| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 18 | Yes |
Popular Name: [1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]-3,5-dimethyl-pyrazol-4-yl]methanamine [1-[(3-isopropyl-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) | 0.68 | 1.65 | -50.18 | 3 | 6 | 1 | 84 | 250.326 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.68 | 1.25 | -10.39 | 2 | 6 | 0 | 83 | 249.318 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
