Bioactive Compound Details

BioIDbio197251
Name2-AMINO-3-(4-HYDROXY-1,2,5-OXADIAZOL-3-YL)PROPIONIC ACID (STRUCTURAL MIX)
ChEMBL IDCHEMBL1094129
Molecular FormulaC5H7N3O4
Molecular Weight173.13
Molecular Weight (Monoisotopic)173.0437
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesNC(Cc1nonc1O)C(=O)O
InchiInChI=1S/C5H7N3O4/c6-2(5(10)11)1-3-4(9)8-12-7-3/h2H,1,6H2,(H,8,9)(H,10,11)
Inchi KeyLSAPTLMISILBOS-UHFFFAOYSA-N
Molecular SpeciesZWITTERION
Targets8.0
Bioactivities39.0
Np Likeness Score-0.17
Records Key['10', '(+)-10', '(-)-10']
Records Name['(RS)-2-Amino-3-(4-hydroxy-1,2,5-oxadiazol-3-yl)propionic acid', '(+)-2-Amino-3-(4-hydroxy-1,2,5-oxadiazol-3-yl)propionic acid', '(-)-2-Amino-3-(4-hydroxy-1,2,5-oxadiazol-3-yl)propionic acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure