| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 16 | No |
Popular Name: 5-(methylsulfanylmethyl)-3-[(1R)-1-piperazin-1-ylethyl]-1,2,4-oxadiazole 5-(methylsulfanylmethyl)-3-[(1R)…
| 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) | 0.19 | 0.31 | -42.9 | 2 | 5 | 1 | 59 | 243.356 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.19 | -1.05 | -8.12 | 1 | 5 | 0 | 54 | 242.348 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
