| Phytochemical Name : 1H-Indole-3-acetonitrile, 1-methoxy- |
| PCNDIDOT0416 |
| Pubchem CID : 11954881 |
| Molecular formula: C11H10N2O |
| Canonical SMILES : CON1C=C(C2=CC=CC=C21)CC#N |
Synonymes : Caulilexin C|30536-48-2|1H-Indole-3-acetonitrile, 1-methoxy-|2-(1-methoxyindol-3-yl)acetonitrile|1-Methoxy-1H-indole-3-acetonitrile|Caulilexine C|1-METHOXYINDOLEACETONITRILE|NBP9TAS7GE|2-(1-methoxy-1H-indol-3-yl)acetonitrile|2-(1-Methoxyindol-3-yl)ethanenitrile|CaulilexinC|UNII-NBP9TAS7GE|1-methoxyindole-3-acetonitrile|SCHEMBL5144472|CHEMBL2063296|DTXSID00474661|CHEBI:172430|HY-N3556|AKOS022642185|MS-23008|1-Methoxy-1H-indole-3-acetonitrile, 9CI|CS-0023836 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.150 |
| Log Po/w (XLOGP3) : 2.060 |
| Log Po/w (WLOGP) : 1.770 |
| Log Po/w (MLOGP) : 1.670 |
| Log Po/w (SILICOS-IT) : 1.760 |
| Consensus Log Po/w : 1.880 |