In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 20 | Yes |
Popular Name: (2R)-2-(azepan-1-yl)-2-[2-(difluoromethoxy)phenyl]ethanamine (2R)-2-(azepan-1-yl)-2-[2-(diflu…
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) | 2.71 | 6.32 | -119.45 | 4 | 3 | 2 | 41 | 286.366 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.71 | 4.45 | -44.97 | 3 | 3 | 1 | 40 | 285.358 | 5 | ↓ |