| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2011 | 23 | Yes |
Popular Name: 4-[2-[(2S,6R)-2,6-dimethyl-1-piperidyl]-2-oxo-ethyl]-3-(2-pyridyl)-1,2,4-oxadiazol-5-one 4-[2-[(2S,6R)-2,6-dimethyl-1-pip…
| 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) | 1.10 | 8.1 | -18.15 | 0 | 7 | 0 | 81 | 316.361 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.10 | 8.29 | -53.16 | 1 | 7 | 1 | 82 | 317.369 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
