| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 29 | No |
| 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) | 3.50 | 7.71 | -36.75 | 6 | 8 | 1 | 127 | 418.905 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 7.77 | -15.69 | 5 | 8 | 0 | 126 | 417.897 | 5 | ↓ |
