| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 17 | Yes |
Popular Name: 2-[methyl-[[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]amino]ethanol 2-[methyl-[[3-(3-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) | 0.15 | 0.9 | -42.53 | 2 | 6 | 1 | 76 | 235.267 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.15 | -1.55 | -10.3 | 1 | 6 | 0 | 75 | 234.259 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.15 | 1.35 | -87.5 | 3 | 6 | 2 | 78 | 236.275 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
