MEDETOMIDINE

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: MR15E85MQM

Structure
InChI Key CUHVIMMYOGQXCV-UHFFFAOYSA-N
Smile Cc1cccc(C(C)c2c[nH]cn2)c1C
InChI
InChI=1S/C13H16N2/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13/h4-8,11H,1-3H3,(H,14,15)

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H16N2
Molecular Weight 200.28
AlogP 3.18
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 28.68
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 15.0

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
1165 2900 - 1102-1110 -

Cross References

Resources Reference
ChEBI 48552
ChEMBL CHEMBL77921
DrugBank DB11428
DrugCentral 1655
EPA CompTox DTXSID6048258
FDA SRS MR15E85MQM
PharmGKB PA449256
SureChEMBL SCHEMBL26432
CONTENTS