| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 24th, 2008 | 27 | 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) | 3.92 | 7.35 | -10.54 | 2 | 5 | 0 | 101 | 377.879 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.00 | 8.68 | -113.19 | 3 | 5 | 2 | 101 | 379.895 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.92 | 7.2 | -48.72 | 3 | 5 | 1 | 102 | 378.887 | 3 | ↓ |
