| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 14 | 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) | 0.45 | 0.66 | -39.37 | 3 | 3 | 1 | 40 | 201.334 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 1.35 | -34.34 | 3 | 3 | 1 | 37 | 201.334 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.45 | 2.69 | -102.31 | 4 | 3 | 2 | 41 | 202.342 | 6 | ↓ |
