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

CHEMBL1479604

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
CCOC(=O)N1CCN(C(=O)/C=C/c2c(C)nn(-c3ccc(F)cc3)c2Cl)CC1

Basic Information

ChEMBL ID CHEMBL1479604
Phase Preclinical
Structure Type MOL
InChI Key KZUOLEDMGFKECT-CMDGGOBGSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

420.9
MW (Da)
3.29
ALogP
5
HBA
0
HBD
67.7
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H22ClFN4O3
MW 420.87
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -1.72

Activity Summary

IC50 2 meas. best 4.94

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Signal transducer and activator of transcription 1-alpha/beta
CHEMBL6101
IC50 4.94 4.94 11420.0 1
Signal transducer and activator of transcription 3
CHEMBL4026
IC50 4.43 4.43 37140.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine