| Phytochemical Name : Melanin |
| PCNDIDM0038 |
| Pubchem CID : 6325610 |
| Molecular formula: C18H10N2O4 |
| Canonical SMILES : CC1=C2C3=C(C4=CNC5=C(C(=O)C(=O)C(=C45)C3=CN2)C)C(=O)C1=O |
Synonymes : Melanin|8049-97-6|Melanin from Sepia officinalis|Melanins|6,14-dimethyl-4,12-diazapentacyclo[8.6.1.12,5.013,17.09,18]octadeca-1(17),2,5,9(18),10,13-hexaene-7,8,15,16-tetrone|Phaeomelanins|6,14-dimethyl-4,12-diazapentacyclo[8.6.1.1^{2,5}.0^{13,17}.0^{9,18}]octadeca-1(17),2,5,9(18),10,13-hexaene-7,8,15,16-tetrone|D0WQ4G|GTPL5415|CHEMBL4283875|CHEBI:89634|DTXSID301001278|EINECS 232-473-6|FT-0628190|Q27084224|2323070-48-8 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 0.970 |
| Log Po/w (XLOGP3) : -1.230 |
| Log Po/w (WLOGP) : 1.330 |
| Log Po/w (MLOGP) : -0.490 |
| Log Po/w (SILICOS-IT) : 5.420 |
| Consensus Log Po/w : 1.200 |