CARTEOLOL

Search structure
Synonyms:
Status: Approved (1988)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: C07AA15
UNII: 8NF31401XG

Structure
InChI Key LWAFSWPYPHEXKX-UHFFFAOYSA-N
Smile CC(C)(C)NCC(O)COc1cccc2c1CCC(=O)N2
InChI
InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20)

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H24N2O3
Molecular Weight 292.38
AlogP 1.7
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 5.0
Polar Surface Area 70.59
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 21.0

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
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Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 3437
ChEMBL CHEMBL839
DrugBank DB00521
DrugCentral 520
EPA CompTox DTXSID3022746
FDA SRS 8NF31401XG
Human Metabolome Database HMDB0014662
Guide to Pharmacology 7142
KEGG C06874
PharmGKB PA164768736
PubChem 2583
SureChEMBL SCHEMBL23721779
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