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Compound Detail

CHEMBL262709

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CC(C)c1cccc2c1C(=O)N(COc1cccc(C(=O)NCCN3CCOCC3)c1)S2(=O)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL262709
Phase Preclinical
Structure Type MOL
InChI Key DLLBJYFXLQXDKF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

487.6
MW (Da)
2.05
ALogP
7
HBA
1
HBD
105.2
PSA (Ų)
0.61
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H29N3O6S
MW 487.58
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness -1.53

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00028-R Neutrophil elastase 2

Data from ChEMBL 36 via Core Engine