| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2008 | 31 | 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) | 3.29 | 8.73 | -76.92 | 2 | 8 | 1 | 97 | 458.645 | 12 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 6.44 | -21.49 | 1 | 8 | 0 | 96 | 457.637 | 12 | ↓ |
