In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 21 | Yes |
Popular Name: N-[[4-bromo-2-(2,3-dimethylphenoxy)phenyl]methyl]propan-2-amine N-[[4-bromo-2-(2,3-dimethylpheno…
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) | 5.46 | 10.6 | -37.7 | 2 | 2 | 1 | 26 | 349.292 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.46 | 9.36 | -3.25 | 1 | 2 | 0 | 21 | 348.284 | 5 | ↓ |