phenindione   Click here for help

GtoPdb Ligand ID: 6838

Synonyms: Dindevan® | phenylindanedione
Approved drug PDB Ligand
phenindione is an approved drug (FDA (approval date not available))
Compound class: Synthetic organic
Comment: Vitamin K epoxide reductase complex subunit 1 isoform 1 inhibitor
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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 1
Topological polar surface area 34.14
Molecular weight 222.07
XLogP 2.72
No. Lipinski's rules broken 0
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Canonical SMILES O=C1C(c2ccccc2)C(=O)c2c1cccc2
Isomeric SMILES O=C1C(c2ccccc2)C(=O)c2c1cccc2
InChI InChI=1S/C15H10O2/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9,13H
Selectivity at enzymes
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
vitamin K epoxide reductase complex subunit 1 Primary target of this compound Hs Inhibitor Inhibition - - - 1-2