| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 13 | 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) | 0.15 | 1.78 | -43.01 | 3 | 3 | 1 | 50 | 181.259 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.15 | 0.28 | -6.24 | 2 | 3 | 0 | 45 | 180.251 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.15 | 2.22 | -91.68 | 4 | 3 | 2 | 51 | 182.267 | 5 | ↓ |
