| 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) | 5.61 | 12.56 | -16.69 | 2 | 7 | 0 | 88 | 509.606 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.38 | 13.11 | -46.87 | 0 | 7 | -1 | 87 | 508.598 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.38 | 12.8 | -58.72 | 0 | 7 | -1 | 87 | 508.598 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.61 | 13.69 | -41.6 | 1 | 7 | -1 | 91 | 508.598 | 9 | ↓ |
