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Compound Detail

CHEMBL5221797

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CC(C)S(=O)(=O)Nc1ccc(OCCNCC2COc3ccccc3O2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5221797
Phase Preclinical
Structure Type MOL
InChI Key PFATWNHQUVTVMM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

406.5
MW (Da)
2.65
ALogP
6
HBA
2
HBD
85.9
PSA (Ų)
0.62
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H26N2O5S
MW 406.50
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.81

Data from ChEMBL 36 via Core Engine