In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2006 | 20 | Yes |
Popular Name: N-methyl-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-methyl-2-[[5-[(2-methylphenoxy…
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) | 1.57 | 4.39 | -21.91 | 2 | 6 | 0 | 80 | 292.364 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.57 | 4.24 | -48.18 | 1 | 6 | -1 | 78 | 291.356 | 6 | ↓ |