In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2008 | 24 | Yes |
Popular Name: 1-[3-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-isoxazolo[4,5-c]pyridin-5-yl]but-2-yn-1-one 1-[3-[4-(trifluoromethyl)phenyl]…
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) | 3.30 | 4.39 | -12.32 | 0 | 4 | 0 | 46 | 334.297 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.