In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 24 | Yes |
Popular Name: 2-[(2-bromo-4-fluoro-phenyl)methyl-propyl-amino]-N-(o-tolyl)acetamide 2-[(2-bromo-4-fluoro-phenyl)meth…
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) | 5.09 | 11.32 | -44.83 | 2 | 3 | 1 | 34 | 394.308 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.09 | 9.22 | -12.1 | 1 | 3 | 0 | 32 | 393.3 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.