Ligand |
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| Ligand Name: ethyl (R)-N-[(1E)-1-(diethylamino)ethylidene]phosphonamidate | ||
| HET ID: L1M | PubChem: 406169230 | |
| DrugBank: - | ChEMBL: - | |
| Canonical SMILES: CCOP(=O)/N=C(/N(CC)CC)C | ||
| Standard InChI: InChI=1S/C8H19N2O2P/c1-5-10(6-2)8(4)9-13(11)12-7-3/h13H,5-7H2,1-4H3/b9-8+ | ||
| Molecular Formula: C8H19N2O2P | Mol. Weight: 206.22243 | Heavy Atoms: 13 |
| Charge: 0 | Is Chiral: False | logP: 2.1728 |
| HBD: 1 | HBA: 4 | TPSA: 65.37 |
| #Bonds: 12 | #Rotatable Bonds: 6 | Shape Complexity: 0.875 |
| Stereocomplexity: 0.125 | Ligand Type: Small Molecule | |
Binding Affinity |
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