| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2004 | 28 | 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) | 3.90 | 8.08 | -18.85 | 2 | 6 | 0 | 80 | 428.823 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.90 | 7.92 | -41.04 | 1 | 6 | -1 | 78 | 427.815 | 7 | ↓ |
