Ligand Id: 1485
Ligand name BIBP3226

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 5
Rotatable bonds 13
Topological polar surface area 142.83
Molecular weight 473.24
XLogP 6.32
No. Lipinski's rules broken 2

Molecular properties generated using the CDK


Summary Biological activity References Structure Similar ligands (Un)labelled forms
Classification
Compound class Synthetic organic
IUPAC Name
(2R)-5-(diaminomethylideneamino)-2-[[2,2-di(phenyl)acetyl]amino]-N-[(4-hydroxyphenyl)methyl]pentanamide
Synonyms
(R)-N(2)-(diphenylacetyl)-N-[(4-hydroxyphenyl)-methyl]-argininamide
r-N2-(diphenylacetyl)-N-(4-hydroxyphenyl)methyl-argininamide
Database Links
BindingDB Ligand 50060728
ChEBI CHEBI:302735
ChEMBL Ligand 161246, 302735
PubChem CID 5311023
Search Google for chemical match using the InChIKey KUWBXRGRMQZCSS-HSZRJFAPSA-N
Search Google for chemicals with the same backbone KUWBXRGRMQZCSS
Wikipedia BIBP-3226
ZINC ZINC14951192

Contact us | Print | Back to top | Help