| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 19 | No |
Popular Name: (E)-3-[5-[[(2S)-2-cyanopropyl]-methyl-amino]-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic (E)-3-[5-[[(2S)-2-cyanopropyl]-m…
| 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) | 1.09 | 6.14 | -67.39 | 1 | 6 | 0 | 86 | 262.313 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.09 | 6.02 | -58.97 | 0 | 6 | -1 | 85 | 261.305 | 5 | ↓ |
