| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 31 | 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) | 2.46 | 4.73 | -23.87 | 3 | 8 | 0 | 117 | 474.589 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.53 | 3.91 | -86.46 | 1 | 8 | -2 | 126 | 472.573 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 4.8 | -48.28 | 2 | 8 | -1 | 119 | 473.581 | 5 | ↓ |
