LP99

Ligand id: 8572

Name: LP99

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 95.17
Molecular weight 515.16
XLogP 4.46
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[(2R,3S)-2-(4-chlorophenyl)-1-(1,4-dimethyl-2-oxo-1,2-dihydroquinolin-7-yl)-6-oxopiperidin-3-yl]-2-methylpropane-1-sulfonamide
Synonyms
compound 60 [PMID: 25864491]
Database Links
PubChem CID 91827372
RCSB PDB Ligand 6B2
Search Google for chemical match using the InChIKey LVDRREOUMKACNJ-BKMJKUGQSA-N
Search Google for chemicals with the same backbone LVDRREOUMKACNJ
Search UniChem for chemical match using the InChIKey LVDRREOUMKACNJ-BKMJKUGQSA-N
Search UniChem for chemicals with the same backbone LVDRREOUMKACNJ
SynPHARM 82362 (in complex with bromodomain containing 9)
Comments
LP99 is a selective inhibitor of the bromodomain-containing proteins BRD7 and BRD9 [1], proteins which participate in chromatin remodelling as part of the SWI/SNF complex. LP99 is a novel and useful chemical probe for investigating BRD7/9 function. This is a compound from the Structural Genomics Consortium's (SGC) Epigenetics Probes Collection.