pipamperone   Click here for help

GtoPdb Ligand ID: 92

Synonyms: dipiperone | floropipamide
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 66.64
Molecular weight 375.23
XLogP 1.77
No. Lipinski's rules broken 0
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Canonical SMILES O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N
Isomeric SMILES O=C(c1ccc(cc1)F)CCCN1CCC(CC1)(N1CCCCC1)C(=O)N
InChI InChI=1S/C21H30FN3O2/c22-18-8-6-17(7-9-18)19(26)5-4-12-24-15-10-21(11-16-24,20(23)27)25-13-2-1-3-14-25/h6-9H,1-5,10-16H2,(H2,23,27)
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
1588 pipamperone
Synonyms Click here for help
dipiperone | floropipamide
Database Links Click here for help
Specialist databases
GPCRdb Ligand pipamperone
Other databases
BindingDB Ligand 81483
CAS Registry No. 2448-68-2
ChEMBL Ligand CHEMBL440294
DrugCentral Ligand 2181
GtoPdb PubChem SID 135650830
PubChem CID 4830
Search Google for chemical match using the InChIKey AXKPFOAXAHJUAG-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AXKPFOAXAHJUAG
Search PubMed clinical trials pipamperone
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UniChem Compound Search for chemical match using the InChIKey AXKPFOAXAHJUAG-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey AXKPFOAXAHJUAG-UHFFFAOYSA-N
Wikipedia Pipamperone