In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2009 | 20 | Yes |
Popular Name: 2-[4-[2-[(2S)-2-ethyl-1-piperidyl]ethoxy]phenyl]acetonitrile 2-[4-[2-[(2S)-2-ethyl-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) | 3.76 | 10.31 | -38 | 1 | 3 | 1 | 37 | 273.4 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.76 | 8.13 | -9.11 | 0 | 3 | 0 | 36 | 272.392 | 6 | ↓ |