| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 12 | 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) | -0.18 | -0.35 | -36.97 | 3 | 3 | 1 | 40 | 173.28 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.18 | 0.7 | -31.83 | 3 | 3 | 1 | 37 | 173.28 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.18 | -1.56 | -3.5 | 2 | 3 | 0 | 35 | 172.272 | 4 | ↓ |
