In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (1S)-2-[(3S)-3-ethoxy-1-piperidyl]-N-ethyl-1-phenyl-ethanamine (1S)-2-[(3S)-3-ethoxy-1-piperidy…
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) | 2.84 | 7.46 | -35.29 | 2 | 3 | 1 | 29 | 277.432 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 5.79 | -2.29 | 1 | 3 | 0 | 24 | 276.424 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 7.79 | -31.57 | 2 | 3 | 1 | 26 | 277.432 | 7 | ↓ |