| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2010 | 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) | 2.17 | 7.33 | -43.64 | 3 | 3 | 1 | 44 | 242.346 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 6.93 | -4.89 | 2 | 3 | 0 | 42 | 241.338 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 6.92 | -25.66 | 3 | 3 | 1 | 43 | 242.346 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 7.31 | -105.96 | 4 | 3 | 2 | 45 | 243.354 | 5 | ↓ |
