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Chemical structure of Fasudil (HA-1077) HCl

GC14289

Fasudil (HA-1077) HCl

Also known as 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;hydrochloride

Fasudil (HA-1077; AT877) Hydrochloride is a nonspecific RhoA/ROCK inhibitor and also has inhibitory effect on protein kinases, with an Ki of 0·33 μM for ROCK1, IC50s of 0·158 μM and 4·58 μM, 12·30 μM, 1·650 μM for ROCK2 and PKA, PKC, PKG, respectively· Fasudil (HA-1077) HCl is also a potent Ca2+ channel antagonist and vasodilator

ChemicalCAS105628-07-7MW327.83FormulaC14H17N3O2S·HCl
CAS number
105628-07-7
Molecular weight
327.83
Formula
C14H17N3O2S·HCl
Solubility
≥ 16·4mg/mL in DMSO, ≥ 4·81 mg/mL in EtOH with ultrasonic, ≥ 50 mg/mL in Water
InChIKey
LFVPBERIVUNMGV-UHFFFAOYSA-N
Catalogue number
GC14289
Brand
GLPBIO
Computed properties PubChem CID 163751 · TPSA 70.7 Ų · H-bond donors 2 · H-bond acceptors 5
TPSA
70.7 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
21

SMILES C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3.Cl

Computed descriptors from PubChem (CID 163751), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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