| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 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) | 4.52 | 10.85 | -13.55 | 1 | 4 | 0 | 49 | 498.449 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.30 | 10.78 | -37.61 | 1 | 4 | 1 | 51 | 499.457 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.06 | 9.09 | -42.52 | 0 | 4 | -1 | 56 | 497.441 | 3 | ↓ |
