General Information of the Compound
| Compound ID |
CP0577290
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| Compound Name |
methyl 2-[(4-benzoylbenzoyl)amino]-1,3-benzothiazole-6-carboxylate
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| Structure |
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| Formula |
C23H16N2O4S
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| Molecular Weight |
416.458
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| Canonical SMILES |
COC(=O)c1ccc2nc(NC(=O)c3ccc(cc3)C(=O)c3ccccc3)sc2c1
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| InChI |
InChI=1S/C23H16N2O4S/c1-29-22(28)17-11-12-18-19(13-17)30-23(24-18)25-21(27)16-9-7-15(8-10-16)20(26)14-5-3-2-4-6-14/h2-13H,1H3,(H,24,25,27)
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| InChIKey |
DZHVRSUZJWSLFJ-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