| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 21 | Yes |
Popular Name: 4-[[(1S)-2-(diethylamino)-1-methyl-ethyl]amino]-2-(trifluoromethyl)benzonitrile 4-[[(1S)-2-(diethylamino)-1-meth…
| 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) | 4.15 | 8.94 | -48.73 | 2 | 3 | 1 | 40 | 300.348 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.15 | 6.4 | -7.19 | 1 | 3 | 0 | 39 | 299.34 | 7 | ↓ |
