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Compound Detail

CHEMBL1183802

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C[N+](C)(C)CCOC(=O)Sc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183802
Phase Preclinical
Structure Type MOL
InChI Key HPWIOASZEYVSEZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

240.3
MW (Da)
2.62
ALogP
3
HBA
0
HBD
26.3
PSA (Ų)
0.46
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H18NO2S+
MW 240.35
Aromatic Rings 1
Heavy Atoms 16

Data from ChEMBL 36 via Core Engine