General Information of the Compound
| Compound ID |
CP0445439
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| Compound Name |
1-(3-(2-methylquinolin-7-yl)phenyl)ethanone
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| Synonyms |
1-(3-(2-methylquinolin-7-yl)phenyl)ethanone
CHEMBL233370
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| Structure |
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| Formula |
C18H15NO
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| Molecular Weight |
261.324
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| Canonical SMILES |
CC(=O)c1cccc(c1)-c1ccc2ccc(C)nc2c1
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| InChI |
InChI=1S/C18H15NO/c1-12-6-7-14-8-9-17(11-18(14)19-12)16-5-3-4-15(10-16)13(2)20/h3-11H,1-2H3
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| InChIKey |
RDDPBRGDKLSJLB-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
Clinical Information about the Compound