0 B22R1.96208 C/C=C(\C)/C(=O)CCCCCNC(=O)OCc1ccccc1 1458a_100020587367_100010169184 [0,0,0,0,0,0|2,0,1]=3 1 B21R1.43353 CC=CC(=O)CCCCCNC(=O)OCc1ccccc1 1458a_100000210699_100010169184 [1,0,0,0,0,0|2,0,1]=4 2 B21R1.43353 CCOC(=O)CCCCCNC(=O)C=Cc1ccccc1 188690a_100000062434_100000210462 [1,0,0,0,0,0|2,0,1]=4 3 B21R1.615428 C=C(C)C(=O)CCCCCNC(=O)OCc1ccccc1 1458a_100000185857_100010169184 [1,0,0,0,0,0|2,0,1]=4 4 B23R1.1334916 CC/C=C(\C)/C(=O)CCCCCNC(=O)OCc1ccccc1 1458a_100016988807_100010169184 [0,1,0,0,0,0|2,0,1]=4 5 B23R2.162939 C/C=C(\C)/C(=O)C[C@@H]1CCCN1C(=O)OCc2ccccc2 1458a_100020587367_100000731952 [0,0,0,1,0,0|2,0,1]=4 6 B21R1.66497 C/C=C(\C)/C(=O)NCCCCC(=O)OCc1ccccc1 188690a_100000699574_100020587367 [0,0,0,0,1,0|1,0,1]=3 7 B23R1.93318 C/C=C(\C)/C(=O)CCCCCCNC(=O)OCc1ccccc1 1458a_100020587367_100010188950 [0,0,0,0,0,1|2,0,1]=4 8 B20R1.80340 COC(=O)CCCCCNC(=O)C=Cc1ccccc1 188690a_100000184999_100000210462 [2,0,0,0,0,0|2,0,0]=4 9 B22R1.137263 C=C(C)C(=O)OCCC(=O)CNC(=O)/C=C/c1ccccc1 1458a_100000183125_100009816335 [1,1,0,0,0,0|1,0,1]=4 10 B22R2.880 C/C=C(\C)/C(=O)N1CCCC1C(=O)NCc2ccccc2 11a_100103152920_100020587367 [0,0,0,1,1,0|1,0,1]=4 11 B22R2.880 C/C=C(\C)/C(=O)N1CCCC1C(=O)NCc2ccccc2 1626a_100103152920_100020587367 [0,0,0,1,1,0|1,0,1]=4 12 B22R2.880 C/C=C(\C)/C(=O)N1CCC[C@H]1C(=O)OCc2ccccc2 11a_100000014697_100020587367 [0,0,0,1,1,0|1,0,1]=4 13 B22R2.880 C/C=C(\C)/C(=O)N1CCC[C@H]1C(=O)OCc2ccccc2 1626a_100000014697_100020587367 [0,0,0,1,1,0|1,0,1]=4 14 B24R2.37130 C/C=C(\C)/C(=O)N1CCCC(C1)NC(=O)OCc2ccccc2 11a_100000067403_100020587367 [0,1,0,1,0,0|1,0,1]=4 15 B24R2.37130 C/C=C(\C)/C(=O)N1CCCC(C1)NC(=O)OCc2ccccc2 1626a_100000067403_100020587367 [0,1,0,1,0,0|1,0,1]=4 16 B20R1.3861 CC=CC(=O)NCCCCC(=O)OCc1ccccc1 188690a_100000699574_100000210699 [1,0,0,0,1,0|1,0,1]=4 17 B20R1.3861 CCOC(=O)CCCCNC(=O)C=Cc1ccccc1 188690a_100000718961_100000210462 [1,0,0,0,1,0|1,0,1]=4 18 B20R1.31552 C=C(C)C(=O)NCCCCC(=O)OCc1ccccc1 188690a_100000699574_100000185857 [1,0,0,0,1,0|1,0,1]=4 19 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)C#Cc1ccccc1 240690a_100016987756_100000736102 [1,0,0,0,1,0|0,0,2]=4 20 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccc1 11a_100016987756_100000210462 [1,0,0,0,1,0|0,0,0]=2 21 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccn1 11a_100016987756_100000740811 [1,0,0,0,1,0|1,0,0]=3 22 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccn1 240690a_100016987756_100000740811 [1,0,0,0,1,0|1,0,0]=3 23 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccnc1 11a_100016987756_100000735890 [1,0,0,0,1,0|1,0,0]=3 24 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccnc1 240690a_100016987756_100000735890 [1,0,0,0,1,0|1,0,0]=3 25 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccncc1 240690a_100016987756_100000682801 [1,0,0,0,1,0|1,0,0]=3 26 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)CCc1ccccc1 11a_100016987756_100000185753 [1,0,0,0,1,0|0,0,2]=4 27 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)CCc1ccccc1 240690a_100016987756_100000185753 [1,0,0,0,1,0|0,0,2]=4 28 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)CCc1ccccc1 527a_100016987756_100000185753 [1,0,0,0,1,0|0,0,2]=4 29 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)COc1ccccc1 11a_100016987756_100000186222 [1,0,0,0,1,0|1,0,1]=4 30 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)COc1ccccc1 240690a_100016987756_100000186222 [1,0,0,0,1,0|1,0,1]=4 31 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)COc1ccccc1 527a_100016987756_100000186222 [1,0,0,0,1,0|1,0,1]=4 32 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)CSc1ccccc1 11a_100016987756_100000211596 [1,0,0,0,1,0|1,0,1]=4 33 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)CSc1ccccc1 240690a_100016987756_100000211596 [1,0,0,0,1,0|1,0,1]=4 34 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)CSc1ccccc1 527a_100016987756_100000211596 [1,0,0,0,1,0|1,0,1]=4 35 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)NCc1ccccc1 2708a_100015324214_100016987756 [1,0,0,0,1,0|1,0,1]=4 36 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)NCc1ccccc1 273464a_100015324214_100016987756 [1,0,0,0,1,0|1,0,1]=4 37 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)NCc1ccccc1 273464a_100016987756_100015324214 [1,0,0,0,1,0|1,0,1]=4 38 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)NCc1ccccc1 512a_100015324214_100016987756 [1,0,0,0,1,0|1,0,1]=4 39 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)NCc1ccccc1 512a_100016987756_100015324214 [1,0,0,0,1,0|1,0,1]=4 40 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)NNc1ccccc1 273464a_100016987756_100015195140 [1,0,0,0,1,0|2,0,0]=4 41 B20R1.31552 C=C(C)C(=O)NCCCNC(=O)NNc1ccccc1 512a_100016987756_100015195140 [1,0,0,0,1,0|2,0,0]=4 42 B20R1.8948 C/C=C(\C)/C(=O)CCCNC(=O)OCc1ccccc1 1458a_100020587367_100012340047 [0,0,0,0,2,0|1,0,1]=4 43 B20R1.8948 C/C=C(\C)/C(=O)NCCCC(=O)OCc1ccccc1 188690a_100102628731_100020587367 [0,0,0,0,2,0|1,0,1]=4 44 B21R1.8118 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccc1Br 11a_100016987756_100000719032 [1,1,0,0,1,0|0,0,0]=3 45 B21R1.8118 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccc1Br 240690a_100016987756_100000719032 [1,1,0,0,1,0|0,0,0]=3 46 B21R1.8118 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccc1Cl 11a_100016987756_100000720304 [1,1,0,0,1,0|0,0,0]=3 47 B21R1.8118 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccc1Cl 240690a_100016987756_100000720304 [1,1,0,0,1,0|0,0,0]=3 48 B21R1.8118 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccc1F 11a_100016987756_100016256065 [1,1,0,0,1,0|0,0,0]=3 49 B21R1.8118 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccccc1F 240690a_100016987756_100016256065 [1,1,0,0,1,0|0,0,0]=3 50 B21R1.35488 C=C(C)C(=O)NCCCNC(=O)C=C(C)c1ccccc1 11a_100016987756_100000743005 [1,1,0,0,1,0|0,0,0]=3 51 B21R1.35488 C=C(C)C(=O)NCCCNC(=O)C=C(C)c1ccccc1 240690a_100016987756_100000743005 [1,1,0,0,1,0|0,0,0]=3 52 B21R1.35488 C=C(C)C(=O)NCCCNC(=O)C=C(C)c1ccccc1 527a_100016987756_100000743005 [1,1,0,0,1,0|0,0,0]=3 53 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)Br 11a_100016987756_100016267368 [1,1,0,0,1,0|0,0,0]=3 54 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)C 11a_100016987756_100000716854 [1,1,0,0,1,0|0,0,0]=3 55 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)C 240690a_100016987756_100000716854 [1,1,0,0,1,0|0,0,0]=3 56 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)Cl 11a_100016987756_100000184863 [1,1,0,0,1,0|0,0,0]=3 57 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)Cl 240690a_100016987756_100000184863 [1,1,0,0,1,0|0,0,0]=3 58 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)F 11a_100016987756_100000182136 [1,1,0,0,1,0|0,0,0]=3 59 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)F 240690a_100016987756_100000182136 [1,1,0,0,1,0|0,0,0]=3 60 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)I 11a_100016987756_100102526154 [1,1,0,0,1,0|0,0,0]=3 61 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)I 240690a_100016987756_100102526154 [1,1,0,0,1,0|0,0,0]=3 62 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cc1)O 240690a_100016987756_100016269017 [1,1,0,0,1,0|0,0,0]=3 63 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cn1)F 11a_100016987756_100020630499 [1,1,0,0,1,0|1,0,0]=4 64 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(cn1)F 240690a_100016987756_100020630499 [1,1,0,0,1,0|1,0,0]=4 65 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(nc1)Br 11a_100016987756_100020588214 [1,1,0,0,1,0|1,0,0]=4 66 B21R1.59979 C=C(C)C(=O)NCCCNC(=O)C=Cc1ccc(nc1)Br 240690a_100016987756_100020588214 [1,1,0,0,1,0|1,0,0]=4 67 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C/c1ccccc1)/C 11a_100016987756_100016990649 [1,1,0,0,1,0|0,0,0]=3 68 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C/c1ccccc1)/C 527a_100016987756_100016990649 [1,1,0,0,1,0|0,0,0]=3 69 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C/c1ccccc1)/Cl 11a_100016987756_200020598536 [1,1,0,0,1,0|0,0,0]=3 70 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C/c1ccccc1)/Cl 240690a_100016987756_200020598536 [1,1,0,0,1,0|0,0,0]=3 71 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C/c1ccccc1)/Cl 527a_100016987756_200020598536 [1,1,0,0,1,0|0,0,0]=3 72 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C/c1ccccn1)/C 11a_100016987756_100025712827 [1,1,0,0,1,0|1,0,0]=4 73 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C/c1ccccn1)/C 527a_100016987756_100025712827 [1,1,0,0,1,0|1,0,0]=4 74 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C\c1ccccc1)/F 11a_100016987756_100020889036 [1,1,0,0,1,0|0,0,0]=3 75 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)/C(=C\c1ccccc1)/F 527a_100016987756_100020889036 [1,1,0,0,1,0|0,0,0]=3 76 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)C(=C)Cc1ccccc1 11a_100016987756_100000066491 [1,1,0,0,1,0|0,0,1]=4 77 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)C(=Cc1cccnc1)F 11a_100016987756_100000731744 [1,1,0,0,1,0|1,0,0]=4 78 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)C(=Cc1cccnc1)F 240690a_100016987756_100000731744 [1,1,0,0,1,0|1,0,0]=4 79 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)C(=Cc1cccnc1)F 527a_100016987756_100000731744 [1,1,0,0,1,0|1,0,0]=4 80 B21R1.121505 C=C(C)C(=O)NCCCNC(=O)C(=O)Nc1ccccc1 240690a_100016987756_100000738435 [1,1,0,0,1,0|1,0,0]=4 81 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)Br 11a_100016987756_100016258244 [1,1,0,0,1,0|0,0,0]=3 82 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)Br 240690a_100016987756_100016258244 [1,1,0,0,1,0|0,0,0]=3 83 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)C 11a_100016987756_100000690095 [1,1,0,0,1,0|0,0,0]=3 84 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)C 240690a_100016987756_100000690095 [1,1,0,0,1,0|0,0,0]=3 85 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)Cl 11a_100016987756_100000184502 [1,1,0,0,1,0|0,0,0]=3 86 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)Cl 240690a_100016987756_100000184502 [1,1,0,0,1,0|0,0,0]=3 87 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)F 11a_100016987756_100000718793 [1,1,0,0,1,0|0,0,0]=3 88 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)F 240690a_100016987756_100000718793 [1,1,0,0,1,0|0,0,0]=3 89 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)I 11a_100016987756_100020647043 [1,1,0,0,1,0|0,0,0]=3 90 B21R1.534725 C=C(C)C(=O)NCCCNC(=O)C=Cc1cccc(c1)I 240690a_100016987756_100020647043 [1,1,0,0,1,0|0,0,0]=3 91 B21R1.615930 C=C(C)C(=O)NCCCNS(=O)(=O)C=Cc1ccccc1 40a_100016987756_100011098038 [1,1,0,0,1,0|1,0,0]=4 92 B21R2.32935 CN(C)C(=O)[C@@H]1CCCN1C(=O)C=Cc2ccccc2 11a_100020603401_100000210462 [1,0,0,1,1,0|1,0,0]=4 93 B21R2.32935 CN(C)C(=O)[C@@H]1CCCN1C(=O)C=Cc2ccccc2 1626a_100020603401_100000210462 [1,0,0,1,1,0|1,0,0]=4 94 B21R2.257566 C=C(C)C(=O)NCCCNc1ccc2ccccc2n1 27a_100016987756_100011291633 [1,0,0,1,1,0|1,0,0]=4 95 B21R2.1424 C/C=C(\C)/C(=O)N1CCC[C@H]1C(=O)Nc2ccccc2 11a_100102887412_100020587367 [0,0,0,1,2,0|1,0,0]=4 96 B21R2.1424 C/C=C(\C)/C(=O)N1CCC[C@H]1C(=O)Nc2ccccc2 1626a_100102887412_100020587367 [0,0,0,1,2,0|1,0,0]=4 97 B23R2.178110 O=C(C=Cc1ccccc1)NCCCCN2C(=O)C=CC2=O 11a_200020646982_100000210462 [1,1,0,1,0,0|0,0,1]=4 98 B23R2.178110 O=C(C=Cc1ccccc1)NCCCCN2C(=O)C=CC2=O 1626a_200020646982_100000210462 [1,1,0,1,0,0|0,0,1]=4 99 B23R2.49018 CC(C)C(=O)N1CCCC(C1)NC(=O)C=Cc2ccccc2 11a_100011448207_100000210462 [1,1,0,1,0,0|0,0,1]=4 100 B23R2.49018 CC(C)C(=O)N1CCCC(C1)NC(=O)C=Cc2ccccc2 1626a_100011448207_100000210462 [1,1,0,1,0,0|0,0,1]=4 101 B23R2.49018 CN(C)C(=O)N1CCCC(C1)NC(=O)C=Cc2ccccc2 11a_103436538495_100000210462 [1,1,0,1,0,0|1,0,0]=4 102 B23R2.49018 CN(C)C(=O)N1CCCC(C1)NC(=O)C=Cc2ccccc2 1626a_103436538495_100000210462 [1,1,0,1,0,0|1,0,0]=4