VL-0395

Ligand id: 886

Name: VL-0395

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 6
Rotatable bonds 10
Topological polar surface area 161.16
Molecular weight 469.18
XLogP 4.73
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[[3-[(5-carbamimidoyl1H-indole-2-carbonyl)amino]benzoyl]amino]-3-phenylpropanoic acid
Database Links
BindingDB Ligand 50061836
CAS Registry No. 620167-11-5 (source: Scifinder)
ChEMBL Ligand CHEMBL137814
PubChem CID 10742947
Search Google for chemical match using the InChIKey RVWSCZNGPOUASU-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RVWSCZNGPOUASU
Search UniChem for chemical match using the InChIKey RVWSCZNGPOUASU-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone RVWSCZNGPOUASU