| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 12 | 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) | -2.69 | -7.05 | -101.18 | 9 | 6 | 2 | 127 | 176.22 | 5 | ↓ |
| Hi High (pH 8-9.5) | -2.69 | -7.79 | -12.08 | 7 | 6 | 0 | 124 | 174.204 | 5 | ↓ |
| Mid Mid (pH 6-8) | -2.69 | -7.38 | -55.53 | 8 | 6 | 1 | 126 | 175.212 | 5 | ↓ |
