| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2008 | 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) | 3.74 | 10.46 | -58.52 | 0 | 6 | -1 | 83 | 414.437 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.74 | 10.53 | -10.81 | 1 | 6 | 0 | 80 | 415.445 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 11.19 | -18.03 | 0 | 6 | 0 | 77 | 415.445 | 8 | ↓ |
