In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 18 | Yes |
Popular Name: 1-(3-bromo-2-thienyl)-2-[propyl(2,2,2-trifluoroethyl)amino]ethanone 1-(3-bromo-2-thienyl)-2-[propyl(…
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) | 3.93 | 6.81 | -9.57 | 0 | 2 | 0 | 20 | 344.196 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.93 | 8.68 | -41.69 | 1 | 2 | 1 | 22 | 345.204 | 7 | ↓ |