In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2010 | 19 | No |
Popular Name: N-tert-butyl-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide N-tert-butyl-2-[3-(2-thienyl)-5-…
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) | 2.36 | 6.76 | -55.29 | 1 | 5 | -1 | 60 | 295.413 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 6.61 | -15.41 | 2 | 5 | 0 | 63 | 296.421 | 4 | ↓ |