RO4938581

Ligand id: 4299

Name: RO4938581

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 48.53
Molecular weight 350.99
XLogP 3.06
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
15-bromo-5-(difluoromethyl)-2,4,8,9,11-pentaazatetracyclo[11.4.0.0^{2,6}.0^{8,12}]heptadeca-1(17),3,5,9,11,13,15-heptaene
Synonyms
Ro-4938581
Database Links
ChEMBL Ligand CHEMBL1080588
PubChem CID 11624499
Search Google for chemical match using the InChIKey AFJRYPJIKHMNGL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AFJRYPJIKHMNGL
Search UniChem for chemical match using the InChIKey AFJRYPJIKHMNGL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AFJRYPJIKHMNGL
Wikipedia Ro4938581