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Compound Detail

CHEMBL1204523

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Cc1noc(NS(=O)(=O)c2cccc(OCC(=O)O)c2-c2ccc(CC(C)C)cc2)c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1204523
Phase Preclinical
Structure Type MOL
InChI Key UUGOVEOBUJMHLD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

458.5
MW (Da)
4.42
ALogP
6
HBA
2
HBD
118.7
PSA (Ų)
0.49
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H26N2O6S
MW 458.54
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.15

Data from ChEMBL 36 via Core Engine