| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 35 | 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) | 5.02 | 11.56 | -62.01 | 1 | 7 | 0 | 87 | 517.409 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.02 | 9.22 | -58.13 | 0 | 7 | -1 | 86 | 516.401 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 5.02 | 10.71 | -46.48 | 2 | 7 | 1 | 84 | 518.417 | 9 | ↓ |
