In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 5th, 2007 | 24 | Yes |
Popular Name: 2-[[5-(4-hydroxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-pyridyl)acetamide 2-[[5-(4-hydroxyphenyl)-4-methyl…
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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) | 1.92 | -2.12 | -18.46 | 2 | 7 | 0 | 92 | 341.396 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | -2.47 | -37.96 | 3 | 7 | 1 | 94 | 342.404 | 5 | ↓ |