Non-natural sidechain SwissSidechain - WFP
3D view
| Name | 3,5-Difluoro-phenylalanine |
| Molecular Weight [g/mol] | 202.18 |
| logP | -1.21 (predicted) |
| Sidechain logP | 2.49 (predicted) |
| Volume [Å3 ] | 208.53 |
| Sidechain Volume [Å3 ] | 122.87 |
| pKa | 1.4 / 9.38 (predicted) |
| SMILES | [NH3][C@H](C(=O)O)Cc1cc(F)cc(c1)F |
| D-amino acid code | DWFP |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | Not available |
| PubChem | L: 716307 | D: 716310 |
| CAS number | L: 31105-91-6 | D: 266360-63-8 |
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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