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Non-natural sidechain SwissSidechain - C2N

3D view

Name 3-chloro-l-alanine
Molecular Weight [g/mol] 123.54
logP -1.89 (predicted)
Sidechain logP 0.91
Volume [Å3 ] 123.21
Sidechain Volume [Å3 ] 37.55
pKa 1.7 / 8.52 (predicted)
SMILES ClC[C@@H]([C](=O)=O)[NH3]
D-amino acid code DC2N ;(PDB: C2N)
PDB References:
L-amino acid PDB   |   Ligand
D-amino acid PDB   |   Ligand
PubChem L:  439772
CAS number L: 2731-73-9  |  D: 39217-38-4

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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