General Information of the Compound
| Compound ID |
CP0445715
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| Compound Name |
3-[2-fluoro-4-[[7-(2-methoxyethoxy)-3,4-dihydro-2H-chromen-2-yl]methoxy]phenyl]propanoic acid
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| Structure |
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| Formula |
C22H25FO6
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| Molecular Weight |
404.434
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| Canonical SMILES |
COCCOc1ccc2CCC(COc3ccc(CCC(O)=O)c(F)c3)Oc2c1
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| InChI |
InChI=1S/C22H25FO6/c1-26-10-11-27-18-7-3-16-4-8-19(29-21(16)13-18)14-28-17-6-2-15(20(23)12-17)5-9-22(24)25/h2-3,6-7,12-13,19H,4-5,8-11,14H2,1H3,(H,24,25)
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| InChIKey |
WQSFORLFVYVCSQ-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