EPZ015666

Ligand id: 8287

Name: EPZ015666

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 99.61
Molecular weight 383.2
XLogP 1.31
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-6-(oxetan-3-ylamino)pyrimidine-4-carboxamide
Synonyms
EPZ 015666 | EPZ-015666
Database Links
CAS Registry No. 1616391-65-1
GtoPdb PubChem SID 252166499
PubChem CID 90241673
RCSB PDB Ligand 3XV
Search Google for chemical match using the InChIKey ZKXZLIFRWWKZRY-KRWDZBQOSA-N
Search Google for chemicals with the same backbone ZKXZLIFRWWKZRY
Search UniChem for chemical match using the InChIKey ZKXZLIFRWWKZRY-KRWDZBQOSA-N
Search UniChem for chemicals with the same backbone ZKXZLIFRWWKZRY
SynPHARM 81924 (in complex with protein arginine methyltransferase 5 )
Comments
EPZ015666 is a first-in-class, potent, selective and orally bioavailable PRMT5 inhibitor. The pharmaceutical composition may comprise the hydrochloride salt. EPZ015666 is compound 166 in patent WO2014100719 [5].