| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 14 | Yes |
Popular Name: (2S)-3-[3-(isopropylamino)propyl-methyl-amino]-2-methyl-propanenitrile (2S)-3-[3-(isopropylamino)propyl…
| 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) | 1.60 | 4.56 | -40.99 | 2 | 3 | 1 | 44 | 198.334 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.60 | 6.62 | -113.71 | 3 | 3 | 2 | 45 | 199.342 | 7 | ↓ |
