| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 18 | Yes |
Popular Name: 3-butyl-5-[[(2S,6S)-2,6-dimethylpiperazin-1-yl]methyl]-1,2,4-oxadiazole 3-butyl-5-[[(2S,6S)-2,6-dimethyl…
| 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) | 1.41 | 2.3 | -43.71 | 2 | 5 | 1 | 59 | 253.37 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.41 | 1.13 | -5.54 | 1 | 5 | 0 | 54 | 252.362 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
