| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 14th, 2006 | 39 | 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) | 4.84 | 10.94 | -30.85 | 2 | 8 | 0 | 94 | 654.359 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.84 | 11.86 | -85.43 | 1 | 8 | -1 | 97 | 653.351 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.84 | 11.86 | -80.1 | 1 | 8 | -1 | 97 | 653.351 | 5 | ↓ |
