MeAIB

Ligand id: 4697

Name: MeAIB

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 49.33
Molecular weight 117.08
XLogP -0.16
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-methyl-2-(methylamino)propanoic acid
Synonyms
α-(methylamino)isobutyric acid | 2-(methylamino)isobutyric acid
Database Links
CAS Registry No. 2566-34-9 (source: Scifinder)
ChEMBL Ligand CHEMBL1916079
PubChem CID 75725
RCSB PDB Ligand 3WS
Search Google for chemical match using the InChIKey DLAMVQGYEVKIRE-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DLAMVQGYEVKIRE
Search UniChem for chemical match using the InChIKey DLAMVQGYEVKIRE-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DLAMVQGYEVKIRE