| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2008 | 34 | No |
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) | 3.14 | 7.52 | -54.5 | 1 | 8 | 1 | 75 | 467.542 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 4.6 | -11.98 | 0 | 8 | 0 | 74 | 466.534 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.14 | 6.93 | -51.53 | 1 | 8 | 1 | 75 | 467.542 | 6 | ↓ |
