| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 38 | 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) | 4.77 | 10.13 | -14.02 | 2 | 8 | 0 | 97 | 513.594 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.54 | 10.28 | -56.9 | 0 | 8 | -1 | 96 | 512.586 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.54 | 10 | -63.06 | 0 | 8 | -1 | 96 | 512.586 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.77 | 11.17 | -44.95 | 1 | 8 | -1 | 100 | 512.586 | 9 | ↓ |
