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Compound Detail

CHEMBL5222651

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CCS(=O)(=O)Nc1ccc(OCCNCC2COc3ccccc3O2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5222651
Phase Preclinical
Structure Type MOL
InChI Key AGPDMWDBGIWYGY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

392.5
MW (Da)
2.26
ALogP
6
HBA
2
HBD
85.9
PSA (Ų)
0.64
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H24N2O5S
MW 392.48
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -1.09

Data from ChEMBL 36 via Core Engine