0 B16R2.3356 CC(O)CCn1nc2cnccn2c1=O CSC012451164 [0,0,0,0,0,0|2,0,1]=3 1 B15R2.1660 OC(=O)CCN1Cc2ccccc2C1 CSC015183805 [1,0,0,0,0,0|2,0,1]=4 2 B17R2.4042 CC(C)(O)CCn1nc2cnccn2c1=O CSC006120752 [0,1,0,0,0,0|2,0,1]=4 3 B15R1.1078 CN(CCC(=O)O)C(=O)c1ccccc1 CSC011389132 [0,0,1,0,0,0|2,0,0]=3 4 B15R1.1078 CN(CCC(=O)O)C(=O)c1ccccn1 CSC011389119 [0,0,1,0,0,0|3,0,0]=4 5 B15R1.1078 CN(CCC(=O)O)C(=O)c1cccnc1 CSC011389126 [0,0,1,0,0,0|3,0,0]=4 6 B15R1.1078 CN(CCC(=O)O)C(=O)c1ccncc1 CSC011389122 [0,0,1,0,0,0|3,0,0]=4 7 B15R1.8019 Cc1cccnc1C(=O)NCCC(=O)O CSC011647371 [0,0,1,0,0,0|3,0,0]=4 8 B15R1.8019 Cc1ccncc1C(=O)NCCC(=O)O CSC019693584 [0,0,1,0,0,0|3,0,0]=4 9 B15R1.8019 Cc1ncccc1C(=O)NCCC(=O)O CSC012692618 [0,0,1,0,0,0|3,0,0]=4 10 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1Cl CSC000003379 [0,0,1,0,0,0|3,0,0]=4 11 B15R1.8019 Nc1ccccc1C(=O)NCCC(=O)O CSC011430125 [0,0,1,0,0,0|1,0,1]=3 12 B15R1.8019 OC(=O)CCNC(=O)c1ccccc1Br CSC000195278 [0,0,1,0,0,0|2,0,0]=3 13 B15R1.8019 OC(=O)CCNC(=O)c1ccccc1O CSC000725735 [0,0,1,0,0,0|2,0,0]=3 14 B15R2.629 OC(=O)Cn1sc2ccccc2c1=O CSC000721788 [0,0,0,0,1,0|2,0,0]=3 15 B17R2.40403 OC(=O)CSc1nc2ccccc2c(=O)[nH]1 CSC016300018 [0,0,0,0,0,1|3,0,0]=4 16 B17R2.155580 CC(O)CCn1nnc2ccccc2c1=O CSC005567452 [0,0,0,0,0,1|2,0,1]=4 17 B14R1.420 OC(=O)CCNC(=O)c1cccnc1 CSC011191979 [1,0,1,0,0,0|2,0,0]=4 18 B14R2.44 O=c1n(nc2n1cccc2)CC#N CSC000748925 [2,0,0,0,0,0|1,0,1]=4 19 B16R1.760 CCN(CCC(=O)O)C(=O)c1ccccc1 CSC011395395 [0,1,1,0,0,0|2,0,0]=4 20 B16R1.1027 CN(CCC(=O)O)C(=O)c1ccc(cc1)C CSC011389135 [0,1,1,0,0,0|2,0,0]=4 21 B16R1.1027 CN(CCC(=O)O)C(=O)c1ccc(cc1)Cl CSC011389124 [0,1,1,0,0,0|2,0,0]=4 22 B16R1.1027 CN(CCC(=O)O)C(=O)c1ccc(cc1)F CSC011389123 [0,1,1,0,0,0|2,0,0]=4 23 B16R1.1027 CN(CCC(=O)O)C(=O)c1ccc(cc1)I CSC011389225 [0,1,1,0,0,0|2,0,0]=4 24 B16R1.4127 CC(CN(C)C(=O)c1ccccc1)C(=O)O CSC011509845 [0,1,1,0,0,0|2,0,0]=4 25 B16R1.10818 CN(CCC(=O)O)C(=O)c1ccccc1Br CSC011389117 [0,1,1,0,0,0|2,0,0]=4 26 B16R1.10818 CN(CCC(=O)O)C(=O)c1ccccc1C CSC011389140 [0,1,1,0,0,0|2,0,0]=4 27 B16R1.10818 CN(CCC(=O)O)C(=O)c1ccccc1Cl CSC011389118 [0,1,1,0,0,0|2,0,0]=4 28 B16R1.10818 CN(CCC(=O)O)C(=O)c1ccccc1F CSC011389131 [0,1,1,0,0,0|2,0,0]=4 29 B16R1.10818 CN(CCC(=O)O)C(=O)c1ccccc1I CSC011389136 [0,1,1,0,0,0|2,0,0]=4 30 B16R1.10818 CN(CCC(=O)O)C(=O)c1ccccc1O CSC011389125 [0,1,1,0,0,0|2,0,0]=4 31 B16R1.11187 CN(CCC(=O)O)C(=O)c1cccc(c1)Br CSC011389166 [0,1,1,0,0,0|2,0,0]=4 32 B16R1.11187 CN(CCC(=O)O)C(=O)c1cccc(c1)C CSC011389145 [0,1,1,0,0,0|2,0,0]=4 33 B16R1.11187 CN(CCC(=O)O)C(=O)c1cccc(c1)Cl CSC011389128 [0,1,1,0,0,0|2,0,0]=4 34 B16R1.11187 CN(CCC(=O)O)C(=O)c1cccc(c1)I CSC011389223 [0,1,1,0,0,0|2,0,0]=4 35 B16R1.12306 CC(=O)N(CCC(=O)O)Cc1ccccc1 CSC000025152 [0,1,1,0,0,0|2,0,0]=4 36 B16R1.7437 CC(CC(=O)O)NC(=O)c1ccccc1Br CSC000195609 [0,1,1,0,0,0|2,0,0]=4 37 B16R1.7437 CC(CC(=O)O)NC(=O)c1ccccc1C CSC000195639 [0,1,1,0,0,0|2,0,0]=4 38 B16R1.7437 CC(CC(=O)O)NC(=O)c1ccccc1Cl CSC000195610 [0,1,1,0,0,0|2,0,0]=4 39 B16R1.7437 CC(CC(=O)O)NC(=O)c1ccccc1I CSC000195658 [0,1,1,0,0,0|2,0,0]=4 40 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)O)C CSC000195321 [0,1,1,0,0,0|2,0,0]=4 41 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)O)F CSC011692620 [0,1,1,0,0,0|2,0,0]=4 42 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)O)O CSC011208170 [0,1,1,0,0,0|2,0,0]=4 43 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)O)Br CSC012257196 [0,1,1,0,0,0|2,0,0]=4 44 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)O)Cl CSC013122936 [0,1,1,0,0,0|2,0,0]=4 45 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)O)F CSC011593155 [0,1,1,0,0,0|2,0,0]=4 46 B16R1.10819 CC(CNC(=O)c1ccccc1Br)C(=O)O CSC011724651 [0,1,1,0,0,0|2,0,0]=4 47 B16R1.10819 CC(CNC(=O)c1ccccc1C)C(=O)O CSC011724674 [0,1,1,0,0,0|2,0,0]=4 48 B16R1.10819 CC(CNC(=O)c1ccccc1Cl)C(=O)O CSC011724652 [0,1,1,0,0,0|2,0,0]=4 49 B16R1.10819 CC(CNC(=O)c1ccccc1I)C(=O)O CSC011724670 [0,1,1,0,0,0|2,0,0]=4 50 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)O)Cl CSC014170670 [0,1,1,0,0,0|2,0,0]=4 51 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)O)F CSC017957690 [0,1,1,0,0,0|2,0,0]=4 52 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)O)I CSC019598930 [0,1,1,0,0,0|2,0,0]=4 53 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(=O)O CSC014094957 [0,1,1,0,0,0|2,0,0]=4 54 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(=O)O CSC000195300 [0,1,1,0,0,0|2,0,0]=4 55 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(=O)O CSC013044652 [0,1,1,0,0,0|2,0,0]=4 56 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(=O)O CSC012924675 [0,1,1,0,0,0|2,0,0]=4 57 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(=O)O CSC012904911 [0,1,1,0,0,0|2,0,0]=4 58 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(=O)O CSC011222734 [0,1,1,0,0,0|2,0,0]=4 59 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)O)Br CSC011327881 [0,1,1,0,0,0|2,0,0]=4 60 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)O)Cl CSC014322800 [0,1,1,0,0,0|2,0,0]=4 61 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)O)F CSC013328087 [0,1,1,0,0,0|2,0,0]=4 62 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(=O)O CSC013046535 [0,1,1,0,0,0|2,0,0]=4 63 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(=O)O CSC000195324 [0,1,1,0,0,0|2,0,0]=4 64 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(=O)O CSC014124540 [0,1,1,0,0,0|2,0,0]=4 65 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(=O)O CSC012720784 [0,1,1,0,0,0|2,0,0]=4 66 B16R1.11442 Nc1ccc(c(c1)Cl)C(=O)NCCC(=O)O CSC010170815 [0,1,1,0,0,0|2,0,0]=4 67 B16R1.16971 COC(=O)CCNC(=O)c1ccccc1N CSC000260291 [0,1,1,0,0,0|1,0,1]=4 68 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)O)C CSC013216097 [0,1,1,0,0,0|2,0,0]=4 69 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)O)I CSC006543705 [0,1,1,0,0,0|2,0,0]=4 70 B16R2.2272 COCCCn1nc2cnccn2c1=O CSC060895422 [1,1,0,0,0,0|1,0,1]=4 71 B18R2.9347 COC(=O)CCn1nnc2ccccc2c1=O CSC000279894 [0,1,0,0,0,1|1,0,0]=3 72 B18R2.9347 NNC(=O)CCn1cnc2ccccc2c1=O CSC000507564 [0,1,0,0,0,1|2,0,0]=4 73 B14R1.417 CN(CC(=O)O)C(=O)c1ccccc1 CSC000194983 [0,0,1,0,1,0|2,0,0]=4 74 B16R1.7414 Cc1ccccc1CC(=O)NCCC(=O)O CSC000195361 [0,0,1,0,0,1|2,0,0]=4 75 B16R1.7414 Cc1ccccc1NC(=O)NCCC(=O)O CSC011428468 [0,0,1,0,0,1|2,0,0]=4 76 B16R1.7414 OC(=O)CCNC(=O)Cc1ccccc1Br CSC006342339 [0,0,1,0,0,1|2,0,0]=4 77 B16R1.7414 OC(=O)CCNC(=O)Cc1ccccc1Cl CSC000195338 [0,0,1,0,0,1|2,0,0]=4 78 B16R1.7414 OC(=O)CCNC(=O)Cc1ccccc1F CSC000195356 [0,0,1,0,0,1|2,0,0]=4 79 B16R1.7414 OC(=O)CCNC(=O)Cc1ccccc1I CSC017286328 [0,0,1,0,0,1|2,0,0]=4 80 B16R1.7414 OC(=O)CCNC(=O)Cn1ccccc1=O CSC017197678 [0,0,1,0,0,1|1,0,0]=3 81 B16R1.10817 Cc1ccccc1C(=O)NCCCC(=O)O CSC000194769 [0,0,1,0,0,1|2,0,0]=4 82 B16R1.10817 Nc1ccccc1C(=O)NCCCC(=O)O CSC005501492 [0,0,1,0,0,1|1,0,1]=4 83 B16R1.10817 OC(=O)CCCNC(=O)c1ccccc1Br CSC000194743 [0,0,1,0,0,1|2,0,0]=4 84 B16R1.10817 OC(=O)CCCNC(=O)c1ccccc1Br CSC000194743 [0,0,1,0,0,1|2,0,0]=4 85 B16R1.10817 OC(=O)CCCNC(=O)c1ccccc1F CSC000194789 [0,0,1,0,0,1|2,0,0]=4 86 B16R1.10817 OC(=O)CCCNC(=O)c1ccccc1I CSC000194786 [0,0,1,0,0,1|2,0,0]=4 87 B16R1.10817 OC(=O)CCCNC(=O)c1ccccc1O CSC011193993 [0,0,1,0,0,1|2,0,0]=4 88 B16R2.2942 OCCCn1cnc2ccccc2c1=O CSC000732409 [1,0,0,0,0,1|1,0,1]=4 89 B16R2.2942 OCCCn1nnc2ccccc2c1=O CSC011320292 [1,0,0,0,0,1|1,0,1]=4 90 B18R2.63530 OC(=O)CCSc1nc2ccccc2c(=O)[nH]1 CSC016300019 [0,0,0,0,0,2|2,0,0]=4