| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2010 | 19 | Yes |
Popular Name: (2R)-3-[[(1R,2S)-2-amino-1-(3-pyridyl)butyl]-ethyl-amino]-2-methyl-propanenitrile (2R)-3-[[(1R,2S)-2-amino-1-(3-py…
| 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) | 1.34 | 2.92 | -53.85 | 3 | 4 | 1 | 68 | 261.393 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.34 | 5.75 | -126.98 | 4 | 4 | 2 | 69 | 262.401 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.34 | 3.36 | -119.87 | 4 | 4 | 2 | 69 | 262.401 | 7 | ↓ |
