| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 15th, 2008 | 28 | 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) | 2.76 | 11.49 | -87.25 | 3 | 6 | 2 | 58 | 382.508 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 9.03 | -42.54 | 2 | 6 | 1 | 57 | 381.5 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 6.57 | -13.36 | 1 | 6 | 0 | 56 | 380.492 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 9.02 | -45.02 | 2 | 6 | 1 | 57 | 381.5 | 5 | ↓ |
