| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2007 | 30 | 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) | 4.08 | 8.59 | -57.34 | 0 | 6 | -1 | 79 | 449.31 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.53 | 7.55 | -28.37 | 1 | 6 | 0 | 76 | 450.318 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | -0.19 | -21.31 | 0 | 6 | 0 | 72 | 450.318 | 7 | ↓ |
