| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2006 | 27 | No |
Popular Name: (8-hydroxy-7-isopropyl-1,1,4a-trimethyl-5,6-dioxo-2,3,4,9,10,10a-hexahydrophenanthren-9-yl) (8-hydroxy-7-isopropyl-1,1,4a-tr…
| 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) | 4.28 | 10.49 | -45.29 | 0 | 5 | -1 | 84 | 373.469 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 2.89 | -8.38 | 0 | 5 | 0 | 77 | 374.477 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 213 | MolMall (formerly Molecular Diversity Preservation International) |
