| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 27 | No |
None
| 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) | -0.04 | 3.3 | -52.65 | 2 | 8 | 1 | 91 | 401.553 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.04 | 3.3 | -57.4 | 2 | 8 | 1 | 91 | 401.553 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.04 | 1.07 | -26.18 | 1 | 8 | 0 | 90 | 400.545 | 8 | ↓ |
