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Compound Detail

CHEMBL257362

IODOACETAMIDE ALKYNE
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C#CCCCCNC(=O)CI
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL257362
Name IODOACETAMIDE ALKYNE
Phase Preclinical
Structure Type MOL
InChI Key YCRUVTMZPHEOAM-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

265.1
MW (Da)
1.34
ALogP
1
HBA
1
HBD
29.1
PSA (Ų)
0.35
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H12INO
MW 265.09
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness -0.49

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
17237762 10.1038/nature05544 Transient receptor potential cation channel subfamily A member 1 2

Data from ChEMBL 36 via Core Engine