In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2008 | 28 | Yes |
Popular Name: 1-[(3R)-3-(1-phenethyl-4-piperidyl)pyrrolidin-1-yl]-2-(2-pyridyl)ethanone 1-[(3R)-3-(1-phenethyl-4-piperid…
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) | 3.41 | 0.4 | -50.6 | 1 | 4 | 1 | 38 | 378.54 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.41 | 0.48 | -80.85 | 2 | 4 | 2 | 39 | 379.548 | 6 | ↓ |