| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 19 | Yes |
Popular Name: 1-(1,4-diazepan-1-yl)-2-[propyl(2,2,2-trifluoroethyl)amino]ethanone 1-(1,4-diazepan-1-yl)-2-[propyl(…
| 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) | 1.06 | 4.63 | -44.64 | 2 | 4 | 1 | 40 | 282.33 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.06 | 3.26 | -9.27 | 1 | 4 | 0 | 36 | 281.322 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 6.49 | -100.94 | 3 | 4 | 2 | 41 | 283.338 | 6 | ↓ |
