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Compound Detail

CHEMBL1184194

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CCCCCCCCCCCCCCCC1CCC(COCCCCCC[n+]2ccsc2)O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184194
Phase Preclinical
Structure Type MOL
InChI Key LACZEPCUUVSVFB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

480.8
MW (Da)
8.64
ALogP
3
HBA
0
HBD
22.3
PSA (Ų)
0.12
QED
1
Ro5 Violations
23
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H54NO2S+
MW 480.82
Aromatic Rings 1
Heavy Atoms 33
NP-Likeness 0.61

Data from ChEMBL 36 via Core Engine