| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 18 | Yes |
Popular Name: 3-[[(2S)-2-dimethylamino-2-(4-methoxyphenyl)ethyl]amino]propanenitrile 3-[[(2S)-2-dimethylamino-2-(4-me…
| 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) | 0.87 | 5.9 | -49.02 | 2 | 4 | 1 | 49 | 248.35 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.87 | 5.14 | -59.67 | 2 | 4 | 1 | 53 | 248.35 | 7 | ↓ |
