| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 14th, 2010 | 16 | 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) | 2.07 | 7.51 | -41.86 | 2 | 4 | 1 | 46 | 221.328 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 6.22 | -6.04 | 1 | 4 | 0 | 41 | 220.32 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.07 | 7.73 | -89.16 | 3 | 4 | 2 | 47 | 222.336 | 3 | ↓ |
