In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 17 | Yes |
Popular Name: 3-(3-pyridyl)-5-[[(2S)-pyrrolidin-2-yl]methyl]-1,2,4-oxadiazole 3-(3-pyridyl)-5-[[(2S)-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) | 1.33 | 2.9 | -40.64 | 2 | 5 | 1 | 68 | 231.279 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.33 | 3.36 | -86.36 | 3 | 5 | 2 | 70 | 232.287 | 3 | ↓ |