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

CHEMBL5932536

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
COc1cccc(C(=O)N2CCN(Cc3c(-c4ccc(C(C)C)cc4)nc4ccccn34)CC2)n1

Basic Information

ChEMBL ID CHEMBL5932536
Phase Preclinical
Structure Type MOL
InChI Key PXQBCLGROSFHIM-UHFFFAOYSA-N
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

469.6
MW (Da)
4.49
ALogP
6
HBA
0
HBD
63.0
PSA (Ų)
0.42
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H31N5O2
MW 469.59
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -1.85

Activity Summary

IC50 4 meas. best 7.35

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Potassium channel subfamily K member 3
CHEMBL2321613
IC50 7.35 6.83 45.0 2
Potassium channel subfamily K member 9
CHEMBL2321614
IC50 7.1 6.975 79.6 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine