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Compound Detail

CHEMBL4596631

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CC(C)(C)C1CCC(CN(Cc2cccc(NCC(=O)O)n2)S(=O)(=O)c2cccnc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596631
Phase Preclinical
Structure Type MOL
InChI Key VSSIHLMABBTTIL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

474.6
MW (Da)
4.02
ALogP
6
HBA
2
HBD
112.5
PSA (Ų)
0.56
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 C24H34N4O4S
MW 474.63
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness -1.43

Data from ChEMBL 36 via Core Engine