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Compound Detail

CHEMBL1179828

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CCCCSC(=O)OCC[N+](C)(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179828
Phase Preclinical
Structure Type MOL
InChI Key WYLOOWXXBXLTSC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

220.4
MW (Da)
2.36
ALogP
3
HBA
0
HBD
26.3
PSA (Ų)
0.39
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H22NO2S+
MW 220.36
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness 0.41

Data from ChEMBL 36 via Core Engine