In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 21 | Yes |
Popular Name: 3-(3-fluorophenyl)-5-(3-methylbut-2-enyl)-6,7-dihydro-4H-isoxazolo[4,5-c]pyridine 3-(3-fluorophenyl)-5-(3-methylbu…
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) | 3.92 | 10.25 | -42.74 | 1 | 3 | 1 | 30 | 287.358 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 7.98 | -8.33 | 0 | 3 | 0 | 29 | 286.35 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.