In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 14 | No |
Popular Name: (E)-2-methyl-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoic (E)-2-methyl-3-(1,3,5-trimethylp…
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) | 1.10 | 5.64 | -50.17 | 0 | 4 | -1 | 58 | 193.226 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 5.77 | -55.45 | 1 | 4 | 0 | 59 | 194.234 | 2 | ↓ |