In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2009 | 19 | Yes |
Popular Name: 5-[(3S)-1-methyl-3-piperidyl]-3-(4-methyl-3-pyridyl)-1,2,4-oxadiazole 5-[(3S)-1-methyl-3-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) | 1.75 | 6.04 | -43.67 | 1 | 5 | 1 | 56 | 259.333 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.75 | 6.49 | -86.32 | 2 | 5 | 2 | 57 | 260.341 | 2 | ↓ |