In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 15 | Yes |
Popular Name: 1-[[(2R)-tetrahydropyran-2-yl]methyl]piperidine-4-carbonitrile 1-[[(2R)-tetrahydropyran-2-yl]me…
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) | 1.78 | 4.57 | -6.54 | 0 | 3 | 0 | 36 | 208.305 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 6.85 | -44.91 | 1 | 3 | 1 | 37 | 209.313 | 2 | ↓ |