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Compound Detail

CHEMBL1159907

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CSCC[C@H](N)C(=O)NO

Basic Information

ChEMBL ID CHEMBL1159907
Phase Preclinical
Structure Type MOL
InChI Key HUPYBBFSQOFVSZ-BYPYZUCNSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
8
Publications
0
Known Names

Molecular Properties

164.2
MW (Da)
-0.43
ALogP
4
HBA
3
HBD
75.3
PSA (Ų)
0.39
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 C5H12N2O2S
MW 164.23
Aromatic Rings 0
Heavy Atoms 10
NP-Likeness -0.24

Literature References

PubMed DOI Target Context # Activities
10360737 10.1016/s0960-894x(99)00206-1 Staphylococcus aureus 1
10360737 10.1016/s0960-894x(99)00206-1 Staphylococcus epidermidis 1
10360737 10.1016/s0960-894x(99)00206-1 Bacillus cereus 1
10360737 10.1016/s0960-894x(99)00206-1 Escherichia coli 1
10360737 10.1016/s0960-894x(99)00206-1 Salmonella typhimurium 1
10360737 10.1016/s0960-894x(99)00206-1 Klebsiella pneumoniae 1
10360737 10.1016/s0960-894x(99)00206-1 Klebsiella aerogenes 1
10360737 10.1016/s0960-894x(99)00206-1 Pseudomonas aeruginosa 1

Data from ChEMBL 36 via Core Engine