| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 24 | Yes |
Popular Name: N-tert-butyl-2-[4-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-1,4-diazepan-1-yl]acetamide N-tert-butyl-2-[4-[2-oxo-2-(2,2,…
| 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) | 1.83 | 3.09 | -47.18 | 3 | 6 | 1 | 66 | 353.409 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.83 | 0.89 | -14.84 | 2 | 6 | 0 | 65 | 352.401 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.83 | 2.93 | -41.22 | 3 | 6 | 1 | 66 | 353.409 | 7 | ↓ |
