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

CHEMBL4779092

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(NC(=O)c2cnc3c(Cl)c(C(C)(C)C)nn3c2C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4779092
Phase Preclinical
Structure Type MOL
InChI Key GPCNUEVCRBYKCY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

372.9
MW (Da)
4.25
ALogP
5
HBA
1
HBD
68.5
PSA (Ų)
0.75
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H21ClN4O2
MW 372.86
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.84

Literature References

PubMed DOI Target Context # Activities
33218895 10.1016/j.bmc.2020.115836 Neutrophil elastase 1

Data from ChEMBL 36 via Core Engine