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Compound Detail

CHEMBL59189

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Nc1ccc2cc(S(=O)(=O)O)cc(S(=O)(=O)O)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL59189
Phase Preclinical
Structure Type MOL
InChI Key CMOLPZZVECHXKN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

303.3
MW (Da)
0.92
ALogP
5
HBA
3
HBD
134.8
PSA (Ų)
0.55
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H9NO6S2
MW 303.32
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.46

Literature References

PubMed DOI Target Context # Activities
12873507 10.1016/s0960-894x(03)00535-3 Unchecked 1

Data from ChEMBL 36 via Core Engine