General
Preferred name
Cdk2 Inhibitor II
Synonyms
cmpd 3, cmpd 16 ()
CDK2-IN-3 ()
P&D ID
PD018716
CAS
222035-13-4
Tags
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 CDK2-IN-3 (compound 3) is a potent and selective CDK2 inhibitor with an IC50 of 60 nM[1].
PRICE 276
DESCRIPTION The cyclin-dependent kinase 2 (Cdk2) works with cyclins A or E to regulate S phase and G2-M transition during the cell cycle. Cdk2 Inhibitor II is a potent, cell-permeable, ATP-competitive, and selective inhibitor of Cdk2. It is a 3-(benzylidne)indolin-2-one analog that selectively and potently inhibits Cdk2 with IC50 of 60 nM. (BOC Sciences Bioactive Compounds)
DESCRIPTION Cdk2 Inhibitor II is a selective and potent CDK2 inhibitor50 at 60 nM. (TargetMol Bioactive Compound Library)
Compound Sets
5
BOC Sciences Bioactive Compounds
cdk2-inhibitor-ii-cas-222035-13-4-292152
Cayman Chemical Bioactives
15154
CDK inhibitor database (CDKiDB)
MedChem Express Bioactive Compound Library
HY-112460
TargetMol Bioactive Compound Library
T36933
External IDs
22
Properties
(calculated by RDKit )
Molecular Weight
393.97
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
3
Rotatable Bonds
3
Ring Count
3
Aromatic Ring Count
2
cLogP
1.86
TPSA
113.65
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.69
Structural alerts
1
imine_one_isatin(189)
[#8]=[#6]-2-[#6](=!@[#7]-[#7])-c:1:c:c:c:c:c:1-[#7]-2
PAINS Family A
Custom attributes
(extracted from source data)
Target
CDK2
CDK
Pathway
Cell Cycle/DNA Damage
Cell Cycle/Checkpoint
Solubility
Soluble to 5 mg/ml in DMSO.
Source data