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

CHEMBL5220722

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
COc1ccc(CNC(=O)CSc2nnc(N)s2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5220722
Phase Preclinical
Structure Type MOL
InChI Key YAWHZTKAUNIBKJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

310.4
MW (Da)
1.54
ALogP
7
HBA
2
HBD
90.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H14N4O2S2
MW 310.40
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -2.34

Literature References

PubMed DOI Target Context # Activities
34898210 10.1021/acs.jmedchem.1c01108 Bromodomain-containing protein 4 2

Data from ChEMBL 36 via Core Engine