In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 18 | Yes |
Popular Name: 2-[methyl-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]amino]acetic 2-[methyl-[[3-(2-pyridyl)-1,2,4-…
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) | -0.96 | 3.78 | -41.08 | 1 | 7 | 0 | 96 | 248.242 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.96 | 1.53 | -52.34 | 0 | 7 | -1 | 95 | 247.234 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.96 | 4.34 | -71.75 | 2 | 7 | 1 | 98 | 249.25 | 5 | ↓ |