General
Preferred name
ALOISINE A
Synonyms
6-PHENYL[5H]PYRROLO[2,3-B]PYRAZINE ()
Aloisine A RP107 ()
P&D ID
PD005306
CAS
496864-16-5
Tags
available
drug candidate
Drug indication
Discovery agent
Drug Status
experimental
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
Aloisine A RP107 is a potent, selective, reversible, and ATP-competitive inhibitor of cyclin dependent kinases (IC50 =150nM, 120 nM and 200 nM for Cdk1/cyclin B, Cdk2/cyclin A, and Cdk5/p25, respectively). It also inhibits clycogen synthase kinase-3 (IC50 =300 nM ), and c-Jun N-terminal kinase ( IC50 3-10µM).
(Enamine Bioactive Compounds)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
1
Organisms
0
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
21
Molecular Weight
267.14
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
4
Ring Count
3
Aromatic Ring Count
3
cLogP
3.67
TPSA
61.8
Fraction CSP3
0.25
Chiral centers
0.0
Largest ring
6.0
QED
0.76
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
