In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 19 | Yes |
Popular Name: 3-[[(1-isopropyl-4-piperidyl)amino]methyl]benzonitrile 3-[[(1-isopropyl-4-piperidyl)ami…
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) | 2.32 | 7.87 | -37.43 | 2 | 3 | 1 | 40 | 258.389 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 6.71 | -50.48 | 2 | 3 | 1 | 44 | 258.389 | 4 | ↓ |