| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 15 | Yes |
Popular Name: (2S)-3-[2-(diisopropylamino)ethylamino]-2-methyl-propanenitrile (2S)-3-[2-(diisopropylamino)ethy…
| 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) | 1.65 | 5.43 | -36.46 | 2 | 3 | 1 | 40 | 212.361 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.65 | 3.52 | -4.89 | 1 | 3 | 0 | 39 | 211.353 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 4.57 | -51.9 | 2 | 3 | 1 | 44 | 212.361 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 6.62 | -125.78 | 3 | 3 | 2 | 45 | 213.369 | 7 | ↓ |
