In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 21 | Yes |
Popular Name: 3-[3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propoxy]benzonitrile 3-[3-[cyclopropyl(2,2,2-trifluor…
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) | 3.32 | 7.49 | -7.89 | 0 | 3 | 0 | 36 | 298.308 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 9.54 | -46.66 | 1 | 3 | 1 | 37 | 299.316 | 8 | ↓ |