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Compound Detail

CHEMBL356206

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CS(=O)(=O)c1ccc(-c2nc3sc4ccccc4n3c2-c2ccccc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL356206
Phase Preclinical
Structure Type MOL
InChI Key FWOVSBHAKXFWMG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

404.5
MW (Da)
5.29
ALogP
5
HBA
0
HBD
51.4
PSA (Ų)
0.41
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H16N2O2S2
MW 404.52
Aromatic Rings 5
Heavy Atoms 28
NP-Likeness -1.52

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(96)00580-X Prostaglandin G/H synthase 1 1
- 10.1016/S0960-894X(96)00580-X Prostaglandin G/H synthase 2 1

Data from ChEMBL 36 via Core Engine