| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 13 | Yes |
Popular Name: (2S)-3-[ethyl-[3-(methylamino)propyl]amino]-2-methyl-propanenitrile (2S)-3-[ethyl-[3-(methylamino)pr…
| 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) | 1.31 | 3.8 | -42.97 | 2 | 3 | 1 | 44 | 184.307 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 5.66 | -112.83 | 3 | 3 | 2 | 45 | 185.315 | 7 | ↓ |
