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

CHEMBL5877272

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
Cc1cc(NC(=O)c2nn(C(C)(C)C)c3ncnc(N)c23)n[nH]1

Basic Information

ChEMBL ID CHEMBL5877272
Phase Preclinical
Structure Type MOL
InChI Key QIBXPQVQBRFRIY-UHFFFAOYSA-N
1
Targets
5
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

314.4
MW (Da)
1.45
ALogP
7
HBA
3
HBD
127.4
PSA (Ų)
0.66
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H18N8O
MW 314.35
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.58

Activity Summary

IC50 5 meas. best 9.68

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Proto-oncogene tyrosine-protein kinase receptor Ret
CHEMBL2041
IC50 9.68 9.48 0.2 5

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine