| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 16 | Yes |
Popular Name: 3-[2-(tert-butylamino)ethyl-isobutyl-amino]propanenitrile 3-[2-(tert-butylamino)ethyl-isob…
None
| 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) | 1.89 | 6.13 | -41.46 | 2 | 3 | 1 | 44 | 226.388 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.89 | 4.74 | -5.02 | 1 | 3 | 0 | 39 | 225.38 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.89 | 7.55 | -125.55 | 3 | 3 | 2 | 45 | 227.396 | 8 | ↓ |
