In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 19 | Yes |
Popular Name: 1-[4-bromo-2-(4-chloro-3-methyl-phenoxy)phenyl]-N-methyl-methanamine 1-[4-bromo-2-(4-chloro-3-methyl-…
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) | 5.04 | 8.98 | -41.62 | 2 | 2 | 1 | 26 | 341.656 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.04 | 7.53 | -2.79 | 1 | 2 | 0 | 21 | 340.648 | 4 | ↓ |