| Phytochemical Name : Cearoin |
| PCNDIDC0082 |
| Pubchem CID : 3938139 |
| Molecular formula: C14H12O4 |
| Canonical SMILES : COC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)O |
Synonymes : Cearoin|52811-37-7|(2,5-dihydroxy-4-methoxyphenyl)-phenylmethanone|SPBio_002047|Spectrum_000592|SpecPlus_000118|Spectrum2_001954|Spectrum3_001305|Spectrum4_001597|Spectrum5_000314|BSPBio_002969|KBioGR_002214|KBioSS_001072|SPECTRUM290030|DivK1c_006214|SCHEMBL4928735|CHEMBL1613209|KBio1_001158|KBio2_001072|KBio2_003640|KBio2_006208|KBio3_002189|DTXSID20398097|CHEBI:109547|HY-N8418|2,5-dihydroxy-4-methoxybenzophenone|CCG-39472|AKOS040761474|SDCCGMLS-0066944.P001|NCGC00095562-01|NCGC00095562-02|MS-23452|CS-0144129|(2,5-dihydroxy-4-methoxyphenyl)(phenyl)methanone|BRD-K20420220-001-03-9|Q27188692 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.120 |
| Log Po/w (XLOGP3) : 3.430 |
| Log Po/w (WLOGP) : 2.340 |
| Log Po/w (MLOGP) : 1.410 |
| Log Po/w (SILICOS-IT) : 2.430 |
| Consensus Log Po/w : 2.340 |