General Information of the Compound
| Compound ID |
CP0557911
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| Compound Name |
4-(3,4-dihydro-2H-chromen-2-ylmethoxy)-1-(3-methylphenyl)pyridin-2-one
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| Structure |
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| Formula |
C22H21NO3
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| Molecular Weight |
347.414
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| Canonical SMILES |
Cc1cccc(c1)-n1ccc(OCC2CCc3ccccc3O2)cc1=O
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| InChI |
InChI=1S/C22H21NO3/c1-16-5-4-7-18(13-16)23-12-11-19(14-22(23)24)25-15-20-10-9-17-6-2-3-8-21(17)26-20/h2-8,11-14,20H,9-10,15H2,1H3
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| InChIKey |
YRKXISBGLRTDHT-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