In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2004 | 32 | Yes |
Popular Name: 4-[[[5-(4-methoxyphenyl)-4-o-cumenyl-1,2,4-triazol-3-yl]thio]methyl]benzonitrile 4-[[[5-(4-methoxyphenyl)-4-o-cum…
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) | 6.38 | 16.13 | -13.06 | 0 | 5 | 0 | 64 | 440.572 | 7 | ↓ |