| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 14 | Yes |
Popular Name: (2S)-3-[[(1R,2S)-2-aminocyclopentyl]-ethyl-amino]-2-methyl-propanenitrile (2S)-3-[[(1R,2S)-2-aminocyclopen…
| 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) | 1.01 | 4.58 | -45.01 | 3 | 3 | 1 | 55 | 196.318 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 5.56 | -127.39 | 4 | 3 | 2 | 56 | 197.326 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 5.45 | -39.46 | 3 | 3 | 1 | 54 | 196.318 | 4 | ↓ |
