| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 32 | 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) | 3.82 | 8.79 | -45.77 | 3 | 6 | 1 | 66 | 449.497 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 8.8 | -45.55 | 3 | 6 | 1 | 66 | 449.497 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 6.57 | -15.4 | 2 | 6 | 0 | 65 | 448.489 | 8 | ↓ |
