General Information of the Compound
| Compound ID |
CP0401578
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| Compound Name |
3-(4-methoxyphenyl)-6-methyl-2H-chromen-2-one
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| Synonyms |
113769-77-0
3-(4-Methoxyphenyl)-6-methyl-3-chromene-2-one
3-(4-methoxyphenyl)-6-methyl-2H-chromen-2-one
3-(4-methoxyphenyl)-6-methylcoumarin
BDBM50300894
CHEMBL572233
SCHEMBL17857190
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| Structure |
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| Formula |
C17H14O3
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| Molecular Weight |
266.296
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| Canonical SMILES |
COc1ccc(cc1)-c1cc2cc(C)ccc2oc1=O
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| InChI |
InChI=1S/C17H14O3/c1-11-3-8-16-13(9-11)10-15(17(18)20-16)12-4-6-14(19-2)7-5-12/h3-10H,1-2H3
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| InChIKey |
IXPFLPLQVXPBGF-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
Clinical Information about the Compound