| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 9th, 2006 | 29 | 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) | 4.68 | 15.13 | -17.42 | 1 | 5 | 0 | 60 | 402.523 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 14.66 | -45.47 | 0 | 5 | -1 | 61 | 401.515 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.86 | 15.05 | -45.02 | 0 | 5 | -1 | 61 | 401.515 | 4 | ↓ |
