Ligand Id: 2643
Ligand name BMS614

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 79.29
Molecular weight 448.18
XLogP 8.42
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Summary Biological activity References Structure
Classification
Compound class Synthetic organic
IUPAC Name
4-[(5,5-dimethyl-8-quinolin-3-yl6H-naphthalene-2-carbonyl)amino]benzoic acid
Synonyms
4-[5,6-Dihydro-5,5-dimethyl-8-(quinolin -3-yl) naphthalen-2-carboxamido] benzoic Acid
BMS
CID445091
Database Links
BindingDB Ligand 36811
PubChem CID 445091
Search Google for chemical match using the InChIKey WGLMBRZXZDAQHP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone WGLMBRZXZDAQHP
ZINC ZINC01893319

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