azatadine   Click here for help

GtoPdb Ligand ID: 7119

Synonyms: Optimine® | SCH-10649
Approved drug Immunopharmacology Ligand
azatadine is an approved drug (FDA (1977))
Compound class: Synthetic organic
Comment: Azatadine is a first-generation antihistamine and anticholinergic drug. Its marketing has been discontinued in many countries as its use has largely been repleaced by newer and more effective alternatives.
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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 0
Topological polar surface area 16.13
Molecular weight 290.18
XLogP 2.81
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CN1CCC(=C2c3ccccc3CCc3c2nccc3)CC1
Isomeric SMILES CN1CCC(=C2c3ccccc3CCc3c2nccc3)CC1
InChI InChI=1S/C20H22N2/c1-22-13-10-16(11-14-22)19-18-7-3-2-5-15(18)8-9-17-6-4-12-21-20(17)19/h2-7,12H,8-11,13-14H2,1H3
InChI Key SEBMTIQKRHYNIT-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1977))
IUPAC Name Click here for help
11-(1-methylpiperidin-4-ylidene)-5,6-dihydrobenzo[1,2]cyclohepta[3,4-b]pyridine
International Nonproprietary Names Click here for help
INN number INN
2327 azatadine
Synonyms Click here for help
Optimine® | SCH-10649
Database Links Click here for help
CAS Registry No. 3964-81-6
ChEMBL Ligand CHEMBL946
DrugBank Ligand DB00719
DrugCentral Ligand 268
GtoPdb PubChem SID 178103696
PubChem CID 19861
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Wikipedia Azatadine