| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2008 | 18 | No |
Popular Name: (E)-3-[5-(2-cyanoethyl-methyl-amino)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic (E)-3-[5-(2-cyanoethyl-methyl-am…
| 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) | 0.01 | 4.85 | -68.62 | 1 | 6 | 0 | 86 | 248.286 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.01 | 4.76 | -58.84 | 0 | 6 | -1 | 85 | 247.278 | 5 | ↓ |
