In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 27 | Yes |
Popular Name: [(2S)-2-ethyl-1-piperidyl]-[6-[(2R)-2-phenylpyrrolidin-1-yl]-3-pyridyl]methanone [(2S)-2-ethyl-1-piperidyl]-[6-[(…
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) | 3.87 | 12.28 | -8.7 | 0 | 4 | 0 | 36 | 363.505 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.87 | 12.91 | -30.82 | 1 | 4 | 1 | 38 | 364.513 | 4 | ↓ |