| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2009 | 25 | 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) | 3.13 | 12.8 | -98.24 | 3 | 4 | 2 | 39 | 336.483 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 10.36 | -9.85 | 1 | 4 | 0 | 37 | 334.467 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 12.28 | -49.49 | 2 | 4 | 1 | 38 | 335.475 | 4 | ↓ |
