In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 20 | Yes |
Popular Name: [(3R)-3-methyl-1-piperidyl]-(6-pyrrolidin-1-yl-3-pyridyl)methanone [(3R)-3-methyl-1-piperidyl]-(6-p…
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) | 1.66 | 8.02 | -10.05 | 0 | 4 | 0 | 36 | 273.38 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.66 | 8.44 | -31.17 | 1 | 4 | 1 | 38 | 274.388 | 2 | ↓ |