| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: 3-[[(1R)-2-amino-1-(1-methylpyrazol-4-yl)ethyl]-isobutyl-amino]propanenitrile 3-[[(1R)-2-amino-1-(1-methylpyra…
| 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) | -0.31 | 2.52 | -57.52 | 3 | 5 | 1 | 72 | 250.37 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | 2.15 | -9.17 | 2 | 5 | 0 | 71 | 249.362 | 7 | ↓ |
