| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2010 | 26 | Yes |
None
| 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) | 3.77 | 12.14 | -38.56 | 2 | 3 | 1 | 33 | 348.445 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.77 | 9.82 | -6.62 | 1 | 3 | 0 | 32 | 347.437 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.77 | 12.61 | -87.13 | 3 | 3 | 2 | 34 | 349.453 | 3 | ↓ |
