| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2006 | 28 | 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) | 3.33 | 7.76 | -64.27 | 0 | 6 | -1 | 83 | 382.436 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.74 | 1.77 | -12.93 | 0 | 6 | 0 | 76 | 383.444 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.77 | 6.69 | -31.87 | 1 | 6 | 0 | 80 | 383.444 | 6 | ↓ |
