In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 26 | Yes |
Popular Name: 4-(dimethylaminomethyl)-N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]benzamide 4-(dimethylaminomethyl)-N-[2-(6-…
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) | 2.62 | 8.48 | -50.17 | 2 | 5 | 1 | 52 | 359.421 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.62 | 6 | -12.48 | 1 | 5 | 0 | 51 | 358.413 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.