Bioactive Compound Details

BioIDbio197832
NameNITHIAMIDE
ChEMBL IDCHEMBL1872946
Molecular FormulaC5H5N3O3S
Molecular Weight187.18
Molecular Weight (Monoisotopic)187.0052
TypeSmall molecule
Max PhasePhase 2
Target IDTar81
Target NameNone
Synonyms2-ACETAMIDO-5-NITROTHIAZOLE|ACINITRAZOLE|AMINITROZOL|AMINITROZOLE|CL 5,279|CL-5279|NITHIAMIDE|NSC-31539|NSC-45914
SmilesCC(=O)Nc1ncc([N+](=O)[O-])s1
InchiInChI=1S/C5H5N3O3S/c1-3(9)7-5-6-2-4(12-5)8(10)11/h2H,1H3,(H,6,7,9)
Inchi KeyUJRRDDHEMZLWFI-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets11.0
Bioactivities30.0
Np Likeness Score-2.59
Records Key['NITHIAMIDE', 'SID26757913', '9', 'SID144205685', 'Aminitrozole', '57', 'NITHIAMIDE', 'SID170466180', 'NITHIAMIDE', 'NITHIAMIDE', 'COVC-2825514078', 'NITHIAMIDE']
Records Name['NITHIAMIDE', 'SID26757913', 'N-(5-Nitro-1,3-thiazol-2-yl)acetamide', 'SID144205685', 'Aminitrozole', 'N-(5-nitrothiazol-2-yl)acetamide', 'NITHIAMIDE', 'SID170466180', 'NITHIAMIDE', 'NITHIAMIDE', 'AMINITROZOLE', 'NITHIAMIDE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure