BPH-628

Ligand id: 3188

Name: BPH-628

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 5
Rotatable bonds 6
Topological polar surface area 154.91
Molecular weight 434.07
XLogP 5.91
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
{1-hydroxy-2-[3-(4-phenylphenyl)phenyl]-1-phosphonoethyl}phosphonic acid
Synonyms
B28 | BPH 628 | BPH628
Database Links
CAS Registry No. 1059677-40-5 (source: Scifinder)
ChEMBL Ligand CHEMBL262616
DrugBank Ligand DB07409
GtoPdb PubChem SID 135650016
PubChem CID 16122554
RCSB PDB Ligand B28
Search Google for chemical match using the InChIKey MPBUFKZCEBTBSK-UHFFFAOYSA-N
Search Google for chemicals with the same backbone MPBUFKZCEBTBSK
Search UniChem for chemical match using the InChIKey MPBUFKZCEBTBSK-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone MPBUFKZCEBTBSK