| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2007 | 35 | 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) | 3.88 | -7.33 | -16.35 | 2 | 8 | 0 | 97 | 493.585 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | -6.75 | -45.26 | 1 | 8 | -1 | 99 | 492.577 | 6 | ↓ |
