VEROSUDIL

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: MAF34143WM

Structure
InChI Key VDYRZXYYQMMFJW-UHFFFAOYSA-N
Smile CN(C)C(C(=O)Nc1ccc2c(=O)[nH]ccc2c1)c1ccsc1
InChI
InChI=1S/C17H17N3O2S/c1-20(2)15(12-6-8-23-10-12)17(22)19-13-3-4-14-11(9-13)5-7-18-16(14)21/h3-10,15H,1-2H3,(H,18,21)(H,19,22)

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H17N3O2S
Molecular Weight 327.41
AlogP 2.83
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 65.2
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 23.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Rho-associated protein kinase inhibitor PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Cytochrome P450 Cytochrome P450 family 2 Cytochrome P450 family 2D Cytochrome P450 2D6
- - - - 67

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Glaucoma 2 D005901 ClinicalTrials
Ocular Hypertension 2 D009798 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL3545065
FDA SRS MAF34143WM
Guide to Pharmacology 8911
PubChem 66906051
SureChEMBL SCHEMBL19235657
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