| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 20 | Yes |
Popular Name: 3-[[[(2S)-2-dimethylamino-2-(2-thienyl)ethyl]amino]methyl]benzonitrile 3-[[[(2S)-2-dimethylamino-2-(2-t…
| 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) | 2.74 | 8.2 | -41.04 | 2 | 3 | 1 | 40 | 286.424 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.74 | 5.52 | -5.82 | 1 | 3 | 0 | 39 | 285.416 | 6 | ↓ |
