| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 22 | 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) | 2.31 | 6.07 | -59.29 | 3 | 5 | 1 | 72 | 322.454 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 5.01 | -48.06 | 2 | 5 | 0 | 75 | 321.446 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.31 | 4.64 | -13.4 | 2 | 5 | 0 | 67 | 321.446 | 6 | ↓ |
