General Information of the Compound
| Compound ID |
CP0462325
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| Compound Name |
2-Benzo[b]thiophen-3-yl-N-{4-[(3-chloro-4-hydroxy-benzoyl)-hydrazonomethyl]-2-methoxy-phenyl}-acetamide
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| Structure |
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| Formula |
C25H20ClN3O4S
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| Molecular Weight |
493.972
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| Canonical SMILES |
COc1cc(\C=N\NC(=O)c2ccc(O)c(Cl)c2)ccc1NC(=O)Cc1csc2ccccc12
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| InChI |
InChI=1S/C25H20ClN3O4S/c1-33-22-10-15(13-27-29-25(32)16-7-9-21(30)19(26)11-16)6-8-20(22)28-24(31)12-17-14-34-23-5-3-2-4-18(17)23/h2-11,13-14,30H,12H2,1H3,(H,28,31)(H,29,32)/b27-13+
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| InChIKey |
CBBZAZSQKGEJOQ-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