| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 21 | 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) | 3.43 | 5.58 | -11.95 | 2 | 6 | 0 | 87 | 353.172 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 6.49 | -46.22 | 1 | 6 | -1 | 90 | 352.164 | 5 | ↓ |
