In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | Yes |
Popular Name: N-[[4-(3,4-dimethylphenoxy)-3-fluoro-phenyl]methyl]ethanamine N-[[4-(3,4-dimethylphenoxy)-3-fl…
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) | 4.54 | 9.46 | -45.73 | 2 | 2 | 1 | 26 | 274.359 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.54 | 8.09 | -5.99 | 1 | 2 | 0 | 21 | 273.351 | 5 | ↓ |