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

CHEMBL129336

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
CCCCc1nc(CO)c(Cl)n1Cc1ccc(-c2nc(C)sc2C(=O)O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL129336
Phase Preclinical
Structure Type MOL
InChI Key CUKHMBMXNYJMMT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

419.9
MW (Da)
4.55
ALogP
6
HBA
2
HBD
88.2
PSA (Ų)
0.56
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H22ClN3O3S
MW 419.93
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -1.23

Literature References

PubMed DOI Target Context # Activities
7966154 10.1021/jm00049a012 Angiotensin II receptor 2

Data from ChEMBL 36 via Core Engine