0 B14R1.42 CC(O)C=Cc1ccc(c(c1)C#N)O AIFCHEM-6359704076 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.42 CC(O)C=Cc1ccc(c(c1)CN)O AIFCHEM-5641015266 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.42 CCc1cc(ccc1F)C=CC(C)O AIFCHEM-6368065433 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.42 CCc1cc(ccc1O)C=CC(C)O AIFCHEM-6309383863 [0,0,0,0,0,0|1,0,2]=3 4 B14R1.42 COc1cc(ccc1C)C=CC(C)O AIFCHEM-6357993115 [0,0,0,0,0,0|1,0,2]=3 5 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F AIFCHEM-6047279791 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O AIFCHEM-94535592243 [1,0,0,0,0,0|1,0,1]=3 7 B13R1.511 CC(O)C=Cc1ccc(c(c1)F)O AIFCHEM-6274210590 [1,0,0,0,0,0|1,0,2]=4 8 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)O AIFCHEM-6368210826 [1,0,0,0,0,0|0,0,2]=3 9 B13R1.511 Cc1ccc(cc1O)C=CC(C)O AIFCHEM-6353214399 [1,0,0,0,0,0|1,0,2]=4 10 B13R1.575 CCNCc1ccc(c(c1)OC)O AIFCHEM-94537413052 [1,0,0,0,0,0|1,0,2]=4 11 B13R1.643 CNc1cccc(c1)C=CC(C)O AIFCHEM-94597171854 [1,0,0,0,0,0|1,0,2]=4 12 B15R1.392 COc1cc(cc(c1O)O)C=CC(C)O AIFCHEM-6256676919 [0,1,0,0,0,0|0,0,2]=3 13 B15R1.531 CNCc1cc(ccc1O)C=CC(C)O AIFCHEM-6033711044 [0,1,0,0,0,0|1,0,2]=4 14 B15R1.4027 CCc1cc(ccc1O)C=CC(C)(C)O AIFCHEM-6310081527 [0,1,0,0,0,0|1,0,2]=4 15 B15R1.12854 CCc1cc(ccc1CO)C=CC(C)O AIFCHEM-6375000360 [0,1,0,0,0,0|1,0,2]=4 16 B15R1.12854 COc1cc(ccc1C=O)C=CC(C)O AIFCHEM-6295633936 [0,1,0,0,0,0|0,0,3]=4 17 B15R1.12854 COc1ccc(cc1OC)C=CC(C)O AIFCHEM-6300235653 [0,1,0,0,0,0|0,0,2]=3 18 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C AIFCHEM-94605354390 [0,1,0,0,0,0|1,0,1]=3 19 B15R1.12854 COc1ccc(nc1OC)C=CC(C)O AIFCHEM-6422769404 [0,1,0,0,0,0|1,0,2]=4 20 B15R2.7688 CC(O)C=Cc1ccc2c(c1)OCO2 AIFCHEM-6354273153 [0,0,0,1,0,0|0,0,2]=3 21 B13R1.52 CC(=Cc1ccc(c(c1)C=O)O)C AIFCHEM-6312947168 [0,0,0,0,1,0|3,0,0]=4 22 B13R1.52 CC(=Cc1ccc(c(c1)CN)O)C AIFCHEM-5659313066 [0,0,0,0,1,0|3,0,0]=4 23 B13R1.52 COc1cc(ccc1Br)NC(=O)C AIFCHEM-6215120655 [0,0,0,0,1,0|2,0,0]=3 24 B13R1.52 COc1cc(ccc1N)C=C(C)C AIFCHEM-5750864117 [0,0,0,0,1,0|2,0,0]=3 25 B13R1.52 COc1cc(ncc1I)NC(=O)C AIFCHEM-6077323923 [0,0,0,0,1,0|3,0,0]=4 26 B12R1.21 CC(O)C=Cc1ccc(cc1)O AIFCHEM-94601033022 [2,0,0,0,0,0|0,0,2]=4 27 B12R1.385 OCC=Cc1ccc(c(c1)O)O AIFCHEM-6413125974 [2,0,0,0,0,0|0,0,2]=4 28 B12R1.286 CC=Cc1ccc(c(c1)CN)O AIFCHEM-5660679463 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.286 CC=Cc1ccc(c(c1)NC)F AIFCHEM-5843997786 [2,0,0,0,0,0|2,0,0]=4 30 B12R1.286 CC=Cc1ccc(c(c1)NC)N AIFCHEM-6363724941 [2,0,0,0,0,0|2,0,0]=4 31 B12R1.286 CC=Cc1ccc(c(c1)OC)O AIFCHEM-6360952734 [2,0,0,0,0,0|0,0,0]=2 32 B12R1.286 CC=Cc1ccc(c(n1)OC)O AIFCHEM-6323484763 [2,0,0,0,0,0|1,0,0]=3 33 B12R1.286 CC=Cc1cnc(c(c1)OC)N AIFCHEM-5724752859 [2,0,0,0,0,0|2,0,0]=4 34 B12R1.286 CCNc1ccc(c(c1)OC)O AIFCHEM-94537422385 [2,0,0,0,0,0|1,0,1]=4 35 B14R1.684 CC(C)(O)C=Cc1ccc(c(c1)O)O AIFCHEM-6312109662 [1,1,0,0,0,0|0,0,2]=4 36 B14R1.684 Cc1cc(ccc1O)C=CC(C)(C)O AIFCHEM-6311747988 [1,1,0,0,0,0|0,0,2]=4 37 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)O)O AIFCHEM-94605337230 [1,1,0,0,0,0|1,0,1]=4 38 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)O AIFCHEM-94526503165 [1,1,0,0,0,0|1,0,1]=4 39 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)O AIFCHEM-94532678370 [1,1,0,0,0,0|1,0,1]=4 40 B14R1.6036 Cc1cc(c(cc1O)C)C=CC(C)O AIFCHEM-6303494260 [1,1,0,0,0,0|0,0,2]=4 41 B14R1.15552 CC(O)C=Cc1cc(c(c(c1)F)O)O AIFCHEM-6368624223 [1,1,0,0,0,0|0,0,2]=4 42 B14R1.15552 CC(O)C=Cc1cc(c(c(c1)O)O)O AIFCHEM-6475270799 [1,1,0,0,0,0|0,0,2]=4 43 B14R1.907 CCCC=Cc1ccc(c(c1)OC)N AIFCHEM-5742709271 [1,1,0,0,0,0|1,0,1]=4 44 B14R1.907 CCCC=Cc1ccc(c(c1)OC)O AIFCHEM-6395533732 [1,1,0,0,0,0|0,0,1]=3 45 B14R1.7499 COc1cc(cc(c1O)O)C=CCO AIFCHEM-6194267857 [1,1,0,0,0,0|0,0,2]=4 46 B14R1.75 COc1cccc(c1)CN(C)C(=O)C AIFCHEM-5677985105 [1,1,0,0,0,0|1,0,1]=4 47 B14R1.81 COc1cccc(c1O)CNC(=O)C AIFCHEM-94605344911 [1,1,0,0,0,0|1,0,1]=4 48 B14R1.376 COc1cc(cc(c1)C=CC(C)O)N AIFCHEM-6105281020 [1,1,0,0,0,0|0,0,2]=4 49 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F AIFCHEM-94535600885 [1,1,0,0,0,0|1,0,1]=4 50 B14R1.468 COCc1cccc(c1)C=CC(C)O AIFCHEM-6442293647 [1,1,0,0,0,0|0,0,2]=4 51 B14R1.2162 COc1cccc(c1)C=CC(C)(C)O AIFCHEM-94547742811 [1,1,0,0,0,0|0,0,2]=4 52 B14R1.2335 COc1ccc(c(c1)C=CC(C)O)C AIFCHEM-6296326025 [1,1,0,0,0,0|0,0,2]=4 53 B14R1.2335 COc1ccc(c(c1)C=CC(C)O)O AIFCHEM-6347511154 [1,1,0,0,0,0|0,0,2]=4 54 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C AIFCHEM-5776597559 [0,1,0,0,1,0|2,0,0]=4 55 B14R1.343 COc1cc(cc(c1O)O)C=C(C)C AIFCHEM-6260426356 [0,1,0,0,1,0|1,0,0]=3 56 B14R1.439 CC=Cc1cc(ccc1O)NC(=O)C AIFCHEM-92182185137 [0,1,0,0,1,0|2,0,0]=4 57 B14R1.439 CNCc1cc(ccc1O)C=C(C)C AIFCHEM-6072907125 [0,1,0,0,1,0|2,0,0]=4 58 B14R1.439 COCc1cc(ccc1F)C=C(C)C AIFCHEM-6381388368 [0,1,0,0,1,0|2,0,0]=4 59 B14R1.705 CC(=O)Nc1ccc(c(c1)C(=O)C)O AIFCHEM-94535596879 [0,1,0,0,1,0|2,0,0]=4 60 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C AIFCHEM-94605358186 [0,1,0,0,1,0|2,0,0]=4 61 B14R1.881 COc1cc(c(cc1F)Br)NC(=O)C AIFCHEM-94535596405 [0,1,0,0,1,0|2,0,0]=4 62 B14R1.3651 COc1cc(ccc1CN)C=C(C)C AIFCHEM-6194214084 [0,1,0,0,1,0|2,0,0]=4 63 B14R1.3651 COc1cc(ccc1CO)C=C(C)C AIFCHEM-6406154968 [0,1,0,0,1,0|1,0,0]=3 64 B14R1.3651 COc1ccc(cc1OC)NC(=O)C AIFCHEM-6033371770 [0,1,0,0,1,0|1,0,0]=3 65 B14R1.3651 COc1ccc(nc1OC)C=C(C)C AIFCHEM-6397658338 [0,1,0,0,1,0|2,0,0]=4 66 B16R1.4709 COc1cc(ccc1O)C(=O)NCC(=O)C AIFCHEM-6057883813 [0,1,0,0,0,1|0,0,1]=3 67 B16R1.423 COc1cc(cc(c1O)OC)CNC(=O)C AIFCHEM-94535596941 [0,2,0,0,0,0|1,0,1]=4 68 B16R1.11597 COc1cc(cc(c1O)O)C=CC(C)(C)O AIFCHEM-6194632432 [0,2,0,0,0,0|0,0,2]=4 69 B16R1.10273 CCOc1cc(ccc1OC)C=CC(C)O AIFCHEM-6352029918 [0,2,0,0,0,0|0,0,2]=4 70 B16R1.20040 COc1cc(c(cc1OC)C=CC(C)O)O AIFCHEM-6227080933 [0,2,0,0,0,0|0,0,2]=4 71 B16R1.84799 COc1cc(ccc1CO)C=CC(C)(C)O AIFCHEM-6431516871 [0,2,0,0,0,0|0,0,2]=4 72 B16R1.4763 CCN(Cc1ccc(c(c1)OC)O)C(=O)C AIFCHEM-94685527495 [0,2,0,0,0,0|1,0,1]=4 73 B16R1.15083 CC#CC(=O)NCc1ccc(c(c1)OC)O AIFCHEM-6175905566 [0,2,0,0,0,0|1,0,1]=4 74 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)O AIFCHEM-6127297092 [0,2,0,0,0,0|1,0,1]=4 75 B14R1.3662 COc1ccc(c(c1O)O)C=C(C)C AIFCHEM-6433789471 [0,0,1,1,0,0|2,0,0]=4 76 B14R2.10591 Cc1cc(ccc1O)C=CC2CC2 AIFCHEM-94569116515 [1,0,0,1,0,0|1,0,1]=4 77 B14R2.10591 Oc1ccc(cc1O)C=CC2CC2 AIFCHEM-6295661194 [1,0,0,1,0,0|1,0,1]=4 78 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCC2 AIFCHEM-94535597703 [0,0,0,1,1,0|2,0,0]=4 79 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 AIFCHEM-94605351261 [0,0,0,1,1,0|1,0,0]=3 80 B16R2.2324 CCc1cc(ccc1O)c2csc(c2)C AIFCHEM-6309751033 [0,0,0,1,0,1|2,0,0]=4 81 B16R2.2324 CCc1cc(ccc1O)c2nc(cs2)C AIFCHEM-94523460737 [0,0,0,1,0,1|2,0,0]=4 82 B16R2.2324 CCc1cc(ccc1O)c2ncc(s2)C AIFCHEM-94523457805 [0,0,0,1,0,1|1,1,0]=4 83 B16R2.2324 COc1cc(ccc1C)c2cnc([nH]2)C AIFCHEM-6292388170 [0,0,0,1,0,1|2,0,0]=4 84 B16R2.2324 COc1cc(ccc1N)c2c[nH]c(n2)C AIFCHEM-6298273331 [0,0,0,1,0,1|2,0,0]=4 85 B16R2.2324 COc1cc(ccc1N)c2ccc(s2)C AIFCHEM-6337016813 [0,0,0,1,0,1|1,1,0]=4 86 B16R2.2324 COc1cc(ccc1N)c2cnc(s2)C AIFCHEM-6408432794 [0,0,0,1,0,1|1,1,0]=4 87 B16R2.2324 COc1cc(ccc1N)c2csc(c2)C AIFCHEM-5750760247 [0,0,0,1,0,1|2,0,0]=4 88 B16R2.2324 COc1cc(ccc1O)c2cc([nH]n2)C AIFCHEM-6327079540 [0,0,0,1,0,1|2,0,0]=4 89 B16R2.2324 COc1cc(ccc1O)c2ccc(s2)C AIFCHEM-6298052421 [0,0,0,1,0,1|0,1,0]=3 90 B16R2.2324 COc1cc(ccc1O)c2ccn(n2)C AIFCHEM-6395578920 [0,0,0,1,0,1|2,0,0]=4 91 B16R2.2324 COc1cc(ccc1O)c2cnn(n2)C AIFCHEM-6302258684 [0,0,0,1,0,1|2,0,0]=4 92 B16R2.2324 COc1cc(ccc1O)c2ncc(s2)C AIFCHEM-6375077340 [0,0,0,1,0,1|0,1,0]=3 93 B16R2.2324 COc1cc(ccc1O)c2ncn(n2)C AIFCHEM-6316072354 [0,0,0,1,0,1|2,0,0]=4 94 B16R2.2324 COc1cc(ccc1O)c2nnc(o2)C AIFCHEM-94583462415 [0,0,0,1,0,1|1,0,1]=4 95 B16R2.2324 COc1cc(ccc1O)c2nnc(s2)C AIFCHEM-6306122428 [0,0,0,1,0,1|1,1,0]=4 96 B16R2.2324 COc1nc(ccc1O)c2ccc(o2)C AIFCHEM-6323443126 [0,0,0,1,0,1|1,0,1]=4 97 B16R2.26496 COc1cc(cc(c1O)O)C=CC2CC2 AIFCHEM-6260459565 [0,1,0,1,0,0|1,0,1]=4 98 B16R2.82843 CC(C)(O)C=Cc1ccc2c(c1)OCO2 AIFCHEM-6290792558 [0,1,0,1,0,0|0,0,2]=4 99 B16R2.83537 CC(O)C=Cc1ccc2c(c1F)OCO2 AIFCHEM-6370825033 [0,1,0,1,0,0|0,0,2]=4 100 B16R2.83537 Cc1c(ccc2c1OCO2)C=CC(C)O AIFCHEM-6365415132 [0,1,0,1,0,0|0,0,2]=4 101 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C AIFCHEM-6398326996 [1,0,0,0,1,0|1,0,0]=3 102 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br AIFCHEM-5608066263 [1,0,0,0,1,0|2,0,0]=4 103 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O AIFCHEM-94527206242 [1,0,0,0,1,0|1,0,0]=3 104 B12R1.19 CC(=O)Nc1ccc(c(c1)I)O AIFCHEM-94605357326 [1,0,0,0,1,0|2,0,0]=4 105 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O AIFCHEM-94535592055 [1,0,0,0,1,0|1,0,0]=3 106 B12R1.438 COc1cc(ccn1)NC(=O)C AIFCHEM-94535593514 [1,0,0,0,1,0|2,0,0]=4 107 B12R1.438 CSc1cccc(c1)NC(=O)C AIFCHEM-94535592741 [1,0,0,0,1,0|1,1,0]=4