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

CHEMBL2362369

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
CC(=O)Nc1ccn(C2COC(COC(=O)c3ccccc3)O2)c(=O)n1

Basic Information

ChEMBL ID CHEMBL2362369
Phase Preclinical
Structure Type MOL
InChI Key BAODLFFHZLIRKZ-UHFFFAOYSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

359.3
MW (Da)
0.93
ALogP
8
HBA
1
HBD
108.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17N3O6
MW 359.34
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.25

Activity Summary

IC50 3 meas. best 6.55

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 6.55 6.23 281.3 3

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine