Non-natural sidechain SwissSidechain - 004
3D view
| Name | Phenylglycine |
| Molecular Weight [g/mol] | 152.17 |
| logP | -1.7 |
| Sidechain logP | 2.13 |
| Volume [Å3 ] | 174.80 |
| Sidechain Volume [Å3 ] | 89.14 |
| pKa | 2.23 / 8.85 (predicted) |
| SMILES | [NH3][C@@H](c1ccccc1)C(=O)O |
| D-amino acid code | D004 ;(PDB: PG9) |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | PDB | Ligand |
| PubChem | L: 99291 | D: 70134 |
| CAS number | L: 2935-35-5 | D: 875-74-1 |
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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