| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2011 | 15 | Yes |
Popular Name: (1S)-1-[5-(1H-pyrazol-4-yl)-1,2,4-oxadiazol-3-yl]butan-1-amine (1S)-1-[5-(1H-pyrazol-4-yl)-1,2,…
None
| 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) | -1.05 | -0.51 | -44.85 | 4 | 6 | 1 | 95 | 208.245 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.05 | -0.83 | -8.93 | 3 | 6 | 0 | 94 | 207.237 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
