In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 18 | Yes |
Popular Name: 4-ethyl-2-(2-hydroxyethyl)-5-(4-piperidylmethyl)-1,2,4-triazol-3-one 4-ethyl-2-(2-hydroxyethyl)-5-(4-…
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) | -0.59 | 3.32 | -50.19 | 3 | 6 | 1 | 77 | 255.342 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.