| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2008 | 20 | No |
Popular Name: (E)-3-[1,3-dimethyl-5-(4-methyl-1,4-diazepan-1-yl)pyrazol-4-yl]prop-2-enoic (E)-3-[1,3-dimethyl-5-(4-methyl-…
| 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) | 0.72 | 6.54 | -69.6 | 1 | 6 | 0 | 66 | 278.356 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.72 | 4.42 | -52.39 | 0 | 6 | -1 | 64 | 277.348 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 6.63 | -93.75 | 2 | 6 | 1 | 67 | 279.364 | 3 | ↓ |
