In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2005 | 14 | No |
Popular Name: 2-butenoic acid, 4-(4-methyl-1-piperazinyl)-4-oxo- 2-butenoic acid, 4-(4-methyl-1-p…
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CAS Number: 129795-76-2
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) | -0.68 | 3.83 | -72.85 | 1 | 5 | 0 | 65 | 198.222 | 2 | ↓ |