In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 18 | Yes |
Popular Name: (2R)-2-(3-methoxyphenyl)-2-(4-methyl-1-piperidyl)acetonitrile (2R)-2-(3-methoxyphenyl)-2-(4-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) | 2.89 | 6.49 | -5.49 | 0 | 3 | 0 | 36 | 244.338 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.89 | 8.43 | -39.64 | 1 | 3 | 1 | 37 | 245.346 | 3 | ↓ |