General Information of the Compound
| Compound ID |
CP0461846
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| Compound Name |
4-{[1-(2-Decyl-benzofuran-5-yl)-ethyl]-hydroxy-carbamoyl}-butyric acid methyl ester
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| Structure |
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| Formula |
C26H39NO5
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| Molecular Weight |
445.6
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| Canonical SMILES |
CCCCCCCCCCc1cc2cc(ccc2o1)C(C)N(O)C(=O)CCCC(=O)OC
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| InChI |
InChI=1S/C26H39NO5/c1-4-5-6-7-8-9-10-11-13-23-19-22-18-21(16-17-24(22)32-23)20(2)27(30)25(28)14-12-15-26(29)31-3/h16-20,30H,4-15H2,1-3H3
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| InChIKey |
QNVZXMPQRYPJPM-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