| Phytochemical Name : 2-[(2R,6S)-6-[(2R)-2-hydroxy-2-phenylethyl]-1-methylpiperidin-2-yl]-1-phenylethanone |
| PCNDIDOT0564 |
| Pubchem CID : 688025 |
| Molecular formula: C22H27NO2 |
| Canonical SMILES : CN1C(CCCC1CC(=O)C2=CC=CC=C2)CC(C3=CC=CC=C3)O |
Synonymes : lobeline|Inflatine|Lobelin|D01IVE|90-69-7|LS-88107 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.320 |
| Log Po/w (XLOGP3) : 3.760 |
| Log Po/w (WLOGP) : 3.530 |
| Log Po/w (MLOGP) : 2.950 |
| Log Po/w (SILICOS-IT) : 4.010 |
| Consensus Log Po/w : 3.510 |