| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2006 | 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) | 3.86 | 8.21 | -39.39 | 2 | 7 | 1 | 83 | 412.462 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.86 | 5.69 | -12.43 | 1 | 7 | 0 | 81 | 411.454 | 9 | ↓ |
