| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2010 | 29 | 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) | 3.38 | 4.42 | -12.48 | 3 | 7 | 0 | 99 | 411.845 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 5.36 | -38.87 | 2 | 7 | -1 | 102 | 410.837 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 4.59 | -14.88 | 3 | 7 | 0 | 99 | 411.845 | 5 | ↓ |
