TOLAZOLINE

Search structure
Synonyms:
Status: Approved (1985)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: C04AB02
UNII: CHH9H12AQ3

Structure
InChI Key JIVZKJJQOZQXQB-UHFFFAOYSA-N
Smile c1ccc(CC2=NCCN2)cc1
InChI
InChI=1S/C10H12N2/c1-2-4-9(5-3-1)8-10-11-6-7-12-10/h1-5H,6-8H2,(H,11,12)

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H12N2
Molecular Weight 160.22
AlogP 1.23
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 24.39
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 12.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor
- 2100 1514 180 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Trace amine receptor
- - - 1640 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Cross References

Resources Reference
ChEBI 28502
ChEMBL CHEMBL770
DrugBank DB00797
DrugCentral 2695
EPA CompTox DTXSID3023683
FDA SRS CHH9H12AQ3
Human Metabolome Database HMDB0014935
Guide to Pharmacology 7310
KEGG C07147
PharmGKB PA451716
PubChem 5504
SureChEMBL SCHEMBL34961
ZINC ZINC000000125006
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