In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 21 | Yes |
Popular Name: 2-[3-[isopropyl(2,2,2-trifluoroethyl)amino]propoxy]benzonitrile 2-[3-[isopropyl(2,2,2-trifluoroe…
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) | 3.60 | 7.26 | -11.2 | 0 | 3 | 0 | 36 | 300.324 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.60 | 9.09 | -45.73 | 1 | 3 | 1 | 37 | 301.332 | 8 | ↓ |