| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2005 | 36 | 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) | 8.82 | 18.55 | -25.45 | 2 | 5 | 1 | 57 | 525.5 | 8 | ↓ |
| Hi High (pH 8-9.5) | 8.82 | 18.18 | -14.16 | 1 | 5 | 0 | 56 | 524.492 | 8 | ↓ |
| Mid Mid (pH 6-8) | 8.82 | 18.67 | -90.78 | 3 | 5 | 2 | 61 | 526.508 | 8 | ↓ |
