| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 21 | No |
| 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) | 1.88 | 9.49 | -36.52 | 2 | 4 | 1 | 42 | 322.479 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 8.38 | -44.19 | 1 | 4 | 0 | 45 | 321.471 | 1 | ↓ |
