General Information of the Compound
| Compound ID |
CP0545329
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| Compound Name |
4-Oxo-2-[4-(quinolin-2-ylmethoxy)-phenyl]-4H-chromene-8-carboxylic acid
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| Structure |
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| Formula |
C26H17NO5
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| Molecular Weight |
423.424
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| Canonical SMILES |
OC(=O)c1cccc2c1oc(cc2=O)-c1ccc(OCc2ccc3ccccc3n2)cc1
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| InChI |
InChI=1S/C26H17NO5/c28-23-14-24(32-25-20(23)5-3-6-21(25)26(29)30)17-9-12-19(13-10-17)31-15-18-11-8-16-4-1-2-7-22(16)27-18/h1-14H,15H2,(H,29,30)
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| InChIKey |
CPQMZGGGIONSEK-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