| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 16th, 2009 | 33 | 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) | 1.71 | 10.34 | -39.71 | 2 | 8 | 0 | 113 | 517.376 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 8.04 | -62.23 | 1 | 8 | -1 | 108 | 516.368 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 9.41 | -49.5 | 1 | 8 | -1 | 108 | 516.368 | 6 | ↓ |
