| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 18th, 2008 | 28 | 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) | 2.99 | 5.59 | -44.24 | 3 | 6 | 1 | 68 | 402.54 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 3.28 | -12.48 | 2 | 6 | 0 | 66 | 401.532 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 7.14 | -97.75 | 4 | 6 | 2 | 69 | 403.548 | 6 | ↓ |
