General Information of the Compound
| Compound ID |
CP0194849
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| Compound Name |
7-((6-chloropyridin-3-yl)methoxy)-3-(4-methoxyphenyl)-4H-chromen-4-one
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| Structure |
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| Formula |
C22H16ClNO4
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| Molecular Weight |
393.826
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| Canonical SMILES |
COc1ccc(cc1)-c1coc2cc(OCc3ccc(Cl)nc3)ccc2c1=O
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| InChI |
InChI=1S/C22H16ClNO4/c1-26-16-5-3-15(4-6-16)19-13-28-20-10-17(7-8-18(20)22(19)25)27-12-14-2-9-21(23)24-11-14/h2-11,13H,12H2,1H3
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| InChIKey |
CBJFSNDHRCKUEV-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