| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 19 | Yes |
Popular Name: 2-[4-[2-[[(1S)-1,2-dimethylpropyl]-methyl-amino]ethoxy]phenyl]acetonitrile 2-[4-[2-[[(1S)-1,2-dimethylpropy…
| 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) | 3.44 | 9.75 | -38.67 | 1 | 3 | 1 | 37 | 261.389 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 7.81 | -8.89 | 0 | 3 | 0 | 36 | 260.381 | 7 | ↓ |
