General Information of the Compound
| Compound ID |
CP0513121
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| Compound Name |
ethyl 7-[(3-chlorophenyl)methoxy]-2-oxochromene-3-carboxylate
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| Structure |
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| Formula |
C19H15ClO5
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| Molecular Weight |
358.777
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| Canonical SMILES |
CCOC(=O)c1cc2ccc(OCc3cccc(Cl)c3)cc2oc1=O
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| InChI |
InChI=1S/C19H15ClO5/c1-2-23-18(21)16-9-13-6-7-15(10-17(13)25-19(16)22)24-11-12-4-3-5-14(20)8-12/h3-10H,2,11H2,1H3
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| InChIKey |
MMWXNBGCSAZEPR-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