In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2005 | 28 | Yes |
Popular Name: 2-[[6-[(4-ethoxyphenyl)methyl]-5-oxo-4H-1,2,4-triazin-3-yl]sulfanyl]-N-phenyl-acetamide 2-[[6-[(4-ethoxyphenyl)methyl]-5…
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) | 3.96 | 5.27 | -46.97 | 1 | 7 | -1 | 100 | 395.464 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.50 | 6.69 | -14.27 | 2 | 7 | 0 | 97 | 396.472 | 8 | ↓ |