| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | Yes |
Popular Name: (2S)-3-[3-(tert-butylamino)propyl-ethyl-amino]-2-methyl-propanenitrile (2S)-3-[3-(tert-butylamino)propy…
| 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) | 2.49 | 5.6 | -40.3 | 2 | 3 | 1 | 44 | 226.388 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 7.48 | -113.2 | 3 | 3 | 2 | 45 | 227.396 | 8 | ↓ |
