| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2005 | 24 | 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 | 7.89 | -51.38 | 1 | 3 | -1 | 60 | 331.476 | 0 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | -1.55 | -9.27 | 1 | 3 | 0 | 54 | 332.484 | 1 | ↓ |
| Mid Mid (pH 6-8) | 4.38 | -0.7 | -6.91 | 2 | 3 | 0 | 57 | 332.484 | 1 | ↓ |
