| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 33 | Yes |
| 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) | 5.79 | 8.03 | -12.04 | 3 | 7 | 0 | 99 | 514.42 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.56 | 8.41 | -39.95 | 1 | 7 | -1 | 98 | 513.412 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.79 | 9.03 | -40.8 | 2 | 7 | -1 | 102 | 513.412 | 7 | ↓ |
