| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 5th, 2008 | 32 | 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) | 1.80 | 6.33 | -58.05 | 2 | 9 | 1 | 100 | 461.564 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 3.85 | -19.54 | 1 | 9 | 0 | 99 | 460.556 | 7 | ↓ |
