| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 37 | 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) | 5.68 | 11.73 | -13.77 | 2 | 7 | 0 | 91 | 496.611 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.45 | 12.29 | -46.31 | 0 | 7 | -1 | 90 | 495.603 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.45 | 12.06 | -56.41 | 0 | 7 | -1 | 90 | 495.603 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.68 | 12.85 | -40.45 | 1 | 7 | -1 | 94 | 495.603 | 9 | ↓ |
