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Compound Detail

CHEMBL4596979

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CC(C)(C)c1ccc(CN(Cc2cccc(NCC(=O)O)n2)S(=O)(=O)c2ccccn2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596979
Phase Preclinical
Structure Type MOL
InChI Key OWUKFZYTZSHJNF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

468.6
MW (Da)
3.66
ALogP
6
HBA
2
HBD
112.5
PSA (Ų)
0.49
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H28N4O4S
MW 468.58
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.48

Data from ChEMBL 36 via Core Engine