| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 20 | Yes |
Popular Name: 2-[4-[2-[methyl-[(1S)-1,2,2-trimethylpropyl]amino]ethoxy]phenyl]acetonitrile 2-[4-[2-[methyl-[(1S)-1,2,2-trim…
| 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) | 4.02 | 9.96 | -38.2 | 1 | 3 | 1 | 37 | 275.416 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.02 | 8.54 | -8.25 | 0 | 3 | 0 | 36 | 274.408 | 7 | ↓ |
