Rho kinase inhibitor IV

Ligand id: 6033

Name: Rho kinase inhibitor IV

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 104.98
Molecular weight 376.16
XLogP 0.4
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-amino-1-[(3S)-3-methyl-4-(4-methylisoquinoline-5-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one
Synonyms
glycyl-H 1152
Database Links
CAS Registry No. 913844-46-9
PubChem CID 11976582
Search Google for chemical match using the InChIKey CMKMGFAUKPAOMG-AWEZNQCLSA-N
Search Google for chemicals with the same backbone CMKMGFAUKPAOMG
Search UniChem for chemical match using the InChIKey CMKMGFAUKPAOMG-AWEZNQCLSA-N
Search UniChem for chemicals with the same backbone CMKMGFAUKPAOMG
Comments
This is compound 18 in [3]. It is a selective and potent Rho kinase inhibitor