In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 18 | Yes |
Popular Name: (2R)-2-(azepan-1-yl)-2-(3,4-difluorophenyl)ethanamine (2R)-2-(azepan-1-yl)-2-(3,4-difl…
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) | 2.40 | 6.64 | -133.27 | 4 | 2 | 2 | 32 | 256.34 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 4.68 | -50.76 | 3 | 2 | 1 | 31 | 255.332 | 3 | ↓ |