| BioID | bio198159 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1078460 |
|---|
| Molecular Formula | C14H16N2O6 |
|---|
| Molecular Weight | 308.29 |
|---|
| Molecular Weight (Monoisotopic) | 308.1008 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
|---|
| Target Name | None |
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| Synonyms | Diethyl 2-((4-Nitrophenylamino)Methylene)Malonate |
|---|
| Smiles | CCOC(=O)C(=CNc1ccc([N+](=O)[O-])cc1)C(=O)OCC |
|---|
| Inchi | InChI=1S/C14H16N2O6/c1-3-21-13(17)12(14(18)22-4-2)9-15-10-5-7-11(8-6-10)16(19)20/h5-9,15H,3-4H2,1-2H3 |
|---|
| Inchi Key | UYYMMFBRRNQYGI-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 8.0 |
|---|
| Bioactivities | 9.0 |
|---|
| Np Likeness Score | -1.17 |
|---|
| Records Key | ['1m, GC10'] |
|---|
| Records Name | ['diethyl 2-((4-nitrophenylamino)methylene)malonate'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
