In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 21 | No |
Popular Name: 4-[3-[ethyl(2,2,2-trifluoroethyl)amino]propoxy]benzenecarbothioamide 4-[3-[ethyl(2,2,2-trifluoroethyl…
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) | 3.40 | 5.75 | -13.61 | 2 | 3 | 0 | 38 | 320.38 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.40 | 7.78 | -51.36 | 3 | 3 | 1 | 40 | 321.388 | 9 | ↓ |