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Ligand Download |
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| Ligand Name: dodecyl 2-(trimethylammonio)ethyl phosphate | ||
| HET ID: DPV | PubChem: 644308 | |
| DrugBank: - | ChEMBL: CHEMBL229565 | |
| Canonical SMILES: CCCCCCCCCCCCOP(=O)(OCC[N+](C)(C)C)[O-] | ||
| Standard InChI: InChI=1S/C17H38NO4P/c1-5-6-7-8-9-10-11-12-13-14-16-21-23(19,20)22-17-15-18(2,3)4/h5-17H2,1-4H3 | ||
| Molecular Formula: C17H38NO4P | Mol. Weight: 351.46167 | Heavy Atoms: 23 |
| Charge: 0 | Is Chiral: False | logP: 5.1853 |
| HBD: 0 | HBA: 4 | TPSA: 68.4 |
| #Bonds: 22 | #Rotatable Bonds: 16 | Shape Complexity: 1.0 |
| Stereocomplexity: 0.05882353 | ||