| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 34 | 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) | 3.09 | 8.56 | -46.81 | 0 | 8 | -1 | 97 | 468.526 | 11 | ↓ |
| Mid Mid (pH 6-8) | 2.51 | 8.9 | -19.83 | 0 | 8 | 0 | 91 | 469.534 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 7.44 | -19.91 | 1 | 8 | 0 | 95 | 469.534 | 10 | ↓ |
