RIPASUDIL HYDROCHLORIDE DIHYDRATE

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Synonyms
Status
Molecule Category Salt-form
UNII 016TTR32QF

Structure

InChI Key CMDJNMACGABCKQ-XVSRHIFFSA-N
Smiles C[C@H]1CNCCCN1S(=O)(=O)c1cccc2cncc(F)c12.Cl.O.O
InChI
InChI=1S/C15H18FN3O2S.ClH.2H2O/c1-11-8-17-6-3-7-19(11)22(20,21)14-5-2-4-12-9-18-10-13(16)15(12)14;;;/h2,4-5,9-11,17H,3,6-8H2,1H3;1H;2*1H2/t11-;;;/m0.../s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H23ClFN3O4S
Molecular Weight 395.88
AlogP 1.75
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 22.0

Pharmacology

Mechanism of Action Action Reference
Rho-associated protein kinase inhibitor INHIBITOR PubMed

Target Conservation

Protein: Rho-associated protein kinase
Description: Rho-associated protein kinase 2
Organism : Homo sapiens
O75116 ENSG00000134318
Protein: Rho-associated protein kinase
Description: Rho-associated protein kinase 1
Organism : Homo sapiens
Q13464 ENSG00000067900

Cross References

Resources Reference
ChEMBL CHEMBL4594454
FDA SRS 016TTR32QF
SureChEMBL SCHEMBL20557243
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