picrotin

Ligand id: 4286

Name: picrotin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 105.59
Molecular weight 310.11
XLogP -0.99
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Database Links
BitterDB Ligand 931
CAS Registry No. 21416-53-5 (source: Scifinder)
ChEBI CHEBI:8205
ChEMBL Ligand CHEMBL478523
PubChem CID 442291
Search Google for chemical match using the InChIKey RYEFFICCPKWYML-QCGISDTRSA-N
Search Google for chemicals with the same backbone RYEFFICCPKWYML
Search UniChem for chemical match using the InChIKey RYEFFICCPKWYML-QCGISDTRSA-N
Search UniChem for chemicals with the same backbone RYEFFICCPKWYML