In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 29 | Yes |
Popular Name: 2-(3-benzhydryl-6,7-dihydro-4H-isoxazolo[4,5-c]pyridin-5-yl)-N-ethyl-N-methyl-acetamide 2-(3-benzhydryl-6,7-dihydro-4H-i…
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) | 3.56 | 13.16 | -55.57 | 1 | 5 | 1 | 51 | 390.507 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 10.98 | -15.41 | 0 | 5 | 0 | 50 | 389.499 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.