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Non-natural sidechain SwissSidechain - BCS

3D view

Name benzylcysteine
Molecular Weight [g/mol] 212.29
logP -1.22 (predicted)
Sidechain logP 2.37 (predicted)
Volume [Å3 ] 243.78
Sidechain Volume [Å3 ] 158.12
pKa 2.42 / 9.14 (predicted)
SMILES [NH3][C@H](C(=O)O)CSCc1ccccc1
D-amino acid code DBCS
PDB References:
L-amino acid PDB   |   Ligand
D-amino acid Not available
PubChem L:  193613
CAS number L: 3054-01-1  |  D: 23032-53-3

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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