| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2010 | 37 | 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) | -0.49 | -1.67 | -188.15 | 14 | 10 | 3 | 172 | 525.807 | 22 | ↓ |
| Hi High (pH 8-9.5) | -0.49 | -4.09 | -48.78 | 12 | 10 | 1 | 163 | 523.791 | 22 | ↓ |
| Mid Mid (pH 6-8) | -0.49 | -0.58 | -313.39 | 15 | 10 | 4 | 177 | 526.815 | 22 | ↓ |
| Lo Low (pH 4.5-6) | -0.49 | 0.48 | -473.6 | 16 | 10 | 5 | 181 | 527.823 | 22 | ↓ |
