General Information of the Compound
| Compound ID |
CP0885387
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| Compound Name |
3-(4-((3-(3,5-dimethylisoxazol-4-yl)-5-ethoxybenzyl)oxy)-2-fluorophenyl)propanoic acid
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| Structure |
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| Formula |
C23H24FNO5
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| Molecular Weight |
413.445
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| Canonical SMILES |
CCOc1cc(COc2ccc(CCC(=O)O)c(F)c2)cc(-c2c(C)noc2C)c1
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| InChI |
InChI=1S/C23H24FNO5/c1-4-28-20-10-16(9-18(11-20)23-14(2)25-30-15(23)3)13-29-19-7-5-17(21(24)12-19)6-8-22(26)27/h5,7,9-12H,4,6,8,13H2,1-3H3,(H,26,27)
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| InChIKey |
ZNNLKTSPOXLOST-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound