General Information of the Compound
| Compound ID |
CP0395853
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| Compound Name |
(2Z)-2-[[5-bromo-1-(cyclohexylmethyl)indol-3-yl]methylidene]-4,6-dihydroxy-1-benzofuran-3-one
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| Structure |
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| Formula |
C24H22BrNO4
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| Molecular Weight |
468.347
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| Canonical SMILES |
Oc1cc2O\C(=C/c3cn(CC4CCCCC4)c4ccc(Br)cc34)C(=O)c2c(O)c1
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| InChI |
InChI=1S/C24H22BrNO4/c25-16-6-7-19-18(9-16)15(13-26(19)12-14-4-2-1-3-5-14)8-22-24(29)23-20(28)10-17(27)11-21(23)30-22/h6-11,13-14,27-28H,1-5,12H2/b22-8-
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| InChIKey |
OLPWWAZBULMGSC-UYOCIXKTSA-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