| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 35 | 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) | 5.49 | 10.76 | -15 | 2 | 7 | 0 | 88 | 475.589 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.26 | 10.48 | -58.17 | 0 | 7 | -1 | 87 | 474.581 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.26 | 10.73 | -51.51 | 0 | 7 | -1 | 87 | 474.581 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.49 | 11.77 | -43.92 | 1 | 7 | -1 | 91 | 474.581 | 9 | ↓ |
