General Information of the Compound
| Compound ID |
CP0421736
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| Compound Name |
3-(2'-Methoxyphenyl)-1H-naphtho[2,1-b]pyran-1-one
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| Structure |
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| Formula |
C20H14O3
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| Molecular Weight |
302.329
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| Canonical SMILES |
COc1ccccc1-c1cc(=O)c2c(ccc3ccccc23)o1
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| InChI |
InChI=1S/C20H14O3/c1-22-17-9-5-4-8-15(17)19-12-16(21)20-14-7-3-2-6-13(14)10-11-18(20)23-19/h2-12H,1H3
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| InChIKey |
PCTZJHHURYBJOH-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