In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2010 | 17 | Yes |
Popular Name: (1S,2R)-2-[(1-ethyl-4-piperidyl)-methyl-amino]cyclohexanol (1S,2R)-2-[(1-ethyl-4-piperidyl)…
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) | 1.89 | 3.84 | -29.92 | 2 | 3 | 1 | 28 | 241.399 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 3.88 | -34.39 | 2 | 3 | 1 | 28 | 241.399 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 6.08 | -96.05 | 3 | 3 | 2 | 29 | 242.407 | 3 | ↓ |