Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL207373

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
N[C@H](COc1cncc(-c2ccc3cnccc3c2)c1)c1ccccc1

Basic Information

ChEMBL ID CHEMBL207373
Phase Preclinical
Structure Type MOL
InChI Key VRKRFTNPHNNRGS-JOCHJYFZSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

341.4
MW (Da)
4.38
ALogP
4
HBA
1
HBD
61.0
PSA (Ų)
0.59
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H19N3O
MW 341.41
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -0.62

Activity Summary

Ki 1 meas. best 6.33

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
RAC-alpha serine/threonine-protein kinase
CHEMBL4282
Ki 6.33 6.33 465.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
RAC-alpha serine/threonine-protein kinase Ki = 465.0 nM 6.33 Inhibition of Akt1 in presence of 10 uM ATP 16678413

Literature References

PubMed DOI Target Context # Activities
16678413 10.1016/j.bmcl.2006.04.046 RAC-alpha serine/threonine-protein kinase 1

Data from ChEMBL 36 via Core Engine