| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 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) | 3.59 | 5.13 | -46.25 | 1 | 7 | -1 | 104 | 491.261 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.59 | 5.88 | -102.02 | 0 | 7 | -2 | 107 | 490.253 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.13 | 6.9 | -12.8 | 2 | 7 | 0 | 101 | 492.269 | 4 | ↓ |
