| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2010 | 16 | 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) | 3.10 | 8.09 | -108.69 | 3 | 2 | 2 | 21 | 226.408 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 6.69 | -28.48 | 2 | 2 | 1 | 16 | 225.4 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 6.35 | -32.22 | 2 | 2 | 1 | 20 | 225.4 | 2 | ↓ |
