| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 28 | 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) | -0.02 | 11.03 | -72.02 | 0 | 7 | -1 | 86 | 386.403 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.02 | 9.03 | -20.52 | 1 | 7 | 0 | 83 | 387.411 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -2.76 | 8 | -38.74 | 1 | 7 | 0 | 89 | 387.411 | 2 | ↓ |
