In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 20 | Yes |
Popular Name: (1R)-N-[2-(azepan-1-yl)ethyl]-1-(4-methoxyphenyl)ethanamine (1R)-N-[2-(azepan-1-yl)ethyl]-1-…
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) | 3.56 | 8.91 | -120.41 | 3 | 3 | 2 | 30 | 278.44 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 7.81 | -35.91 | 2 | 3 | 1 | 26 | 277.432 | 6 | ↓ |