General Information of the Compound
| Compound ID |
CP0406676
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| Compound Name |
7-hydroxy-4-(2-(6-methylpyridin-2-yl)ethyl)-2H-chromen-2-one
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| Structure |
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| Formula |
C17H15NO3
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| Molecular Weight |
281.311
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| Canonical SMILES |
Cc1cccc(CCc2cc(=O)oc3cc(O)ccc23)n1
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| InChI |
InChI=1S/C17H15NO3/c1-11-3-2-4-13(18-11)6-5-12-9-17(20)21-16-10-14(19)7-8-15(12)16/h2-4,7-10,19H,5-6H2,1H3
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| InChIKey |
LDCRVNBWINORDP-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