GUANABENZ ACETATE

Search structure
Trade Names:
Synonyms:
Status: Approved (1982)
Entry Type: Small molecule
Molecule Category: Salt
UNII: 443O19GK1A
Parent Compound: GUANABENZ

Structure
InChI Key MCSPBPXATWBACD-GAYQJXMFSA-N
Smile CC(=O)O.N=C(N)N/N=C/c1c(Cl)cccc1Cl
InChI
InChI=1S/C8H8Cl2N4.C2H4O2/c9-6-2-1-3-7(10)5(6)4-13-14-8(11)12;1-2(3)4/h1-4H,(H4,11,12,14);1H3,(H,3,4)/b13-4+;

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H12Cl2N4O2
Molecular Weight 291.14
AlogP 1.81
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 2.0
Polar Surface Area 74.26
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 14.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Adrenergic receptor alpha-2 agonist FDA
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
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Related Entries

Parent

Cross References

Resources Reference
ChEBI 5554
ChEMBL CHEMBL1200560
FDA SRS 443O19GK1A
Guide to Pharmacology 5443
KEGG C07034
PubChem 5702062
SureChEMBL SCHEMBL40594
ZINC ZINC00001522
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