In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 27 | Yes |
Popular Name: 5-[[1-(2,1-benzoxazole-3-carbonyl)-4-piperidyl]methyl]-4-ethyl-2-methyl-1,2,4-triazol-3-one 5-[[1-(2,1-benzoxazole-3-carbony…
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) | 1.70 | 9.19 | -17.96 | 0 | 8 | 0 | 86 | 369.425 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.