Non-natural sidechain SwissSidechain - APD
3D view
| Name | 3-Methyl-phenylalanine |
| Molecular Weight [g/mol] | 180.22 |
| logP | -1.04 (predicted) |
| Sidechain logP | 3.2 |
| Volume [Å3 ] | 219.56 |
| Sidechain Volume [Å3 ] | 133.90 |
| pKa | 2.58 / 9.45 (predicted) |
| SMILES | OC(=O)[C@H](Cc1cccc(c1)C)[NH3] |
| D-amino acid code | DAPD |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | Not available |
| PubChem | L: 2761494 |
| CAS number | L: 114926-37-3 |
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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