| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 13 | Yes |
Popular Name: (2S)-3-[2-dimethylaminoethyl(ethyl)amino]-2-methyl-propanenitrile (2S)-3-[2-dimethylaminoethyl(eth…
| 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) | 1.28 | 5.07 | -40.07 | 1 | 3 | 1 | 31 | 184.307 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 2.6 | -4.51 | 0 | 3 | 0 | 30 | 183.299 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.28 | 6.92 | -118.07 | 2 | 3 | 2 | 33 | 185.315 | 6 | ↓ |
