ricolinostat

Ligand id: 7010

Name: ricolinostat

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 13
Topological polar surface area 107.45
Molecular weight 433.21
XLogP 3.74
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[7-(hydroxyamino)-7-oxoheptyl]-2-(N-phenylanilino)pyrimidine-5-carboxamide
International Nonproprietary Names
INN number INN
9801 ricolinostat
Synonyms
ACY-1215
Comments
Rocilinostat is an investigational HDAC6 inhibitor [2]. But note that it exhibits only ~10-fold enzymic selectivity against the class I isoform, HDAC1.
Database Links
CAS Registry No. 1316214-52-4
ChEMBL Ligand CHEMBL2364628
GtoPdb PubChem SID 178103589
PubChem CID 53340666
RCSB PDB Ligand AH4
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