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Compound Detail

CHEMBL315748

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Cc1ccc(C2CN(S(=O)(=O)c3ccccc3)C(=O)N2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL315748
Phase Preclinical
Structure Type MOL
InChI Key DFNCVVOTDHRUGM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

316.4
MW (Da)
2.45
ALogP
3
HBA
1
HBD
66.5
PSA (Ų)
0.95
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H16N2O3S
MW 316.38
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.06

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(96)00463-5 A549 1
- 10.1016/0960-894X(96)00463-5 SK-MEL-2 1

Data from ChEMBL 36 via Core Engine