indoramin   Click here for help

GtoPdb Ligand ID: 501

Synonyms: Baratol® | Doralese® | indoramine | WY-21901
Approved drug
indoramin is an approved drug (UK (1993))
Compound class: Synthetic organic
Comment: Indoramin is a selective antagonist of α1-adrenoceptors [3].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 48.13
Molecular weight 347.2
XLogP 3.8
No. Lipinski's rules broken 0
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Canonical SMILES O=C(c1ccccc1)NC1CCN(CC1)CCc1c[nH]c2c1cccc2
Isomeric SMILES O=C(c1ccccc1)NC1CCN(CC1)CCc1c[nH]c2c1cccc2
InChI InChI=1S/C22H25N3O/c26-22(17-6-2-1-3-7-17)24-19-11-14-25(15-12-19)13-10-18-16-23-21-9-5-4-8-20(18)21/h1-9,16,19,23H,10-15H2,(H,24,26)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (UK (1993))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
3064 indoramin
Synonyms Click here for help
Baratol® | Doralese® | indoramine | WY-21901
Database Links Click here for help
Specialist databases
GPCRdb Ligand indoramin
Other databases
BindingDB Ligand 50033113
CAS Registry No. 26844-12-2 (source: Scifinder)
ChEMBL Ligand CHEMBL279516
DrugCentral Ligand 1443
GtoPdb PubChem SID 135650391
PubChem CID 33625
Search Google for chemical match using the InChIKey JXZZEXZZKAWDSP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone JXZZEXZZKAWDSP
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UniChem Compound Search for chemical match using the InChIKey JXZZEXZZKAWDSP-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey JXZZEXZZKAWDSP-UHFFFAOYSA-N
Wikipedia Indoramin