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

CHEMBL4595838

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
Nc1nc(N)c(-c2cccc(Cl)c2)c(COc2cccc(OCC(=O)O)c2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595838
Phase Preclinical
Structure Type MOL
InChI Key COMLOBNSQWKWHJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

400.8
MW (Da)
3.00
ALogP
7
HBA
3
HBD
133.6
PSA (Ų)
0.55
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17ClN4O4
MW 400.82
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine