General Information of the Compound
| Compound ID |
CP0535665
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| Compound Name |
5-(1-Hydroxy-naphthalen-2-yl)-pentanoic acid ethyl ester
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| Structure |
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| Formula |
C17H20O3
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| Molecular Weight |
272.344
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| Canonical SMILES |
CCOC(=O)CCCCc1ccc2ccccc2c1O
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| InChI |
InChI=1S/C17H20O3/c1-2-20-16(18)10-6-4-8-14-12-11-13-7-3-5-9-15(13)17(14)19/h3,5,7,9,11-12,19H,2,4,6,8,10H2,1H3
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| InChIKey |
BJYQCDMXMKBCEV-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