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Compound Detail

CHEMBL4750599

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Cc1sc(NC(=O)c2ccc(SC(F)(F)F)cc2)c(C(=O)O)c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4750599
Phase Preclinical
Structure Type MOL
InChI Key JJADZNPAUOBCIW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

375.4
MW (Da)
4.93
ALogP
4
HBA
2
HBD
66.4
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H12F3NO3S2
MW 375.39
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -1.69

Literature References

PubMed DOI Target Context # Activities
31072652 10.1016/j.bmcl.2019.04.048 Potassium channel subfamily K member 10 2
31072652 10.1016/j.bmcl.2019.04.048 Potassium channel subfamily K member 2 2

Data from ChEMBL 36 via Core Engine