| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 28 | 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) | -0.43 | 4.61 | -51.21 | 3 | 8 | 1 | 96 | 408.548 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.24 | 3.35 | -56.25 | 2 | 8 | 0 | 102 | 407.54 | 8 | ↓ |
