TUG-770

Ligand id: 6483

Name: TUG-770

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 61.09
Molecular weight 307.1
XLogP 5.57
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-(4-{2-[2-(cyanomethyl)phenyl]ethynyl}-2-fluorophenyl)propanoic acid
Synonyms
TUG770
Database Links
CAS Registry No. 1402601-82-4
ChEMBL Ligand CHEMBL2386353
PubChem CID 66553168
Search Google for chemical match using the InChIKey KIZUBVPJNPVIIN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KIZUBVPJNPVIIN
Search UniChem for chemical match using the InChIKey KIZUBVPJNPVIIN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KIZUBVPJNPVIIN