| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 32 | 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) | 2.79 | 9.34 | -25.32 | 3 | 7 | 0 | 114 | 507.425 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 8.72 | -58.33 | 2 | 7 | -1 | 110 | 506.417 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 9.17 | -45.66 | 2 | 7 | -1 | 110 | 506.417 | 5 | ↓ |
