| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 33 | 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 | 5.05 | -13.54 | 2 | 7 | 0 | 82 | 468.623 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 7.36 | -53.83 | 3 | 7 | 1 | 83 | 469.631 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 7.29 | -51.95 | 3 | 7 | 1 | 83 | 469.631 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.46 | 9.6 | -129.51 | 4 | 7 | 2 | 84 | 470.639 | 8 | ↓ |
