| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2005 | 18 | No |
Popular Name: 4-(3,4-dimethoxyanilino)-4-oxobut-2-enoic acid 4-(3,4-dimethoxyanilino)-4-oxobu…
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CAS Number: 468747-44-6
2-butenoic acid, 4-[(3,4-dimethoxyphenyl)amino]-4-oxo-
| 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) | 0.53 | -0.02 | -49.34 | 1 | 6 | -1 | 87 | 250.23 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 119 - 121 | Enamine Building Blocks |
| MP | 119...121 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
