General
Preferred name
H-7 DIHYDROCHLORIDE
Synonyms
1-(5-Isoquinolinylsulfonyl)-2-methylpiperazine dihydrochloride ()
Protein kinase inhibitor H-7 (dihydrochloride) ()
H-7 (hydrochloride) ()
P&D ID
PD015090
CAS
108930-17-2
Tags
natural product
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Inhibitor of cyclic nucleotide dependent protein kinase (PKA) and protein kinase C (PKC) (LOPAC library)
DESCRIPTION LTB omega-hydroxylase inhibitor (Tocris Bioactive Compound Library)
DESCRIPTION H-7 dihydrochloride is a protein kinase inhibitor (IC50 = 6.0, 5.8, 3.0 and 97.0 μM for inhibition of PKC, PKG, PKA and myosin light chain kinase, respectively). H-7 inhibits cell invasion and metastasis in B16BL6 cancer cells through the PKC/MEK/ERK pathway. It was also shown to inhibit Topo I and II in murine L929 cells and induce apoptosis via PKC inhibition. (BOC Sciences Bioactive Compounds)
Cell lines
0
Organisms
1
Compound Sets
5
BOC Sciences Bioactive Compounds
h-7-dihydrochloride-cas-108930-17-2-350576
Cayman Chemical Bioactives
21434
LOPAC library
MedChem Express Bioactive Compound Library
HY-100983
Tocris Bioactive Compound Library
0542
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
363.06
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
2
cLogP
2.06
TPSA
62.3
Fraction CSP3
0.36
Chiral centers
1.0
Largest ring
6.0
QED
0.89
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Selectivity
PKA / PKC
Primary Target
Broad Spectrum Protein Kinase Inhibitors
MOA
Inhibitor
Pathway
Epigenetics
TGF-beta/Smad
Target
PKC
Source data