| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2011 | 37 | 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) | 4.02 | 11.34 | -50.46 | 2 | 10 | 1 | 114 | 533.719 | 14 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 7.44 | -59.89 | 0 | 10 | -1 | 116 | 531.703 | 14 | ↓ |
| Mid Mid (pH 6-8) | 4.48 | 9.55 | -59.5 | 1 | 10 | 0 | 117 | 532.711 | 14 | ↓ |
