General Information of the Compound
| Compound ID |
CP0416022
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| Compound Name |
(2Z)-2-[[3-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]phenyl]methylidene]-3-oxo-1-benzofuran-7-carboxamide
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| Structure |
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| Formula |
C26H20N4O4
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| Molecular Weight |
452.47
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| Canonical SMILES |
NC(=O)c1cccc2C(=O)\C(Oc12)=C\c1cccc(c1)C(=O)NCCc1nc2ccccc2[nH]1
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| InChI |
InChI=1S/C26H20N4O4/c27-25(32)18-8-4-7-17-23(31)21(34-24(17)18)14-15-5-3-6-16(13-15)26(33)28-12-11-22-29-19-9-1-2-10-20(19)30-22/h1-10,13-14H,11-12H2,(H2,27,32)(H,28,33)(H,29,30)/b21-14-
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| InChIKey |
YUGPMHBCTWCTLL-STZFKDTASA-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