| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 38 | 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) | 3.45 | 8.27 | -58.49 | 3 | 9 | 1 | 109 | 520.606 | 12 | ↓ |
| Hi High (pH 8-9.5) | 3.45 | 6.92 | -16.04 | 2 | 9 | 0 | 104 | 519.598 | 12 | ↓ |
