| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2008 | 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) | 4.60 | 4.66 | -45.54 | 1 | 6 | -1 | 95 | 418.256 | 3 | ↓ |
| Ref Reference (pH 7) | 4.60 | 4.77 | -43.98 | 1 | 6 | -1 | 95 | 418.256 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.60 | 5.55 | -98.22 | 0 | 6 | -2 | 98 | 417.248 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.60 | 5.44 | -96.78 | 0 | 6 | -2 | 98 | 417.248 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.14 | 7.3 | -11.58 | 2 | 6 | 0 | 92 | 419.264 | 3 | ↓ |
