| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 2nd, 2009 | 25 | No |
Popular Name: 4-[2-(6-hydroxy-2,2,7,8-tetramethyl-chroman-5-yl)ethyl]benzene-1,2-diol 4-[2-(6-hydroxy-2,2,7,8-tetramet…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.77 | 5.3 | -13.75 | 3 | 4 | 0 | 70 | 342.435 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z81000-1-O | HT-22 (Hippocampal Cells) (cluster #1 Of 1), Other | Other | 930 | 0.34 | Functional ≤ 10μM |
| Z81072-1-O | Jurkat (Acute Leukemic T-cells) (cluster #1 Of 10), Other | Other | 5000 | 0.30 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z81000 | Z81000 | HT-22 (Hippocampal Cells) | 930 | 0.34 | Functional ≤ 10μM |
| Z81072 | Z81072 | Jurkat (Acute Leukemic T-cells) | 5000 | 0.30 | Functional ≤ 10μM |
