Non-natural sidechain SwissSidechain - 2HF
3D view
| Name | 2-fluoro-l-histidine |
| Molecular Weight [g/mol] | 175.16 |
| logP | -2.62 (predicted) |
| Sidechain logP | 1.23 (predicted) |
| Volume [Å3 ] | 170.57 |
| Sidechain Volume [Å3 ] | 84.91 |
| pKa | 0.79 / 9.32 / 1.74 / 8.75 (predicted) |
| SMILES | [NH3][C@H](C(=O)O)C[C@@H]1CN[C@@H](N1)F |
| D-amino acid code | D2HF |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | Not available |
| PubChem | L: 6613474 |
| CAS number | L: 50444-78-5 |
Download:
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| MOL2 | |
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| 2D structures (PNG) | |
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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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