General Information of the Compound
| Compound ID |
CP0041792
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| Compound Name |
2,3-Dihydro-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
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| Structure |
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| Formula |
C15H12O3
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| Molecular Weight |
240.258
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| Canonical SMILES |
Oc1ccc(cc1)C1CC(=O)c2ccccc2O1
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| InChI |
InChI=1S/C15H12O3/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-8,15-16H,9H2
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| InChIKey |
ZLHVIYHWWQYJID-UHFFFAOYSA-N
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| CAS |
6515-37-3
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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: PT01279, Adenosine receptor A3
Protein ID: PT06109, Geminin