General Information of the Compound
| Compound ID |
CP0970360
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| Compound Name |
3-((7-methyl-3-oxo-2,3-dihydrobenzofuran-6-yloxy)methyl)benzoic acid
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| Structure |
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| Formula |
C17H14O5
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| Molecular Weight |
298.294
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| Canonical SMILES |
Cc1c(OCc2cccc(C(=O)O)c2)ccc2c1OCC2=O
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| InChI |
InChI=1S/C17H14O5/c1-10-15(6-5-13-14(18)9-22-16(10)13)21-8-11-3-2-4-12(7-11)17(19)20/h2-7H,8-9H2,1H3,(H,19,20)
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| InChIKey |
STSFXRYLJQVPDW-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