In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 34 | Yes |
Popular Name: 4-[[[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]methyl]benzoate 4-[[[5-(4-tert-butylphenyl)-4-(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) | 7.04 | 2.94 | -55.31 | 0 | 6 | -1 | 80 | 472.59 | 8 | ↓ |