| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 27th, 2006 | 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) | 3.61 | 10.87 | -57.71 | 0 | 7 | -1 | 96 | 415.425 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.05 | 2.45 | -25.65 | 1 | 7 | 0 | 92 | 416.433 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.02 | 2.28 | -15.37 | 0 | 7 | 0 | 89 | 416.433 | 7 | ↓ |
