| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 31 | 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) | 4.33 | 11.13 | -73.02 | 2 | 6 | 0 | 85 | 487.394 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.33 | 9.94 | -125.97 | 0 | 6 | -2 | 87 | 485.378 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.33 | 12.16 | -123.53 | 1 | 6 | -1 | 88 | 486.386 | 8 | ↓ |
