In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 19 | Yes |
Popular Name: 2-[4-[[(1R)-1-(4-pyridyl)ethyl]amino]phenoxy]acetonitrile 2-[4-[[(1R)-1-(4-pyridyl)ethyl]a…
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) | 2.31 | 6.06 | -11.33 | 1 | 4 | 0 | 58 | 253.305 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.31 | 6.49 | -45.46 | 2 | 4 | 1 | 59 | 254.313 | 5 | ↓ |