bicuculline

Ligand id: 2312

Name: bicuculline

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 66.46
Molecular weight 367.11
XLogP 2.51
No. Lipinski's rules broken 0

Molecular properties generated using the CDK
Classification
Compound class Natural product or derivative
IUPAC Name
(6R)-6-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6H-furo[4,3-g][1,3]benzodioxol-8-one
Synonyms
bicuculline methiodide
Database Links
BindingDB Ligand 50000693
CAS Registry No. 485-49-4
ChEBI CHEBI:3092
ChEMBL Ligand CHEMBL417990
GtoPdb PubChem SID 135652669
PubChem CID 10237
RCSB PDB Ligand H0Z
Search Google for chemical match using the InChIKey IYGYMKDQCDOMRE-ZWKOTPCHSA-N
Search Google for chemicals with the same backbone IYGYMKDQCDOMRE
Search UniChem for chemical match using the InChIKey IYGYMKDQCDOMRE-ZWKOTPCHSA-N
Search UniChem for chemicals with the same backbone IYGYMKDQCDOMRE
Wikipedia Bicuculline

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Tocris
(+)-Bicuculline
Cat. No. 0130