| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2010 | 50 | 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) | 7.30 | 22.79 | -195.76 | 4 | 5 | 3 | 32 | 676.989 | 14 | ↓ |
| Hi High (pH 8-9.5) | 7.30 | 19.23 | -38.17 | 2 | 5 | 1 | 26 | 674.973 | 14 | ↓ |
| Mid Mid (pH 6-8) | 7.30 | 20.58 | -112.08 | 3 | 5 | 2 | 31 | 675.981 | 14 | ↓ |
