In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2004 | 31 | Yes |
Popular Name: 2-[[5-(4-tert-butylphenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-1-(2-naphthyl)ethanone 2-[[5-(4-tert-butylphenyl)-4-eth…
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) | 6.91 | 3.09 | -11.86 | 0 | 4 | 0 | 47 | 429.589 | 7 | ↓ |