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

CHEMBL5431736

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
CN(CC1CCCCC1)c1ncnc2[nH]c(-c3ccc(CO)cc3)nc12

Basic Information

ChEMBL ID CHEMBL5431736
Phase Preclinical
Structure Type MOL
InChI Key OAVBPTNWOYTJJQ-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

351.4
MW (Da)
3.53
ALogP
5
HBA
2
HBD
77.9
PSA (Ų)
0.74
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H25N5O
MW 351.45
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -0.70

Activity Summary

IC50 2 meas. best 9.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Macrophage colony-stimulating factor 1 receptor
CHEMBL1844
IC50 9.0 9.0 1.0 1
Macrophage colony-stimulating factor 1 receptor
CHEMBL5570
IC50 7.0 7.0 100.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
37141705 10.1016/j.ejmech.2023.115344 Macrophage colony-stimulating factor 1 receptor 3
37141705 10.1016/j.ejmech.2023.115344 No relevant target 1
37141705 10.1016/j.ejmech.2023.115344 ADMET 1

Data from ChEMBL 36 via Core Engine