| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 30 | No |
| 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) | 4.06 | 11.65 | -68.53 | 1 | 6 | 0 | 78 | 516.335 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.06 | 9.11 | -55.2 | 0 | 6 | -1 | 77 | 515.327 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.06 | 10.83 | -49.12 | 2 | 6 | 1 | 75 | 517.343 | 6 | ↓ |
