General Information of the Compound
| Compound ID |
CP0180398
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| Compound Name |
7-((6-Chloropyridin-3-yl)methoxy)-5-hydroxy-2-phenyl-4H-chromen-4-one
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| Structure |
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| Formula |
C21H14ClNO4
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| Molecular Weight |
379.799
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| Canonical SMILES |
Oc1cc(OCc2ccc(Cl)nc2)cc2oc(cc(=O)c12)-c1ccccc1
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| InChI |
InChI=1S/C21H14ClNO4/c22-20-7-6-13(11-23-20)12-26-15-8-16(24)21-17(25)10-18(27-19(21)9-15)14-4-2-1-3-5-14/h1-11,24H,12H2
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| InChIKey |
DJPYQBQSEJWOGU-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