In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 24 | No |
Popular Name: 4-[[4-[2-(4-methoxyphenyl)ethyl]-1-piperidyl]methyl]-3-methyl-1,2,4-oxadiazole-5-thione 4-[[4-[2-(4-methoxyphenyl)ethyl]…
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) | 2.99 | 11.27 | -56.96 | 1 | 5 | 1 | 45 | 348.492 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.99 | 8.96 | -15.62 | 0 | 5 | 0 | 43 | 347.484 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.