General Information of the Compound
| Compound ID |
CP0485563
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| Compound Name |
ethyl 4-(4-hydroxy-5-oxo-3-pentanoyl-2-phenyl-2H-pyrrol-1-yl)benzoate
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| Structure |
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| Formula |
C24H25NO5
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| Molecular Weight |
407.466
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| Canonical SMILES |
CCCCC(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1ccc(cc1)C(=O)OCC
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| InChI |
InChI=1S/C24H25NO5/c1-3-5-11-19(26)20-21(16-9-7-6-8-10-16)25(23(28)22(20)27)18-14-12-17(13-15-18)24(29)30-4-2/h6-10,12-15,21,27H,3-5,11H2,1-2H3
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| InChIKey |
MCFUOUZLUPZJBC-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