| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 7th, 2009 | 22 | Yes |
| 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) | 2.17 | 9.85 | -29.14 | 1 | 4 | 1 | 34 | 295.41 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 7.69 | -40.93 | 1 | 4 | 1 | 33 | 295.41 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 7.69 | -40.64 | 1 | 4 | 1 | 33 | 295.41 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 8.41 | -9.83 | 0 | 4 | 0 | 32 | 294.402 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 8.78 | -28.15 | 1 | 4 | 1 | 34 | 295.41 | 5 | ↓ |
