In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2006 | 23 | Yes |
Popular Name: N-(5-bromo-2-pyridyl)-5-tert-butyl-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxamide N-(5-bromo-2-pyridyl)-5-tert-but…
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) | 4.36 | 8.82 | -9.87 | 1 | 5 | 0 | 68 | 378.27 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.36 | 8.57 | -26.38 | 2 | 5 | 1 | 69 | 379.278 | 3 | ↓ |