In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2006 | 19 | Yes |
Popular Name: N-(3,5-dimethylphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(3,5-dimethylphenyl)-2-[(5-met…
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) | 2.03 | 6.02 | -18.81 | 2 | 5 | 0 | 71 | 276.365 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.03 | 5.86 | -45.37 | 1 | 5 | -1 | 69 | 275.357 | 4 | ↓ |