In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 31 | Yes |
Popular Name: N-(4-benzyloxyphenyl)-2-[(5-benzyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(4-benzyloxyphenyl)-2-[(5-benz…
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) | 4.83 | 11.63 | -12.96 | 2 | 6 | 0 | 80 | 430.533 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.83 | 11.43 | -46.08 | 1 | 6 | -1 | 78 | 429.525 | 9 | ↓ |