| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2012 | 22 | 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) | 6.03 | 7.98 | -35.27 | 4 | 3 | 1 | 57 | 316.55 | 18 | ↓ |
| Hi High (pH 8-9.5) | 6.03 | 7.58 | -4.17 | 3 | 3 | 0 | 55 | 315.542 | 18 | ↓ |
