CINNARIZINE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
ATC: N07CA02
UNII: 3DI2E1X18L

Structure
InChI Key DERZBLKQOCDDDZ-JLHYYAGUSA-N
Smile C(=C/c1ccccc1)\CN1CCN(C(c2ccccc2)c2ccccc2)CC1
InChI
InChI=1S/C26H28N2/c1-4-11-23(12-5-1)13-10-18-27-19-21-28(22-20-27)26(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-17,26H,18-22H2/b13-10+

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H28N2
Molecular Weight 368.52
AlogP 5.11
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 6.0
Polar Surface Area 6.48
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 28.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST Histamine H1 receptor antagonist
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- - - - 0.4662
Enzyme Protease Cysteine protease Cysteine protease CA clan Cysteine protease C1A family
- 124000 - - -
Enzyme Transferase
- - - - 7.698-31.02
Ion channel Voltage-gated ion channel Voltage-gated sodium channel
- 440 - - 94.6
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Opioid receptor
- 2272 - 922 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Acetylcholine receptor
- 2513 - 162 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor
- 1167 - 1023 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Dopamine receptor
- 252 - 259 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Histamine receptor
- 74 - 8.622 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Serotonin receptor
- 1083 - 103 -
Membrane receptor
- 1083 - 1023 -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC06 neurotransmitter transporter family
- 1090 - 1304 -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 102.69
Transporter Primary active transporter ATP-binding cassette ABCB subfamily
- 15700-15700 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 298-57-7
ChEBI 31403
ChEMBL CHEMBL43064
DrugBank DB00568
DrugCentral 654
EPA CompTox DTXSID3022821
FDA SRS 3DI2E1X18L
Guide to Pharmacology 9072
PDB N90
PubChem 1547484
SureChEMBL SCHEMBL44957
ZINC ZINC000019632891
CONTENTS