In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 20 | Yes |
Popular Name: 2-[3-(4-chlorophenyl)-6,7-dihydro-4H-isoxazolo[4,5-c]pyridin-5-yl]acetamide 2-[3-(4-chlorophenyl)-6,7-dihydr…
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) | 1.52 | 2.69 | -12.71 | 2 | 5 | 0 | 72 | 291.738 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 4.9 | -51.67 | 3 | 5 | 1 | 74 | 292.746 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.