0,0]=4 125 B11R0.163 C=CCNC(=O)N[C@H](C)C(=O)N 273464a_100000119354_100020586998 [0,1,1,0,0,0|2,0,0]=4 126 B11R0.163 C=CCNC(=O)N[C@H](C)C(=O)N 273464a_100020586998_100000119354 [0,1,1,0,0,0|2,0,0]=4 127 B11R0.163 C=CCNC(=O)N[C@H](C)C(=O)N 512a_100000119354_100020586998 [0,1,1,0,0,0|2,0,0]=4 128 B11R0.163 C=CCNC(=O)N[C@H](C)C(=O)N 512a_100020586998_100000119354 [0,1,1,0,0,0|2,0,0]=4 129 B11R0.163 CCNCC(=O)N[C@@H](C)C(=O)O 269956a_100011417567_100000210202 [0,1,1,0,0,0|1,0,1]=4 130 B11R0.163 C[C@H](NC(=O)CNCF)C(=O)O 269956a_100011417567_100015361967 [0,1,1,0,0,0|1,0,1]=4 131 B11R0.187 C=CCC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000210193 [0,1,1,0,0,0|2,0,0]=4 132 B11R0.187 CC=CC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000210699 [0,1,1,0,0,0|2,0,0]=4 133 B11R0.93 CNC(=O)CC(=O)CCC(=O)N 1458a_100011215257_100000183359 [0,1,1,0,0,0|2,0,0]=4 134 B11R0.93 COC(=O)CC(=O)NCC(=O)N 240690a_100000711301_100000211351 [0,1,1,0,0,0|2,0,0]=4 135 B11R0.107 CNC(=O)CCC(=O)CC(=O)N 1458a_100011309844_100000187820 [0,1,1,0,0,0|2,0,0]=4 136 B11R0.107 COC(=O)CCC(=O)CC(=O)C 1458a_100000070787_100000691467 [0,1,1,0,0,0|2,0,0]=4 137 B11R0.107 COC(=O)CCC(=O)CC(=O)N 1458a_100000187943_100000187820 [0,1,1,0,0,0|1,0,0]=3 138 B11R0.107 COC(=O)CCC(=O)CC(=O)[O-] 1458a_100000187943_100020667443 [0,1,1,0,0,0|2,0,0]=4 139 B11R0.107 COC(=O)CNC(=O)C=C(C)C 188690a_100000185156_100000211388 [0,1,1,0,0,0|2,0,0]=4 140 B11R0.107 COC(=O)CNC(=O)CC(=O)C 1458a_100000070787_100000182966 [0,1,1,0,0,0|1,0,0]=3 141 B11R0.107 COC(=O)NCC(=O)CC(=O)N 1458a_100000215747_100000187820 [0,1,1,0,0,0|2,0,0]=4 142 B11R0.173 CC(C(=O)N)C(=O)CCC(=O)N 1458a_100011215257_100000702099 [0,1,1,0,0,0|2,0,0]=4 143 B11R0.173 NC(=O)CCC(=O)C(F)C(=O)N 1458a_100011215257_100009813875 [0,1,1,0,0,0|2,0,0]=4 144 B13R1.2874 CCC(=O)CC1CC(=O)NC(=O)C1 1458a_100000049033_100000210202 [0,1,0,0,0,1|2,0,0]=4 145 B13R1.2874 CNC(=O)CC1CC(=O)NC(=O)C1 11a_106832991635_100000049033 [0,1,0,0,0,1|2,0,0]=4 146 B13R1.2874 CNC(=O)CC1CC(=O)NC(=O)C1 1626a_100102657272_100000049033 [0,1,0,0,0,1|2,0,0]=4 147 B13R1.2874 CNC(=O)CC1CC(=O)NC(=O)C1 240690a_100102657272_100000049033 [0,1,0,0,0,1|2,0,0]=4 148 B13R1.2874 CNC(=O)CC1CC(=O)NC(=O)C1 527a_100102657272_100000049033 [0,1,0,0,0,1|2,0,0]=4 149 B13R1.2874 O=C(CF)CC1CC(=O)NC(=O)C1 1458a_100000049033_100015361967 [0,1,0,0,0,1|2,0,0]=4 150 B13R1.450 C#CCC(=O)C1CC(=O)NC(=O)C1 1458a_100000044373_100000184674 [0,2,0,0,0,0|2,0,0]=4 151 B13R1.450 C#CCC(=O)[C@@H]1CC(=O)NC(=O)N1 1458a_100000732592_100000184674 [0,2,0,0,0,0|1,0,0]=3 152 B13R1.450 C=CCC(=O)C1CC(=O)NC(=O)C1 1458a_100000044373_100000210623 [0,2,0,0,0,0|2,0,0]=4 153 B13R1.450 C=CCC(=O)[C@@H]1CC(=O)NC(=O)N1 1458a_100000732592_100000210623 [0,2,0,0,0,0|1,0,0]=3 154 B13R1.450 CCCC(=O)C1CC(=O)NC(=O)C1 1458a_100000044373_100000210303 [0,2,0,0,0,0|2,0,0]=4 155 B13R1.450 CCCC(=O)[C@@H]1CC(=O)NC(=O)N1 1458a_100000732592_100000210303 [0,2,0,0,0,0|1,0,0]=3 156 B13R1.450 CCNC(=O)C1CC(=O)NC(=O)C1 11a_100015525214_100000044373 [0,2,0,0,0,0|2,0,0]=4 157 B13R1.450 CCNC(=O)C1CC(=O)NC(=O)C1 240690a_100015525214_100000044373 [0,2,0,0,0,0|2,0,0]=4 158 B13R1.450 CCNC(=O)C1CC(=O)NC(=O)C1 527a_100015525214_100000044373 [0,2,0,0,0,0|2,0,0]=4 159 B13R1.450 CCNC(=O)[C@@H]1CC(=O)NC(=O)N1 240690a_100015525214_100000732592 [0,2,0,0,0,0|1,0,0]=3 160 B13R1.450 CNNC(=O)C1CC(=O)NC(=O)C1 22a_100016993582_100000044373 [0,2,0,0,0,0|2,0,0]=4 161 B13R1.450 CNNC(=O)[C@@H]1CC(=O)NC(=O)N1 22a_100016993582_100000732592 [0,2,0,0,0,0|1,0,0]=3 162 B13R1.450 COCC(=O)N1CC(=O)NC(=O)C1 11a_100000763381_100000210968 [0,2,0,0,0,0|2,0,0]=4 163 B13R1.450 COCC(=O)N1CC(=O)NC(=O)C1 1626a_100000763381_100000210968 [0,2,0,0,0,0|2,0,0]=4 164 B13R1.450 COCC(=O)N1CC(=O)NC(=O)C1 240690a_100000763381_100000210968 [0,2,0,0,0,0|2,0,0]=4 165 B13R1.450 N#CCC(=O)C1CC(=O)NC(=O)C1 1458a_100000044373_100011214920 [0,2,0,0,0,0|2,0,0]=4 166 B13R1.450 N#CCC(=O)[C@@H]1CC(=O)NC(=O)N1 1458a_100000732592_100011214920 [0,2,0,0,0,0|1,0,0]=3 167 B13R1.450 O=C1CC(CC(=O)N1)C(=O)CCF 1458a_100000044373_100011217306 [0,2,0,0,0,0|2,0,0]=4 168 B13R1.450 O=C1CC(CC(=O)N1)C(=O)CCO 1458a_100000044373_100000211926 [0,2,0,0,0,0|1,0,0]=3 169 B13R1.450 O=C1CN(CC(=O)N1)C(=O)CCO 240690a_100000763381_100011216618 [0,2,0,0,0,0|2,0,0]=4 170 B13R1.450 O=C1C[C@H](NC(=O)N1)C(=O)CCF 1458a_100000732592_100011217306 [0,2,0,0,0,0|1,0,0]=3 171 B13R1.450 O=C1C[C@H](NC(=O)N1)C(=O)CCO 1458a_100000732592_100000211926 [0,2,0,0,0,0|0,0,0]=2 172 B13R1.2678 CCC(=O)[C@@H]1CC(=O)N(C(=O)N1)C 1458a_100015231322_100000210202 [0,2,0,0,0,0|1,0,0]=3 173 B13R1.2678 CN1C(=O)C[C@H](NC1=O)C(=O)CF 1458a_100015231322_100015361967 [0,2,0,0,0,0|1,0,0]=3 174 B13R1.2678 CNC(=O)[C@@H]1CC(=O)N(C(=O)N1)C 1626a_100102657272_100015231322 [0,2,0,0,0,0|1,0,0]=3 175 B13R1.2678 CNC(=O)[C@@H]1CC(=O)N(C(=O)N1)C 240690a_100102657272_100015231322 [0,2,0,0,0,0|1,0,0]=3 176 B13R1.4789 COC(=O)c1[nH]c(=O)[nH]c(=O)c1O 271570a_203496583355_100010177026 [0,2,0,0,0,0|0,0,2]=4 177 B11R1.645 CC(=O)CC1NC(=O)NC1=O 1458a_100000187923_200000210301 [0,0,1,1,0,0|2,0,0]=4 178 B11R1.645 CC(=O)NC1CC(=O)NC1=O 11a_100102712934_100015343762 [0,0,1,1,0,0|2,0,0]=4 179 B11R1.645 CC(=O)NC1CC(=O)NC1=O 240690a_100102712934_100015343762 [0,0,1,1,0,0|2,0,0]=4 180 B11R1.645 [13CH3]C(=O)CC1NC(=O)NC1=O 1458a_100000187923_200025704644 [0,0,1,1,0,0|2,0,0]=4 181 B11R1.152 NC(=O)CC(=O)[C@@H]1CC(=O)N1 1458a_100016090685_100000187820 [0,0,1,1,0,0|2,0,0]=4 182 B9R0.7 C=C(C)C(=O)NCC(=O)C 1458a_100000076187_200000210301 [0,0,1,0,1,0|2,0,0]=4 183 B9R0.7 C=C(C)C(=O)NCC(=O)N 11a_100000711301_100000185857 [0,0,1,0,1,0|2,0,0]=4 184 B9R0.7 C=C(C)C(=O)NCC(=O)[13CH3] 1458a_100000076187_200025704644 [0,0,1,0,1,0|2,0,0]=4 185 B9R0.7 CC(=O)C(C)NCC(=O)O 269956a_100016091260_100009814033 [0,0,1,0,1,0|1,0,1]=4 186 B9R0.7 NC(=O)CNC(=O)C(=O)N 240690a_100000711301_100011215815 [0,0,1,0,1,0|2,0,0]=4 187 B9R0.53 CC(=O)CC(=O)NC(=O)C 1458a_100000070787_100000183797 [0,0,1,0,1,0|1,0,0]=3 188 B9R0.53 CC(=O)CC(=O)NC(=O)N 1458a_100000070787_100000182717 [0,0,1,0,1,0|1,0,0]=3 189 B9R0.53 NC(=O)CC(=O)CC(=O)N 1458a_100134613110_100000187820 [0,0,1,0,1,0|2,0,0]=4 190 B9R0.53 NC(=O)CC(=O)CC(=O)[O-] 1458a_100134613110_100020667443 [0,0,1,0,1,0|1,0,1]=4 191 B9R1.22 CNC1CC(=O)NC1=O 2230a_100102712934_200000210301 [1,0,0,0,1,0|2,0,0]=4 192 B9R1.22 [13CH3]NC1CC(=O)NC1=O 2230a_100102712934_200025704644 [1,0,0,0,1,0|2,0,0]=4 193 B9R1.35 CC(=O)C1CCC(=O)N1 1458a_100000210400_200000210301 [1,0,0,0,1,0|1,0,1]=4 194 B9R1.35 CC(=O)C1CNC(=O)C1 1458a_100000747279_200000210301 [1,0,0,0,1,0|1,0,1]=4 195 B9R1.35 CC(=O)C1CNC(=O)N1 1458a_100000033324_200000210301 [1,0,0,0,1,0|1,0,0]=3 196 B9R1.35 CC(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_200000210301 [1,0,0,0,1,0|2,0,0]=4 197 B9R1.35 [13CH3]C(=O)C1CCC(=O)N1 1458a_100000210400_200025704644 [1,0,0,0,1,0|1,0,1]=4 198 B9R1.35 [13CH3]C(=O)C1CNC(=O)C1 1458a_100000747279_200025704644 [1,0,0,0,1,0|1,0,1]=4 199 B9R1.35 [13CH3]C(=O)C1CNC(=O)N1 1458a_100000033324_200025704644 [1,0,0,0,1,0|1,0,0]=3 200 B9R1.35 [13CH3]C(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_200025704644 [1,0,0,0,1,0|2,0,0]=4 201 B11R0.146 CCC[C@H](NCC(=O)N)C(=O)O 269956a_100000750406_100000187820 [0,0,1,0,0,1|1,0,1]=4 202 B11R0.146 COC[C@@H](NCC(=O)N)C(=O)O 269956a_100011998655_100000187820 [0,0,1,0,0,1|2,0,0]=4 203 B11R0.146 CSC[C@H](NCC(=O)N)C(=O)O 269956a_100011421858_100000187820 [0,0,1,0,0,1|2,0,0]=4 204 B11R0.146 C[Se]C[C@H](NCC(=O)N)C(=O)O 269956a_100015254316_100000187820 [0,0,1,0,0,1|2,0,0]=4 205 B11R0.141 C=COC(=O)CN[C@@H](C)C(=O)O 269956a_100000743915_100000036128 [0,0,1,0,0,1|2,0,0]=4 206 B11R0.141 CCNC(=O)CN[C@@H](C)C(=O)O 269956a_100000743915_100000183381 [0,0,1,0,0,1|1,0,1]=4 207 B11R0.141 C[C@H](NCC(=O)NCO)C(=O)O 269956a_100000743915_100000185155 [0,0,1,0,0,1|0,0,2]=4 208 B11R0.6 C=C(C)CSCC(=O)NC(=O)N 62a_100000748629_100000182717 [0,0,1,0,0,1|2,0,0]=4 209 B11R0.6 C=C(F)CSCC(=O)NC(=O)N 62a_100000042424_100000182717 [0,0,1,0,0,1|2,0,0]=4 210 B11R0.6 CC(=O)CCCC(=O)CC(=O)N 1458a_100134613110_100011215641 [0,0,1,0,0,1|2,0,0]=4 211 B11R0.6 CC(=O)CCOC(=O)NC(=O)N 1458a_100000070787_100000054987 [0,0,1,0,0,1|1,0,0]=3 212 B11R0.6 CC(=O)NC(=O)CNCC(=O)O 269956a_100016091260_100000183797 [0,0,1,0,0,1|0,0,0]=2 213 B11R0.6 CC(=O)NC(=O)CSCC(=O)N 62a_100000747473_100000183797 [0,0,1,0,0,1|2,0,0]=4 214 B11R0.6 CC(=O)NC(=O)CSCC(=O)[O-] 62a_100020667443_100000183797 [0,0,1,0,0,1|1,0,1]=4 215 B11R0.6 CC(=O)NCCC(=O)CC(=O)N 1458a_100000183196_100000187820 [0,0,1,0,0,1|2,0,0]=4 216 B11R0.6 CC(=O)NCCC(=O)CC(=O)N 1458a_100134613110_100000189650 [0,0,1,0,0,1|2,0,0]=4 217 B11R0.6 CC(=O)OCCC(=O)CC(=O)N 1458a_100134613110_100009814007 [0,0,1,0,0,1|2,0,0]=4 218 B11R0.6 CC(=O)SCCC(=O)CC(=O)N 1458a_100000048949_100000187820 [0,0,1,0,0,1|2,0,0]=4 219 B11R0.6 CC(C)NC(=O)CNCC(=O)O 269956a_100016091260_100000183996 [0,0,1,0,0,1|1,0,1]=4 220 B11R0.6 CC(O)CNCC(=O)NC(=O)N 2230a_100000210904_100000182717 [0,0,1,0,0,1|1,0,1]=4 221 B11R0.6 CC(O)CSCC(=O)NC(=O)N 62a_100011218427_100000182717 [0,0,1,0,0,1|1,0,1]=4 222 B11R0.6 C[C@@H](O)CSCC(=O)NC(=O)N 62a_100009817552_100000182717 [0,0,1,0,0,1|1,0,1]=4 223 B11R0.6 NC(=O)CC(=O)CCNC(=O)N 1458a_100000181464_100000187820 [0,0,1,0,0,1|2,0,0]=4 224 B11R0.6 NC(=O)CC(=O)CCNC(=O)N 1458a_100134613110_200000034859 [0,0,1,0,0,1|2,0,0]=4 225 B11R0.6 NC(=O)CC(=O)CCOC(=O)N 1458a_100134613110_200011214921 [0,0,1,0,0,1|2,0,0]=4 226 B11R0.6 NC(=O)CCCC(=O)CC(=O)N 1458a_100134613110_100102525003 [0,0,1,0,0,1|2,0,0]=4 227 B11R0.6 NC(=O)CCNC(=O)CC(=O)N 240690a_100000740010_100134613110 [0,0,1,0,0,1|2,0,0]=4 228 B11R0.6 NC(=O)CCNC(=O)CC(=O)N 527a_100000740010_100134613110 [0,0,1,0,0,1|2,0,0]=4 229 B11R0.6 NC(=O)CNCC(=O)NC(=O)N 2230a_100000711301_100000182717 [0,0,1,0,0,1|1,0,0]=3 230 B11R0.6 NC(=O)COCC(=O)CC(=O)N 1458a_100011219004_100000187820 [0,0,1,0,0,1|2,0,0]=4 231 B11R0.6 NC(=O)CSCC(=O)NC(=O)N 62a_100000747473_100000182717 [0,0,1,0,0,1|1,0,0]=3 232 B11R0.6 NC(=O)NC(=O)CSCC(=O)[O-] 62a_100020667443_100000182717 [0,0,1,0,0,1|0,0,1]=3 233 B11R0.85 C=C(C)CCC(=O)CNC(=O)N 1458a_100000184981_100000730704 [0,0,1,0,0,1|2,0,0]=4 234 B11R0.85 C=C(C)CCC(=O)NCC(=O)N 11a_100000711301_200000688413 [0,0,1,0,0,1|2,0,0]=4 235 B11R0.85 C=C(C)CCC(=O)NCC(=O)N 240690a_100000711301_200000688413 [0,0,1,0,0,1|2,0,0]=4 236 B11R0.85 C=C(C)CCC(=O)NCC(=O)N 527a_100000711301_200000688413 [0,0,1,0,0,1|2,0,0]=4 237 B11R0.85 C=C(C)CNC(=O)CNC(=O)C 11a_100000765925_100000194580 [0,0,1,0,0,1|2,0,0]=4 238 B11R0.85 C=C(C)CNC(=O)CNC(=O)C 1626a_100000765925_100000194580 [0,0,1,0,0,1|2,0,0]=4 239 B11R0.85 C=C(C)CNC(=O)CNC(=O)C 240690a_100000765925_100000194580 [0,0,1,0,0,1|2,0,0]=4 240 B11R0.85 C=C(C)CNC(=O)CNC(=O)C 527a_100000765925_100000194580 [0,0,1,0,0,1|2,0,0]=4 241 B11R0.85 C=C(C)CNC(=O)NCC(=O)N 2708a_100000765925_100000711301 [0,0,1,0,0,1|2,0,0]=4 242 B11R0.85 C=C(C)CNC(=O)NCC(=O)N 273464a_100000711301_100000765925 [0,0,1,0,0,1|2,0,0]=4 243 B11R0.85 C=C(C)CNC(=O)NCC(=O)N 273464a_100000765925_100000711301 [0,0,1,0,0,1|2,0,0]=4 244 B11R0.85 C=C(C)CNC(=O)NCC(=O)N 512a_100000765925_100000711301 [0,0,1,0,0,1|2,0,0]=4 245 B11R0.85 C=C(C)CNC(=O)NNC(=O)C 273464a_100000765925_100000189765 [0,0,1,0,0,1|2,0,0]=4 246 B11R0.85 C=C(C)CNC(=O)NNC(=O)C 512a_100000189765_100000765925 [0,0,1,0,0,1|2,0,0]=4 247 B11R0.85 CC(=O)CCC(=O)NCC(=O)N 1458a_200011309861_200000210301 [0,0,1,0,0,1|1,0,0]=3 248 B11R0.85 CC(=O)CNC(=O)CNC(=O)C 1458a_100000195220_200000210301 [0,0,1,0,0,1|1,0,0]=3 249 B11R0.85 CC(=O)NCC(=O)NCC(=O)N 11a_100000711301_100000194580 [0,0,1,0,0,1|1,0,0]=3 250 B11R0.85 CC(=O)NCC(=O)NCC(=O)N 240690a_100000711301_100000194580 [0,0,1,0,0,1|1,0,0]=3 251 B11R0.85 CC(=O)NCC(=O)NCC(=O)N 527a_100000711301_100000194580 [0,0,1,0,0,1|1,0,0]=3 252 B11R0.85 CC(=O)NCC(=O)NCC(=O)[13CH3] 1458a_100000195220_200025704644 [0,0,1,0,0,1|1,0,0]=3 253 B11R0.85 CC(=O)NCC(=O)NCC(C)O 11a_100000210904_100000194580 [0,0,1,0,0,1|1,0,1]=4 254 B11R0.85 CC(=O)NCC(=O)NCC(C)O 240690a_100000210904_100000194580 [0,0,1,0,0,1|1,0,1]=4 255 B11R0.85 CC(=O)NCC(=O)NCC(C)O 527a_100000210904_100000194580 [0,0,1,0,0,1|1,0,1]=4 256 B11R0.85 CC(=O)NCC(=O)NNC(=O)C 22a_100000189765_100000194580 [0,0,1,0,0,1|2,0,0]=4 257 B11R0.85 CC(=O)NNC(=O)CCC(=O)N 22a_100000189765_100011215257 [0,0,1,0,0,1|2,0,0]=4 258 B11R0.85 CC(=O)NNC(=O)NCC(=O)N 273464a_100000711301_100000189765 [0,0,1,0,0,1|1,0,0]=3 259 B11R0.85 CC(=O)NNC(=O)NCC(=O)N 512a_100000189765_100000711301 [0,0,1,0,0,1|1,0,0]=3 260 B11R0.85 CC(=O)NNC(=O)NCC(C)O 273464a_100000210904_100000189765 [0,0,1,0,0,1|1,0,1]=4 261 B11R0.85 CC(=O)NNC(=O)NCC(C)O 512a_100000189765_100000210904 [0,0,1,0,0,1|1,0,1]=4 262 B11R0.85 CC(=O)OCC(=O)NCC(=O)N 240690a_100000711301_100000183556 [0,0,1,0,0,1|2,0,0]=4 263 B11R0.85 CC(=O)OCC(=O)NCC(=O)N 527a_100000711301_100000183556 [0,0,1,0,0,1|2,0,0]=4 264 B11R0.85 CC(=O)SCC(=O)NCC(=O)N 11a_100000711301_100000049016 [0,0,1,0,0,1|2,0,0]=4 265 B11R0.85 CC(=O)SCC(=O)NCC(=O)N 240690a_100000711301_100000049016 [0,0,1,0,0,1|2,0,0]=4 266 B11R0.85 CC(C)NCC(=O)NCC(=O)O 269956a_100000183575_100000210206 [0,0,1,0,0,1|1,0,1]=4 267 B11R0.85 CC(O)CCC(=O)CNC(=O)N 1458a_100000184981_100012276601 [0,0,1,0,0,1|1,0,1]=4 268 B11R0.85 NC(=O)CCC(=O)NCC(=O)N 240690a_100000711301_100011215257 [0,0,1,0,0,1|1,0,0]=3 269 B11R0.85 NC(=O)CCC(=O)NCC(=O)N 527a_100000711301_100011215257 [0,0,1,0,0,1|1,0,0]=3 270 B11R0.85 NC(=O)CNC(=O)CC[N+](=O)[O-] 11a_100000711301_200000064761 [0,0,1,0,0,1|1,0,1]=4 271 B11R0.85 NC(=O)CNC(=O)CC[N+](=O)[O-] 240690a_100000711301_200000064761 [0,0,1,0,0,1|1,0,1]=4 272 B11R0.85 NC(=O)CNC(=O)CNC(=O)N 240690a_100000711301_100000184981 [0,0,1,0,0,1|2,0,0]=4 273 B11R0.85 NC(=O)CNC(=O)CNC(=O)N 527a_100000711301_100000184981 [0,0,1,0,0,1|2,0,0]=4 274 B11R0.85 NC(=O)CNC(=O)CSC(=O)N 240690a_100000711301_200015941356 [0,0,1,0,0,1|2,0,0]=4 275 B11R0.85 NC(=O)CNC(=O)NCC(=O)N 273464a_100000711301_100000711301 [0,0,1,0,0,1|2,0,0]=4 276 B11R0.85 [13CH3]C(=O)CCC(=O)NCC(=O)N 1458a_200011309861_200025704644 [0,0,1,0,0,1|1,0,0]=3 277 B11R1.166 CC(=O)C1CCC(=O)NC1=O 1458a_100000070787_100000694648 [0,0,0,0,1,1|1,0,0]=3