| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2008 | 18 | 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) | -0.31 | 2.75 | -45.05 | 3 | 4 | 1 | 49 | 251.35 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | 2.52 | -4.29 | 2 | 4 | 0 | 48 | 250.342 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.31 | 4.72 | -130.07 | 4 | 4 | 2 | 51 | 252.358 | 5 | ↓ |
