In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 37 | Yes |
Popular Name: N-[2-(azepan-1-yl)ethyl]-[(4-fluorophenyl)methyl]-dioxo-BLAHcarboxamide N-[2-(azepan-1-yl)ethyl]-[(4-flu…
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) | 4.79 | 12.51 | -73.98 | 2 | 6 | 1 | 71 | 520.65 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.