| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 20 | No |
Popular Name: (E)-3-[5-[[(2S)-2-cyanopropyl]-ethyl-amino]-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic (E)-3-[5-[[(2S)-2-cyanopropyl]-e…
| 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) | 1.46 | 7.33 | -53.77 | 0 | 6 | -1 | 85 | 275.332 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 7.45 | -60.9 | 1 | 6 | 0 | 86 | 276.34 | 6 | ↓ |
