General Information of the Compound
| Compound ID |
CP0383071
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| Compound Name |
5-Methoxy-benzofuran-2-carboxylic acid {4-[(3-chloro-4-hydroxy-benzoyl)-hydrazonomethyl]-3-methoxy-phenyl}-amide
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| Structure |
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| Formula |
C25H20ClN3O6
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| Molecular Weight |
493.903
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| Canonical SMILES |
COc1ccc2oc(cc2c1)C(=O)Nc1ccc(\C=N\NC(=O)c2ccc(O)c(Cl)c2)c(OC)c1
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| InChI |
InChI=1S/C25H20ClN3O6/c1-33-18-6-8-21-16(9-18)11-23(35-21)25(32)28-17-5-3-15(22(12-17)34-2)13-27-29-24(31)14-4-7-20(30)19(26)10-14/h3-13,30H,1-2H3,(H,28,32)(H,29,31)/b27-13+
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| InChIKey |
RKLATBSQNCJINX-UVHMKAGCSA-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