In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2010 | 18 | Yes |
Popular Name: (2R)-2-(5-bromo-2-thienyl)-2-(2-chloro-4-fluoro-phenoxy)ethanamine (2R)-2-(5-bromo-2-thienyl)-2-(2-…
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) | 3.98 | 6.47 | -54.67 | 3 | 2 | 1 | 37 | 351.648 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.98 | 6.17 | -6.58 | 2 | 2 | 0 | 35 | 350.64 | 4 | ↓ |