| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 38 | 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) | 3.53 | 11.44 | -51.51 | 2 | 7 | 1 | 80 | 532.583 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.53 | 9.05 | -15.79 | 1 | 7 | 0 | 79 | 531.575 | 7 | ↓ |
