Molecular Identity
Fasudil
5-(1,4-diazepan-1-ylsulfonyl)isoquinoline
PubChem CID: 3547
Fasudil is an isoquinoline substituted by a (1,4-diazepan-1-yl)sulfonyl group at position 5. It is a Rho-kinase inhibitor and its hydrochloride hydrate form is approved for the treatment of cerebral vasospasm and cerebral ischemia. It has a role as a geroprotector, a vasodilator agent, an antihypertensive agent, a calcium channel blocker, an EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor, a neuroprotective agent and a nootropic agent. It is a member of isoquinolines and a N-sulfonyldiazepane. It is a conjugate base of a fasudil(1+).
2D Structure
Properties
C14H17N3O2S
Molecular Formula
291.37
Molecular Weight
g/mol
291.1041
Exact Mass
Da
1
XLogP
Drug-like (Lipinski: < 5)
70.7
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
421
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Fasudil103745-39-7ha-1077HA1077AT-877Fasudilum1H-1,4-Diazepine, hexahydro-1-(5-isoquinolinylsulfonyl)-HA 1077AT 8771-(5-Isoquinolinesulfonyl)homopiperazineQ0CH43PGXSHexahydro-1-(5-isoquinolinylsulfonyl)-1H-1,4-diazepineNSC-759827ZK-258594AT877
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Fasudil
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