Ligand |
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| Ligand Name: (2S)‐2‐amino‐3‐oxopent‐4‐enal | ||
| Ligand Type: non-polymer | ||
| Ligand ID: COVPDB1033 | PubChem: - | |
| Synonym(s): - | ||
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: NC(C=O)C(=O)C=C | ||
| Standard InChI: InChI=1S/C5H7NO2/c1-2-5(8)4(6)3-7/h2-4H,1,6H2 | ||
| Molecular Formula: C5H7NO2 | Mol. Weight: 113.047676 | logP: -0.7323 |
| HBD: 1 | HBA: 3 | |
| #Rotatable Bonds: 3 | TPSA: 60.16 | |