In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 21 | Yes |
Popular Name: 5-[(2S)-1-(4-piperidyl)pyrrolidin-2-yl]-3-(propoxymethyl)-1,2,4-oxadiazole 5-[(2S)-1-(4-piperidyl)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) | 1.08 | 3.03 | -37.49 | 2 | 6 | 1 | 65 | 295.407 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 4.37 | -103.93 | 3 | 6 | 2 | 69 | 296.415 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 2.08 | -42.42 | 2 | 6 | 1 | 68 | 295.407 | 6 | ↓ |