DG-051

Ligand id: 6548

Name: DG-051

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 59
Molecular weight 389.14
XLogP 4.63
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[(2S)-2-[4-(4-chlorophenoxy)phenoxymethyl]pyrrolidin-1-yl]butanoic acid
Synonyms
compound 20 [PMID: 19950900] [1]
Database Links
ChEMBL Ligand CHEMBL565789
GtoPdb PubChem SID 178103162
PubChem CID 44537807
Search Google for chemical match using the InChIKey PVCTYSQBVIGZRU-KRWDZBQOSA-N
Search Google for chemicals with the same backbone PVCTYSQBVIGZRU
Search UniChem for chemical match using the InChIKey PVCTYSQBVIGZRU-KRWDZBQOSA-N
Search UniChem for chemicals with the same backbone PVCTYSQBVIGZRU
SynPHARM 78669 (in complex with Leukotriene A4 hydrolase)
Comments
Leukotriene 4 hydrolase inhbitor