In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 4th, 2010 | 20 | Yes |
Popular Name: 4-[[2-[(3S,5R)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]amino]benzonitrile 4-[[2-[(3S,5R)-3,5-dimethyl-1-pi…
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) | 2.52 | 7.28 | -10.3 | 1 | 4 | 0 | 56 | 271.364 | 3 | ↓ |