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

CHEMBL4483004

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
Nc1cc(S(=O)(=O)O)c2cccnc2c1O.O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4483004
Phase Preclinical
Structure Type MOL
InChI Key QJTVUQMSHGMBHP-UHFFFAOYSA-N
Parent Compound CHEMBL4594844
Active Moiety CHEMBL4594844
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

240.2
MW (Da)
0.77
ALogP
5
HBA
3
HBD
113.5
PSA (Ų)
0.39
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H10N2O5S
MW 258.25
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.46

Literature References

PubMed DOI Target Context # Activities
30529546 10.1016/j.ejmech.2018.11.018 Bromodomain-containing protein 4 2

Data from ChEMBL 36 via Core Engine