| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 31 | 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) | 4.61 | 7.15 | -42.42 | 1 | 7 | -1 | 96 | 456.931 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.15 | 8.42 | -19 | 2 | 7 | 0 | 93 | 457.939 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.15 | 8.96 | -13.47 | 2 | 7 | 0 | 93 | 457.939 | 6 | ↓ |
