| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2011 | 33 | 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) | 2.68 | 5.23 | -59.68 | 4 | 7 | 1 | 96 | 446.527 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 3.62 | -17.03 | 3 | 7 | 0 | 94 | 445.519 | 4 | ↓ |
