FR190997

Ligand id: 668

Name: FR190997

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 15
Topological polar surface area 122.75
Molecular weight 697.19
XLogP 7.1
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[(E)-3-[[2-[[2,4-dichloro-3-[[2-methyl-4-(pyridin-2-ylmethoxy)quinolin-8-yl]oxymethyl]phenyl]-methylamino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-methylbenzamide
Synonyms
FR 190997 | FR-190997
Database Links
BindingDB Ligand 50146899
CAS Registry No. 193344-25-1 (source: Scifinder)
ChEMBL Ligand CHEMBL99869
PubChem CID 5311114
Search Google for chemical match using the InChIKey YFMDLMSUZMRKKH-SFQUDFHCSA-N
Search Google for chemicals with the same backbone YFMDLMSUZMRKKH
Search UniChem for chemical match using the InChIKey YFMDLMSUZMRKKH-SFQUDFHCSA-N
Search UniChem for chemicals with the same backbone YFMDLMSUZMRKKH