| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 33 | Yes |
None
| 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) | 3.56 | 10.27 | -45.43 | 2 | 6 | 1 | 57 | 463.524 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.56 | 8.03 | -15.32 | 1 | 6 | 0 | 56 | 462.516 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.56 | 10.26 | -44.15 | 2 | 6 | 1 | 57 | 463.524 | 8 | ↓ |
