| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 13th, 2009 | 29 | 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) | 3.29 | 13.35 | -48.13 | 1 | 5 | 1 | 45 | 435.013 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 11.28 | -17.52 | 0 | 5 | 0 | 44 | 434.005 | 10 | ↓ |
