In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2009 | 21 | Yes |
Popular Name: 2-[4-[2-[cyclohexyl(ethyl)amino]ethoxy]phenyl]acetonitrile 2-[4-[2-[cyclohexyl(ethyl)amino]…
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) | 4.27 | 11.01 | -38.72 | 1 | 3 | 1 | 37 | 287.427 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.27 | 8.95 | -8.44 | 0 | 3 | 0 | 36 | 286.419 | 7 | ↓ |