In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2010 | 18 | No |
Popular Name: N-methyl-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide N-methyl-2-[3-(p-tolyl)-5-thioxo…
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) | 1.84 | 5.92 | -56.63 | 1 | 5 | -1 | 60 | 261.33 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.12 | 5.83 | -16.92 | 2 | 5 | 0 | 63 | 262.338 | 3 | ↓ |