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

CHEMBL4785815

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
N#Cc1cc(C(=O)N2CS(=O)(=O)c3ccccc32)cc(Cl)c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4785815
Phase Preclinical
Structure Type MOL
InChI Key QHUSRJSYQNJEFQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
1
PK Parameters
2
Publications
0
Known Names

Molecular Properties

348.8
MW (Da)
2.31
ALogP
5
HBA
1
HBD
98.5
PSA (Ų)
0.85
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 C15H9ClN2O4S
MW 348.77
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.35

Pharmacokinetic Data

Parameter Value Units Species
Cmax 3870.75 nM Rattus norvegicus

Literature References

PubMed DOI Target Context # Activities
33062187 10.1021/acsmedchemlett.0c00176 Solute carrier family 22 member 12 3
33062187 10.1021/acsmedchemlett.0c00176 ADMET 3

Data from ChEMBL 36 via Core Engine