| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 14th, 2009 | 30 | No |
| 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) | 2.48 | 8.8 | -20.9 | 1 | 7 | 0 | 79 | 448.497 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 8.16 | -52.64 | 0 | 7 | -1 | 85 | 447.489 | 6 | ↓ |
