| Phytochemical Name : (S)-Isosclerone |
| PCNDIDOT0256 |
| Pubchem CID : 10442251 |
| Molecular formula: C10H10O3 |
| Canonical SMILES : C1CC(=O)C2=C(C1O)C=CC=C2O |
Synonymes : (S)-Isosclerone|62332-73-4|(+/-)-Isosclerone|1(2H)-Naphthalenone, 3,4-dihydro-4,8-dihydroxy-|Isosclerone, (+/-)-|AU5N5H7K3C|4,8-Dihydroxytetralin-1-one|4,8-DIHYDROXY-1-TETRALONE|4,8-dihydroxy-3,4-dihydro-2H-naphthalen-1-one|UNII-AU5N5H7K3C|3,4-Dihydro-4,8-dihydroxy-1(2H)-naphthalenone|(4rs)-4,8-dihydroxy-3,4-dihydronaphthalen-1(2h)-one|4,8-dihydroxy-1,2,3,4-tetrahydronaphthalen-1-one|(4S)-4,8-Dihydroxy-alpha-tetralone|CHEMBL448359|ACon1_001617|4,8-DHT|CHEBI:192112|AKOS022639864|NCGC00180322-01|BRD-A75320967-001-01-8 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.530 |
| Log Po/w (XLOGP3) : 1.110 |
| Log Po/w (WLOGP) : 1.080 |
| Log Po/w (MLOGP) : 0.470 |
| Log Po/w (SILICOS-IT) : 1.590 |
| Consensus Log Po/w : 1.160 |