In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 22 | Yes |
Popular Name: N-ethyl-2-[[5-[(4-methoxyphenoxy)methyl]-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-ethyl-2-[[5-[(4-methoxyphenoxy…
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) | 1.61 | 3.65 | -12.36 | 2 | 7 | 0 | 89 | 322.39 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 3.45 | -46.19 | 1 | 7 | -1 | 87 | 321.382 | 8 | ↓ |