| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 19 | 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) | 2.79 | 6.77 | -36.58 | 2 | 3 | 1 | 39 | 270.743 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 6.34 | -7.7 | 1 | 3 | 0 | 38 | 269.735 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.79 | 7.22 | -83.17 | 3 | 3 | 2 | 40 | 271.751 | 3 | ↓ |
