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

CHEMBL5794490

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
O=C(Nc1ccc(CN2CCCC2)cc1)c1n[nH]c2ccc(-c3cccnc3)cc12

Basic Information

ChEMBL ID CHEMBL5794490
Phase Preclinical
Structure Type MOL
InChI Key WCYCBJIZCBZEQD-UHFFFAOYSA-N
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

397.5
MW (Da)
4.47
ALogP
4
HBA
2
HBD
73.9
PSA (Ų)
0.52
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H23N5O
MW 397.48
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.75

Activity Summary

EC50 1 meas. best 8.0
IC50 1 meas. best 6.72

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Dual specificity tyrosine-phosphorylation-regulated kinase 1A
CHEMBL2292
EC50 8.0 8.0 10.0 1
Proto-oncogene Wnt-1
CHEMBL1255129
IC50 6.72 6.72 190.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine