| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 5th, 2008 | 30 | 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) | 3.36 | 5.06 | -23.36 | 1 | 8 | 0 | 110 | 452.554 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 5.12 | -63.91 | 0 | 8 | -1 | 112 | 451.546 | 6 | ↓ |
