| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 30 | 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) | 2.19 | 11.47 | -48.22 | 3 | 9 | 1 | 103 | 415.518 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.26 | 7.54 | -56.31 | 1 | 9 | -1 | 108 | 413.502 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 9.02 | -10.73 | 2 | 9 | 0 | 101 | 414.51 | 7 | ↓ |
