In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2011 | 27 | Yes |
Popular Name: [(3R)-3-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]-1-piperidyl]-(6-morpholino-3-pyridyl)methanone [(3R)-3-[(2S,5S)-2,5-dimethylpyr…
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) | 1.44 | 8.53 | -37.87 | 1 | 6 | 1 | 50 | 373.521 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.44 | 8.88 | -79.4 | 2 | 6 | 2 | 51 | 374.529 | 3 | ↓ |