General Information of the Compound
| Compound ID |
CP0288742
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| Compound Name |
4-(4-chloro-2-cyclohexylphenoxy)butanoic acid
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| Synonyms |
4-(4-chloro-2-cyclohexylphenoxy)butanoic acid
BDBM50213928
CHEMBL394496
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| Structure |
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| Formula |
C16H21ClO3
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| Molecular Weight |
296.794
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| Canonical SMILES |
OC(=O)CCCOc1ccc(Cl)cc1C1CCCCC1
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| InChI |
InChI=1S/C16H21ClO3/c17-13-8-9-15(20-10-4-7-16(18)19)14(11-13)12-5-2-1-3-6-12/h8-9,11-12H,1-7,10H2,(H,18,19)
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| InChIKey |
BDEUQTBTFVDWEA-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