Non-natural sidechain SwissSidechain - PFF
3D view
| Name | 4-Fluoro-Phenylalanine |
| Molecular Weight [g/mol] | 184.19 |
| logP | -1.89 |
| Sidechain logP | 2.58 |
| Volume [Å3 ] | 203.09 |
| Sidechain Volume [Å3 ] | 117.42 |
| pKa | 1.86 / 9.45 (predicted) |
| SMILES | [NH3][C@H](C(=O)O)Cc1ccc(cc1)F |
| D-amino acid code | DPFF |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | Not available |
| PubChem | L: 716312 |
| CAS number | L: 1132-68-9 | D: 18125-46-7 |
Download:
| Files | L-amino acid | D-amino acid | |
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| MOL2 | |
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| 2D structures (PNG) | |
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| backbone-dependent rotamers | |
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| backbone-independent rotamers | |
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| Gromacs topology file | |
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| CHARMM topology file | |
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