In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 15 | Yes |
Popular Name: 1-(5-bromo-2-thienyl)-2-[ethyl(isopropyl)amino]ethanone 1-(5-bromo-2-thienyl)-2-[ethyl(i…
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) | 3.37 | 7.87 | -32.83 | 1 | 2 | 1 | 22 | 291.234 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.37 | 5.92 | -4.32 | 0 | 2 | 0 | 20 | 290.226 | 5 | ↓ |