| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2005 | 25 | Yes |
| 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) | 5.69 | 7.47 | -8.57 | 2 | 3 | 0 | 49 | 383.675 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.69 | 8.48 | -44.39 | 1 | 3 | -1 | 52 | 382.667 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Target | IKK | Selleck Chemicals |
