In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 16 | Yes |
Popular Name: [(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-[(2S,6R)-6-methyl-2-piperidyl]methanone [(2R)-2-(hydroxymethyl)pyrrolidi…
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) | 0.43 | 1.84 | -36.27 | 3 | 4 | 1 | 57 | 227.328 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.43 | 0.47 | -6.53 | 2 | 4 | 0 | 53 | 226.32 | 2 | ↓ |