FENOLDOPAM

Search structure
Synonyms:
Status: Approved (1997)
Entry Type: Small molecule
Molecule Category: Parent
ATC: C01CA19
UNII: INU8H2KAWG

Structure
InChI Key TVURRHSHRRELCG-UHFFFAOYSA-N
Smile Oc1ccc(C2CNCCc3c2cc(O)c(O)c3Cl)cc1
InChI
InChI=1S/C16H16ClNO3/c17-15-11-5-6-18-8-13(9-1-3-10(19)4-2-9)12(11)7-14(20)16(15)21/h1-4,7,13,18-21H,5-6,8H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H16ClNO3
Molecular Weight 305.76
AlogP 2.73
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 1.0
Polar Surface Area 72.72
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

Primary Target
D1 receptor
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Epigenetic regulator Eraser Lysine demethylase Jumonji domain-containing
- 3000 - 1920 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor
- - 5012 151 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Dopamine receptor
3-32 1580 1300-13000 1-3 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Nucleotide-like receptor (family A GPCR) Adenosine receptor
- - - 36 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Acute Kidney Injury 3 D058186 ClinicalTrials
Renal Insufficiency 3 D051437 ClinicalTrials
Hypertension 1 D006973 ClinicalTrials

Related Entries

Scaffolds

UNKNOWN

Cross References

Resources Reference
CAS NUMBER 67227-56-9
ChEBI 5002
ChEMBL CHEMBL588
DrugBank DB00800
DrugCentral 1153
EPA CompTox DTXSID0043896
FDA SRS INU8H2KAWG
Human Metabolome Database HMDB0014938
Guide to Pharmacology 939
KEGG C07693
PharmGKB PA164784034
PubChem 3341
SureChEMBL SCHEMBL34250
CONTENTS