| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2008 | 25 | 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) | 4.03 | 6.38 | -46.63 | 1 | 5 | -1 | 78 | 436.694 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 7.18 | -92.61 | 0 | 5 | -2 | 81 | 435.686 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.57 | 7.46 | -13.79 | 2 | 5 | 0 | 75 | 437.702 | 2 | ↓ |
