Non-natural sidechain SwissSidechain - QU32
3D view
| Name | 3-(2-Quinolyl)-alanine |
| Molecular Weight [g/mol] | 217.24 |
| logP | -1.11 (predicted) |
| Sidechain logP | 2.59 |
| Volume [Å3 ] | 250.24 |
| Sidechain Volume [Å3 ] | 164.58 |
| pKa | 1.66 / 9.29 / 2.44 (predicted) |
| SMILES | OC(=O)[C@H](Cc1ccc2c(n1)cccc2)[NH3] |
| D-amino acid code | DQ32 |
| PDB References: | |
| L-amino acid | Not available |
| D-amino acid | Not available |
| PubChem | |
| CAS number | L: 161513-46-8 | D: 170421-67-7 |
Download:
| Files | L-amino acid | D-amino acid | |
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| PDB |
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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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