 |
| Ligand Name:
(S)-N-[(1E)-1-(diethylamino)ethylidene]-P-methylphosphonamidic fluoride |
| HET ID: L2Y |
PubChem:
146672928
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: CCN(CC)C(=NP(=O)(C)F)C |
| Standard InChI: InChI=1S/C7H16FN2OP/c1-5-10(6-2)7(3)9-12(4,8)11/h5-6H2,1-4H3 |
| Molecular Formula: C7H16FN2OP |
Mol. Weight: 194.1869 |
Heavy Atoms: 12 |
| Charge: 0 |
Is Chiral: False |
logP: 2.539 |
| HBD: 0 |
HBA: 3 |
TPSA: 42.48 |
| #Bonds: 11 |
#Rotatable Bonds: 4 |
Shape Complexity: 0.85714287 |
| Stereocomplexity: 0.14285715 |
Ligand Type: Small Molecule |