| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 17 | Yes |
Popular Name: 4-[3-(3-methyl-2-pyridyl)-1,2,4-oxadiazol-5-yl]butan-1-amine 4-[3-(3-methyl-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) | 0.83 | 2.31 | -52.09 | 3 | 5 | 1 | 79 | 233.295 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.83 | 2.86 | -87.88 | 4 | 5 | 2 | 81 | 234.303 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
