| Phytochemical Name : Butanedioic acid, (phenylmethylene)- |
| PCNDIDB0146 |
| Pubchem CID : 222998 |
| Molecular formula: C11H10O4 |
| Canonical SMILES : C1=CC=C(C=C1)C=C(CC(=O)O)C(=O)O |
Synonymes : Butanedioic acid, (phenylmethylene)-|2-benzylidenesuccinic acid|5653-88-3|2-benzylidenebutanedioic acid|2-(PHENYLMETHYLENE)BUTANEDIOIC ACID|(2Z)-2-benzylidenebutanedioic acid|NSC10134|Phenylitakonsaure|Benzylidenesuccinic Acid|NCIStruc1_000078|NCIStruc2_000036|SCHEMBL166780|DTXSID30963573|AKOS028108608|2-Carboxymethyl-3-phenylpropenoic acid|NCI60_000041 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.140 |
| Log Po/w (XLOGP3) : 1.350 |
| Log Po/w (WLOGP) : 1.520 |
| Log Po/w (MLOGP) : 1.490 |
| Log Po/w (SILICOS-IT) : 1.230 |
| Consensus Log Po/w : 1.340 |