In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1R)-2-[(3S)-3-ethyl-1-piperidyl]-1-(4-methoxyphenyl)-N-methyl-ethanamine (1R)-2-[(3S)-3-ethyl-1-piperidyl…
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) | 3.42 | 8.97 | -124.5 | 3 | 3 | 2 | 30 | 278.44 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 7.87 | -34.68 | 2 | 3 | 1 | 26 | 277.432 | 6 | ↓ |