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Ligand Download |
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| Ligand Name: 6-[[furan-2-ylmethyl(methyl)amino]methyl]-5~{H}-pyrimidine-2,4-dione | ||
| HET ID: P0K | PubChem: 146681122 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: O=C1CC(=NC(=O)N1)CN(Cc1ccco1)C | ||
| Standard InChI: InChI=1S/C11H13N3O3/c1-14(7-9-3-2-4-17-9)6-8-5-10(15)13-11(16)12-8/h2-4H,5-7H2,1H3,(H,13,15,16) | ||
| Molecular Formula: C11H13N3O3 | Mol. Weight: 235.23923 | Heavy Atoms: 17 |
| Charge: 0 | Is Chiral: False | logP: 0.5567 |
| HBD: 1 | HBA: 6 | TPSA: 74.91 |
| #Bonds: 18 | #Rotatable Bonds: 4 | Shape Complexity: 0.36363637 |
| Stereocomplexity: 0.0 | ||