In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 19 | Yes |
Popular Name: 3-[[(1R,2S)-2-amino-1-(1-methylpyrazol-4-yl)butyl]-cyclopropyl-amino]propanenitrile 3-[[(1R,2S)-2-amino-1-(1-methylp…
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) | -0.13 | 3.22 | -54.24 | 3 | 5 | 1 | 72 | 262.381 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.13 | 5.51 | -125.39 | 4 | 5 | 2 | 74 | 263.389 | 7 | ↓ |