FASUDIL HYDROCHLORIDE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Salt
UNII: SQ04N8S7BR
Parent Compound: FASUDIL

Structure
InChI Key LFVPBERIVUNMGV-UHFFFAOYSA-N
Smile Cl.O=S(=O)(c1cccc2cnccc12)N1CCCNCC1
InChI
InChI=1S/C14H17N3O2S.ClH/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14;/h1,3-5,7,11,15H,2,6,8-10H2;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H18ClN3O2S
Molecular Weight 327.84
AlogP 1.22
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 62.3
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 20.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase DMPK family AGC protein kinase ROCK subfamily
- 180 - - -
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Chemokine receptor CC chemokine receptor
- 35000 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Cardiovascular Diseases 2 D002318 ClinicalTrials
Carotid Stenosis 2 D016893 ClinicalTrials

Related Entries

Scaffolds

Parent

Cross References

Resources Reference
ChEBI 31593
ChEMBL CHEMBL541388
EPA CompTox DTXSID1045615
FDA SRS SQ04N8S7BR
PubChem 163751
SureChEMBL SCHEMBL317082
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