In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 27 | Yes |
Popular Name: 3-[3-tert-butyl-2-(4-pyridylmethoxy)pyrazolo[1,5-d][1,2,4]triazin-7-yl]-5-methyl-isoxazole 3-[3-tert-butyl-2-(4-pyridylmeth…
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) | 2.47 | 1.79 | -12.21 | 0 | 8 | 0 | 91 | 364.409 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 1.9 | -41.44 | 1 | 8 | 1 | 92 | 365.417 | 5 | ↓ |