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Compound Detail

CHEMBL5505783

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Cc1noc2c1C(=O)c1sc(C(=O)Nc3ccccc3)cc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5505783
Phase Preclinical
Structure Type MOL
InChI Key XVAKSPQYIKKEBM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

338.3
MW (Da)
3.07
ALogP
6
HBA
1
HBD
89.3
PSA (Ų)
0.61
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H10N2O4S
MW 338.34
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.20

Literature References

PubMed DOI Target Context # Activities
38704936 10.1016/j.ejmech.2024.116448 Signal transducer and activator of transcription 3 2
38704936 10.1016/j.ejmech.2024.116448 HCT-116 1

Data from ChEMBL 36 via Core Engine