| Phytochemical Name : Capillarin |
| PCNDIDC0036 |
| Pubchem CID : 3083811 |
| Molecular formula: C13H10O2 |
| Canonical SMILES : CC#CCC1=CC2=CC=CC=C2C(=O)O1 |
Synonymes : Capillarin|3570-28-3|3-but-2-ynylisochromen-1-one|G5ANW3JF5K|1H-2-Benzopyran-1-one, 3-(2-butynyl)-|3-(2-Butynyl)-1H-2-benzopyran-1-one|UNII-G5ANW3JF5K|3-(but-2-ynyl) isocoumarin|CHEBI:80801|MLS000863656|CHEMBL479330|MEGxp0_001548|SCHEMBL3678730|ACon1_002077|KUJLPCYCQICVRM-UHFFFAOYSA-|DTXSID50189218|HMS2270P11|NCGC00179854-01|SMR000440751|C16926|BRD-K94645508-001-01-9|Q27149844 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.590 |
| Log Po/w (XLOGP3) : 2.970 |
| Log Po/w (WLOGP) : 2.440 |
| Log Po/w (MLOGP) : 2.720 |
| Log Po/w (SILICOS-IT) : 3.630 |
| Consensus Log Po/w : 2.870 |