| Phytochemical Name : Edulinine |
| PCNDIDE0005 |
| Pubchem CID : 161570 |
| Molecular formula: C16H21NO4 |
| Canonical SMILES : CC(C)(C(CC1=C(C2=CC=CC=C2N(C1=O)C)OC)O)O |
Synonymes : Edulinine|27495-36-9|3-[(2R)-2,3-dihydroxy-3-methylbutyl]-4-methoxy-1-methylquinolin-2-one|DTXSID10950183|3-(2,3-Dihydroxy-3-methylbutyl)-4-methoxy-1-methylquinolin-2(1H)-one|2(1H)-Quinolinone, 3-(2,3-dihydroxy-3-methylbutyl)-4-methoxy-1-methyl-, (R)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.480 |
| Log Po/w (XLOGP3) : 0.790 |
| Log Po/w (WLOGP) : 1.220 |
| Log Po/w (MLOGP) : 1.270 |
| Log Po/w (SILICOS-IT) : 2.260 |
| Consensus Log Po/w : 1.610 |