| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2010 | 32 | No |
None
| 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) | -0.97 | -1.82 | -22.8 | 4 | 10 | 0 | 159 | 445.424 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.79 | -3.97 | -127.87 | 2 | 10 | -2 | 169 | 443.408 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.79 | -4.5 | -68.3 | 3 | 10 | -1 | 166 | 444.416 | 7 | ↓ |
