| 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) | 4.09 | 8.17 | -17.8 | 2 | 8 | 0 | 97 | 477.561 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.86 | 8.56 | -54.39 | 0 | 8 | -1 | 96 | 476.553 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.86 | 8.23 | -59.06 | 0 | 8 | -1 | 96 | 476.553 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.09 | 9.15 | -42.83 | 1 | 8 | -1 | 100 | 476.553 | 10 | ↓ |
