General Information of the Compound
| Compound ID |
CP0561287
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| Compound Name |
ethyl 4-(3-acetyl-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl)benzoate
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| Structure |
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| Formula |
C21H19NO5
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| Molecular Weight |
365.385
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| Canonical SMILES |
CCOC(=O)c1ccc(cc1)N1C(C(C(C)=O)=C(O)C1=O)c1ccccc1
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| InChI |
InChI=1S/C21H19NO5/c1-3-27-21(26)15-9-11-16(12-10-15)22-18(14-7-5-4-6-8-14)17(13(2)23)19(24)20(22)25/h4-12,18,24H,3H2,1-2H3
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| InChIKey |
CVQPUZPHCUWVPS-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound