| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2008 | 38 | 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) | 8.06 | 15.01 | -13.54 | 2 | 6 | 0 | 90 | 518.746 | 21 | ↓ |
| Mid Mid (pH 6-8) | 8.06 | 16.09 | -55.04 | 3 | 6 | 1 | 95 | 519.754 | 21 | ↓ |
| Lo Low (pH 4.5-6) | 8.06 | 17.18 | -101.64 | 4 | 6 | 2 | 99 | 520.762 | 21 | ↓ |
