In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 12th, 2004 | 29 | Yes |
Popular Name: 4-[[[4-(2-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]methyl]benzonitrile 4-[[[4-(2-methoxyphenyl)-5-pheny…
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) | 5.34 | 3.72 | -15.79 | 0 | 5 | 0 | 63 | 398.491 | 6 | ↓ |