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Non-natural sidechain SwissSidechain - PHE

3D view

Name Phenylalanine
Molecular Weight [g/mol] 166.20
logP -1.52
Sidechain logP 2.73
Volume [Å3 ] 199.86
Sidechain Volume [Å3 ] 114.20
pKa 2.58 / 9.24
SMILES [NH3][C@@H](Cc1ccccc1)C(=O)O
D-amino acid code DPN ;(PDB: DPN)
PDB References:
L-amino acid PDB   |   Ligand
D-amino acid PDB   |   Ligand
PubChem L:  6140  |  D:  71567
CAS number L: 63-91-2  |  D: 673-06-3

Download:

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