| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 32 | 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) | 0.22 | -0.46 | -45.91 | 3 | 9 | 1 | 96 | 444.556 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 1.81 | -97.7 | 4 | 9 | 2 | 97 | 445.564 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | -2.73 | -10.3 | 2 | 9 | 0 | 94 | 443.548 | 9 | ↓ |
