buclizine   Click here for help

GtoPdb Ligand ID: 7134

Synonyms: UCB-4445
Approved drug
buclizine is an approved drug
Compound class: Synthetic organic
Comment: Buclizine is a piperazine derivative antihistamine and anticholinergic drug, with antiemetic properties.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 6.48
Molecular weight 432.23
XLogP 7.14
No. Lipinski's rules broken 1
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Canonical SMILES Clc1ccc(cc1)C(c1ccccc1)N1CCN(CC1)Cc1ccc(cc1)C(C)(C)C
Isomeric SMILES Clc1ccc(cc1)C(c1ccccc1)N1CCN(CC1)Cc1ccc(cc1)C(C)(C)C
InChI InChI=1S/C28H33ClN2/c1-28(2,3)25-13-9-22(10-14-25)21-30-17-19-31(20-18-30)27(23-7-5-4-6-8-23)24-11-15-26(29)16-12-24/h4-16,27H,17-21H2,1-3H3
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
291 buclizine
Synonyms Click here for help
Database Links Click here for help
CAS Registry No. 82-95-1
ChEMBL Ligand CHEMBL1201271
DrugBank Ligand DB00354
DrugCentral Ligand 416
GtoPdb PubChem SID 178103710
PubChem CID 6729
Search Google for chemical match using the InChIKey MOYGZHXDRJNJEP-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey MOYGZHXDRJNJEP-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey MOYGZHXDRJNJEP-UHFFFAOYSA-N
Wikipedia Buclizine