| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | 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 | 4.17 | -45.54 | 3 | 3 | 1 | 40 | 315.89 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 3.88 | -3.03 | 2 | 3 | 0 | 38 | 314.882 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.10 | 6.18 | -117.48 | 4 | 3 | 2 | 41 | 316.898 | 4 | ↓ |
