L-asparagine   Click here for help

GtoPdb Ligand ID: 4533

Abbreviated name: L-Asn
PDB Ligand
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 106.41
Molecular weight 132.05
XLogP -4.43
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Click here for help
Canonical SMILES NC(=O)CC(C(=O)O)N
Isomeric SMILES NC(=O)C[C@@H](C(=O)O)N
InChI InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1
InChI Key DCXYFEDJOCDNAF-REOHCLBHSA-N
Transporters Moving this Compound Across a Lipid Membrane
Transporter EC number Reaction Reference
Alanine/serine/cysteine transporter 2
B0AT1 2
sodium-coupled neutral amino acid transporter 2 5
Sodium-coupled neutral amino acid transporter 5 7
B0AT2 2
sodium-coupled neutral amino acid transporter 1 1
Sodium-coupled neutral amino acid transporter 3 3
sodium-coupled neutral amino acid transporter 4 4
Additional information and targets (data relate to human unless otherwise stated)
Description Data Reference
Targets where the ligand is described in the comment field
Target Comment