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Compound Detail

CHEMBL3319278

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CS(=O)(=O)c1ccc2nc(NC(=O)NC(=O)c3ccccc3Cl)oc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3319278
Phase Preclinical
Structure Type MOL
InChI Key CCTJFNZNMLIZBA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

393.8
MW (Da)
2.85
ALogP
6
HBA
2
HBD
118.4
PSA (Ų)
0.71
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 C16H12ClN3O5S
MW 393.81
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -2.13

Literature References

PubMed DOI Target Context # Activities
24967667 10.1021/jm500610n No relevant target 2
24967667 10.1021/jm500610n Growth hormone secretagogue receptor type 1 1

Data from ChEMBL 36 via Core Engine