Ligand |
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| Ligand Name: methyl 4-(prop-2-enoyl)-1,2,3,4-tetrahydroquinoxaline-1-carboxylate | ||
| Ligand Type: non-polymer | ||
| Ligand ID: COVPDB460 | PubChem: 155564804 | |
Synonym(s):
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| DrugBank: - | ChEMBL: CHEMBL4578788 | |
| Canonical SMILES: c1cccc(c12)N(C(=O)C=C)CCN2C(=O)OC | ||
| Standard InChI: InChI=1S/C13H14N2O3/c1-3-12(16)14-8-9-15(13(17)18-2)11-7-5-4-6-10(11)14/h3-7H,1,8-9H2,2H3 | ||
| Molecular Formula: C13H14N2O3 | Mol. Weight: 246.10045 | logP: 1.792 |
| HBD: 0 | HBA: 3 | |
| #Rotatable Bonds: 1 | TPSA: 49.85 | |