In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 21 | Yes |
Popular Name: N-[[2-(4-bromo-2-fluoro-phenoxy)-3-pyridyl]methyl]-2-methyl-propan-1-amine N-[[2-(4-bromo-2-fluoro-phenoxy)…
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) | 4.33 | 7.7 | -39.73 | 2 | 3 | 1 | 39 | 354.243 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.33 | 6.47 | -6.91 | 1 | 3 | 0 | 34 | 353.235 | 6 | ↓ |