| Phytochemical Name : Dianthramine |
| PCNDIDD0096 |
| Pubchem CID : 441562 |
| Molecular formula: C14H11NO6 |
| Canonical SMILES : C1=CC(=C(C=C1O)NC2=C(C=CC(=C2)O)C(=O)O)C(=O)O |
Synonymes : Dianthramine|136945-65-8|2-(2-carboxy-5-hydroxyanilino)-4-hydroxybenzoic acid|2,2'-Azanediylbis(4-hydroxybenzoic acid)|C08478|2,2'-Iminobis(4-hydroxybenzoic acid)|Benzoic acid, 2,2'-iminobis[4-hydroxy-|AC1L9BBP|CHEBI:4492|DTXSID30331591|CS-0379366|Q27106400|2-(2-carboxy-5-hydroxy-anilino)-4-hydroxy-benzoic acid |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.370 |
| Log Po/w (XLOGP3) : 1.910 |
| Log Po/w (WLOGP) : 1.870 |
| Log Po/w (MLOGP) : 1.600 |
| Log Po/w (SILICOS-IT) : 2.780 |
| Consensus Log Po/w : 2.110 |