| Phytochemical Name : 2-[2-(1,3-benzodioxol-5-yl)ethyl]-1-methyl-3,4-dihydro-2H-quinoline |
| PCNDIDOT0566 |
| Pubchem CID : 3009245 |
| Molecular formula: C19H21NO2 |
| Canonical SMILES : CN1C(CCC2=CC=CC=C21)CCC3=CC4=C(C=C3)OCO4 |
Synonymes : Galipinine|2-[2-(1,3-benzodioxol-5-yl)ethyl]-1-methyl-3,4-dihydro-2H-quinoline|D1b Allocuspareine|Quinoline, 2-[2-(1,3-benzodioxol-5-yl)ethyl]-1,2,3,4-tetrahydro-1-methyl- |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 3.390 |
| Log Po/w (XLOGP3) : 4.630 |
| Log Po/w (WLOGP) : 3.420 |
| Log Po/w (MLOGP) : 3.570 |
| Log Po/w (SILICOS-IT) : 4.070 |
| Consensus Log Po/w : 3.820 |