| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 17 | Yes |
Popular Name: 1-(1,4-diazepan-1-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone 1-(1,4-diazepan-1-yl)-2-[methyl(…
| 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) | 0.19 | 2.98 | -48.13 | 2 | 4 | 1 | 40 | 254.276 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.19 | 1.64 | -10.76 | 1 | 4 | 0 | 36 | 253.268 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.19 | 5.09 | -101.74 | 3 | 4 | 2 | 41 | 255.284 | 4 | ↓ |
