In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 8th, 2011 | 20 | Yes |
Popular Name: 5-[(2R)-1-propyl-2-piperidyl]-3-(4-pyridyl)-1,2,4-oxadiazole 5-[(2R)-1-propyl-2-piperidyl]-3-…
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) | 2.53 | 6.21 | -38.24 | 1 | 5 | 1 | 56 | 273.36 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.53 | 6.67 | -83.81 | 2 | 5 | 2 | 57 | 274.368 | 4 | ↓ |