In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 15 | Yes |
Popular Name: [(2R,4S)-4-hydroxypyrrolidin-2-yl]-(4-methyl-1-piperidyl)methanone [(2R,4S)-4-hydroxypyrrolidin-2-y…
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) | 0.07 | 1.01 | -39.65 | 3 | 4 | 1 | 57 | 213.301 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.07 | -0.36 | -7.91 | 2 | 4 | 0 | 53 | 212.293 | 1 | ↓ |