| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2006 | 29 | Yes |
| 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) | 3.84 | 13.74 | -11.08 | 0 | 4 | 0 | 68 | 396.527 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.00 | 13.9 | -117.87 | 0 | 4 | -2 | 80 | 394.511 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.00 | 12.82 | -63.23 | 1 | 4 | -1 | 77 | 395.519 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.42 | 13.83 | -45.25 | 0 | 4 | -1 | 74 | 395.519 | 4 | ↓ |
