| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 23 | Yes |
Popular Name: 3-butyl-5-[(1S)-1-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole 3-butyl-5-[(1S)-1-[4-(3,3-dimeth…
| 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) | 3.88 | 7.08 | -40.44 | 1 | 5 | 1 | 47 | 323.505 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | 4.8 | -5.52 | 0 | 5 | 0 | 45 | 322.497 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
