In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: 4-{2-hydroxy-3-[(2,2,2-trifluoroethyl)amino]propoxy}benzonitrile 4-{2-hydroxy-3-[(2,2,2-trifluoro…
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) | 1.46 | 2.1 | -10.97 | 2 | 4 | 0 | 65 | 274.242 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 3.46 | -56.73 | 3 | 4 | 1 | 70 | 275.25 | 7 | ↓ |