9-phenanthrol   Click here for help

GtoPdb Ligand ID: 4114

Compound class: Synthetic organic
Comment: Inhibitor of TRPM4 [2].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 0
Hydrogen bond donors 1
Rotatable bonds 0
Topological polar surface area 20.23
Molecular weight 194.07
XLogP 4.15
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Oc1cc2ccccc2c2c1cccc2
Isomeric SMILES Oc1cc2ccccc2c2c1cccc2
InChI InChI=1S/C14H10O/c15-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9,15H
InChI Key DZKIUEHLEXLYKM-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
phenanthren-9-ol
Database Links Click here for help
CAS Registry No. 484-17-3 (source: Scifinder)
ChEMBL Ligand CHEMBL2407182
GtoPdb PubChem SID 178100936
PubChem CID 10229
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UniChem Compound Search for chemical match using the InChIKey DZKIUEHLEXLYKM-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey DZKIUEHLEXLYKM-UHFFFAOYSA-N

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Tocris
9-Phenanthrol
Cat. No. 4999