| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 30 | 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) | 3.76 | 7.25 | -15.08 | 2 | 6 | 0 | 85 | 402.45 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.30 | 5.42 | -38.65 | 1 | 6 | -1 | 91 | 401.442 | 3 | ↓ |
