In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2004 | 30 | Yes |
Popular Name: 4-[4-benzyl-5-[2-(2,5-dimethylphenoxy)ethylthio]-1,2,4-triazol-3-yl]pyridine 4-[4-benzyl-5-[2-(2,5-dimethylph…
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) | 5.31 | 1.52 | -12.43 | 0 | 5 | 0 | 52 | 416.55 | 8 | ↓ |