In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 18 | Yes |
Popular Name: [1-[(5-isobutyl-1,2,4-oxadiazol-3-yl)methyl]-4-piperidyl]methanamine [1-[(5-isobutyl-1,2,4-oxadiazol-…
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) | 0.72 | 3.66 | -102.53 | 4 | 5 | 2 | 71 | 254.378 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 1.45 | -49.08 | 3 | 5 | 1 | 70 | 253.37 | 5 | ↓ |