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Non-natural sidechain SwissSidechain - BHD

3D view

Name beta-hydroxyaspartic acid
Molecular Weight [g/mol] 148.09
logP -2.65 (predicted)
Sidechain logP -1.11
Volume [Å3 ] 144.23
Sidechain Volume [Å3 ] 58.57
pKa 2.57 / 9.08 / 2.8-(COO-) (predicted)
SMILES O=[C](=O)[C@H]([C@@H]([C](=O)=O)[NH3])O
D-amino acid code DBHD
PDB References:
L-amino acid PDB   |   Ligand
D-amino acid Not available
PubChem
CAS number L: 7298-99-9

Download:

Files L-amino acid D-amino acid
PDB
MOL2
2D structures (PNG)
backbone-dependent rotamers
backbone-independent rotamers
Gromacs topology file
CHARMM topology file
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