Phenylephrine

Representations & DB's id
ChEBI:	CHEBI:8093
ChEMBL:	CHEMBL1215
PubChem:	6041
IUPAC:	3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol
Standard 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
Standard InChI Key:	SONNWYBIRXJNDC-VIFPVBQESA-N
SMILES:	CNC[C@@H](c1cccc(c1)O)O

Molecular propeties
AlogP:	0.65
Hydrogen bonds acceptors:	3
Hydrogen bonds donors:	3
Rotatable bonds:	3
Number of rings:	1
Molecular Weight:	167.09
Topological polar surface area:	52.5
Number of aromatic rings:	1
Fsp3:	0.333
Number of carbons:	9

Plant sources

Part of plant	Plant name	Ref.
Plant	Nerium oleander

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.
Potency	3548.1 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	91999.7 nM	Ras-related protein Rab-9A	P51151
Potency	19952.6 nM	Thyroid stimulating hormone receptor	P16473
Potency	251.2 nM	Hypoxia-inducible factor 1 alpha	Q16665
Potency	251.2 nM	Hypoxia-inducible factor 1 alpha	Q16665
Potency	3548.1 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	5623.4 nM	Dopamine D1 receptor	P21728
Potency	1835.6 nM	Dopamine D1 receptor	P21728
EC50	55 nM	Alpha-1a adrenergic receptor	P35348
EC50	5.9 nM	Alpha-1b adrenergic receptor	P35368