Non-natural sidechain SwissSidechain - FCL
3D view
| Name | 3-chloro-Phenylalanine |
| Molecular Weight [g/mol] | 200.64 |
| logP | -0.78 (predicted) |
| Sidechain logP | 3.28 |
| Volume [Å3 ] | 213.76 |
| Sidechain Volume [Å3 ] | 128.10 |
| pKa | 1.85 / 9.42 (predicted) |
| SMILES | OC(=O)[C@H](Cc1cccc(c1)Cl)[NH3] |
| D-amino acid code | DFCL |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | Not available |
| PubChem | L: 2761492 | D: 7009409 |
| CAS number | L: 80126-51-8 | D: 80126-52-9 |
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 | |
|