Bioactive Compound Details

BioIDbio197678
NameNone
ChEMBL IDCHEMBL1814488
Molecular FormulaC9H18N2O3
Molecular Weight202.25
Molecular Weight (Monoisotopic)202.1317
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-[(2-Ammoniopropanoyl)Amino]Hexanoate
SmilesCCCC[C@H](NC(=O)[C@H](C)N)C(=O)O
InchiInChI=1S/C9H18N2O3/c1-3-4-5-7(9(13)14)11-8(12)6(2)10/h6-7H,3-5,10H2,1-2H3,(H,11,12)(H,13,14)/t6-,7-/m0/s1
Inchi KeyRSIYBPVKRVHPQK-BQBZGAKWSA-N
Molecular SpeciesACID
Targets2.0
Bioactivities3.0
Np Likeness Score0.24
Records Key['8', 'Ala-Nle']
Records Name['2-[(2-ammoniopropanoyl)amino]hexanoate', '(S)-2-((S)-2-aminopropanamido)hexanoic acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure