| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2005 | 22 | 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) | 3.15 | 8.9 | -55.41 | 1 | 5 | -1 | 70 | 294.334 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 9.36 | -68.49 | 2 | 5 | 0 | 71 | 295.342 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 7.39 | -36.87 | 3 | 5 | 1 | 68 | 296.35 | 5 | ↓ |
