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Compound Detail

CHEMBL3134052

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NC(=O)N1C(=O)/C(=C(\O)c2ccc(F)s2)c2cc(F)c(Cl)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3134052
Phase Preclinical
Structure Type MOL
InChI Key IMWALGCXZJCDTE-QXMHVHEDSA-N
0
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

356.7
MW (Da)
3.53
ALogP
4
HBA
2
HBD
83.6
PSA (Ų)
0.61
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H7ClF2N2O3S
MW 356.74
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.80

Activity Summary

EC50 3 meas.

Literature References

PubMed DOI Target Context # Activities
- 10.1039/C3MD00149K NON-PROTEIN TARGET 4
- 10.1039/C3MD00149K No relevant target 1

Data from ChEMBL 36 via Core Engine