bag-1

Ligand id: 6188

Name: bag-1

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 41.57
Molecular weight 333.22
XLogP 7.68
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[4-[2-[5-(2,2-dimethylbutyl)-1H-imidazol-2-yl]ethyl]phenyl]pyridine
Synonyms
AK120413
Database Links
CAS Registry No. 1021937-07-4 (source: SciFinder)
ChEMBL Ligand CHEMBL1091720
PubChem CID 25025860
Search Google for chemical match using the InChIKey WVAKRQOMAINQPU-UHFFFAOYSA-N
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Search UniChem for chemical match using the InChIKey WVAKRQOMAINQPU-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WVAKRQOMAINQPU