amoxapine   Click here for help

GtoPdb Ligand ID: 201

Synonyms: amoxipine | Asendin®
Approved drug
amoxapine is an approved drug (FDA (1980))
Compound class: Synthetic organic
Comment: Amoxapine is a dibenzoxazepine-derivative tricyclic antidepressant.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 36.86
Molecular weight 313.1
XLogP 3.52
No. Lipinski's rules broken 0
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Canonical SMILES Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1
Isomeric SMILES Clc1ccc2c(c1)C(=Nc1c(O2)cccc1)N1CCNCC1
InChI InChI=1S/C17H16ClN3O/c18-12-5-6-15-13(11-12)17(21-9-7-19-8-10-21)20-14-3-1-2-4-16(14)22-15/h1-6,11,19H,7-10H2
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1980))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
3049 amoxapine
Synonyms Click here for help
amoxipine | Asendin®
Database Links Click here for help
Specialist databases
GPCRdb Ligand amoxapine
Other databases
BindingDB Ligand 22870
CAS Registry No. 14028-44-5
ChEMBL Ligand CHEMBL1113
DrugBank Ligand DB00543
DrugCentral Ligand 191
GtoPdb PubChem SID 135649941
PubChem CID 2170
Search Google for chemical match using the InChIKey QWGDMFLQWFTERH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QWGDMFLQWFTERH
Search PubMed clinical trials amoxapine
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UniChem Compound Search for chemical match using the InChIKey QWGDMFLQWFTERH-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey QWGDMFLQWFTERH-UHFFFAOYSA-N
Wikipedia Amoxapine