Ro19-4603

Ligand id: 4297

Name: Ro19-4603

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 92.67
Molecular weight 319.1
XLogP 2.06
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
tert-butyl 8-methyl-7-oxo-5-thia-1,8,12-triazatricyclo[8.3.0.0^{2,6}]trideca-2(6),3,10,12-tetraene-11-carboxylate
Synonyms
Ro-194603
Database Links
CAS Registry No. 99632-94-7 (source: Scifinder)
ChEMBL Ligand CHEMBL269366
PubChem CID 127382
Search Google for chemical match using the InChIKey ZIGMMUKDYCABPW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ZIGMMUKDYCABPW
Search UniChem for chemical match using the InChIKey ZIGMMUKDYCABPW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ZIGMMUKDYCABPW