General Information of the Compound
| Compound ID |
CP0417644
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| Compound Name |
7-hydroxy-3-(4-hydroxy-2-methylphenyl)-4-methylchromen-2-one
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| Structure |
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| Formula |
C17H14O4
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| Molecular Weight |
282.295
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| Canonical SMILES |
Cc1cc(O)ccc1-c1c(C)c2ccc(O)cc2oc1=O
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| InChI |
InChI=1S/C17H14O4/c1-9-7-11(18)3-5-13(9)16-10(2)14-6-4-12(19)8-15(14)21-17(16)20/h3-8,18-19H,1-2H3
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| InChIKey |
WDVKEIUBEHNEBS-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
Protein ID: PT00886, Estrogen receptor
Protein ID: PT00889, Estrogen receptor beta