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

CHEMBL5184653

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
O=C(c1nccs1)c1cn(C(=O)c2ccccc2)c2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5184653
Phase Preclinical
Structure Type MOL
InChI Key YSZGEXXXBPAOJD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

332.4
MW (Da)
4.02
ALogP
5
HBA
0
HBD
52.0
PSA (Ų)
0.53
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H12N2O2S
MW 332.38
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -1.02

Literature References

PubMed DOI Target Context # Activities
35416668 10.1021/acs.jmedchem.2c00208 Aryl hydrocarbon receptor 2

Data from ChEMBL 36 via Core Engine