clofibrate   Click here for help

GtoPdb Ligand ID: 2667

Synonyms: Atromid-S® | AY-61123 | ICI-28257
Approved drug
clofibrate is an approved drug (FDA (1967))
Compound class: Synthetic organic
Comment: The marketing of many formulations of clifobrate has been discontinued
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 35.53
Molecular weight 242.07
XLogP 3.32
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CCOC(=O)C(Oc1ccc(cc1)Cl)(C)C
Isomeric SMILES CCOC(=O)C(Oc1ccc(cc1)Cl)(C)C
InChI InChI=1S/C12H15ClO3/c1-4-15-11(14)12(2,3)16-10-7-5-9(13)6-8-10/h5-8H,4H2,1-3H3
InChI Key KNHUKKLJHYUCFP-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1967))
IUPAC Name Click here for help
Ethyl 2-(4-chlorophenoxy)-2-methylpropanoate
International Nonproprietary Names Click here for help
INN number INN
1530 clofibrate
Synonyms Click here for help
Atromid-S® | AY-61123 | ICI-28257
Database Links Click here for help
CAS Registry No. 637-07-0 (source: SciFinder)
ChEBI CHEBI:3750
ChEMBL Ligand CHEMBL565
DrugBank Ligand DB00636
DrugCentral Ligand 694
GtoPdb PubChem SID 135650110
PubChem CID 2796
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Wikipedia Clofibrate

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Tocris
Clofibrate
Cat. No. 0824