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

CHEMBL5936570

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
CCCCOc1nc(N)c2nc(O)n(Cc3ccc(Oc4ccc(CNC5CC5)cc4)cc3)c2n1

Basic Information

ChEMBL ID CHEMBL5936570
Phase Preclinical
Structure Type MOL
InChI Key GYMKNCFKEQETEI-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

474.6
MW (Da)
4.39
ALogP
9
HBA
3
HBD
120.3
PSA (Ų)
0.27
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H30N6O3
MW 474.57
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -0.74

Activity Summary

EC50 2 meas. best 8.68

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Toll-like receptor 7
CHEMBL5936
EC50 8.68 8.68 2.1 1
Interleukin-6
CHEMBL1795129
EC50 7.75 7.75 17.6 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine