In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 17 | Yes |
Popular Name: azepan-1-yl-(3-ethyl-5-methyl-isoxazol-4-yl)methanone azepan-1-yl-(3-ethyl-5-methyl-is…
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) | 1.75 | 6.64 | -8.04 | 0 | 4 | 0 | 46 | 236.315 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.