phenylephrine   Click here for help

GtoPdb Ligand ID: 485

Synonyms: m-oxedrine | metasynephrine
Approved drug
phenylephrine is an approved drug (FDA (1952))
Compound class: Synthetic organic
Comment: Marketed formulations may contain phenylephrine hydrochloride (PubChem CID 5284443).
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 52.49
Molecular weight 167.09
XLogP 0.52
No. Lipinski's rules broken 0
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Canonical SMILES CNCC(c1cccc(c1)O)O
Isomeric SMILES CNC[C@@H](c1cccc(c1)O)O
InChI InChI=1S/C9H13NO2/c1-10-6-9(12)7-3-2-4-8(11)5-7/h2-5,9-12H,6H2,1H3/t9-/m0/s1
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1952))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
4174 phenylephrine
Synonyms Click here for help
m-oxedrine | metasynephrine
Database Links Click here for help
Specialist databases
GPCRdb Ligand phenylephrine
Other databases
CAS Registry No. 59-42-7
ChEMBL Ligand CHEMBL1215
DrugBank Ligand DB00388
DrugCentral Ligand 2146
GtoPdb PubChem SID 135650819
PubChem CID 6041
Search Google for chemical match using the InChIKey SONNWYBIRXJNDC-VIFPVBQESA-N
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Search PubMed clinical trials phenylephrine
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UniChem Compound Search for chemical match using the InChIKey SONNWYBIRXJNDC-VIFPVBQESA-N
UniChem Connectivity Search for chemical match using the InChIKey SONNWYBIRXJNDC-VIFPVBQESA-N
Wikipedia Phenylephrine