General Information of the Compound
Compound ID |
CP0441067
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Compound Name |
methyl 3-[(9-oxofluorene-1-carbonyl)amino]benzoate
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Structure |
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Formula |
C22H15NO4
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Molecular Weight |
357.365
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Canonical SMILES |
COC(=O)c1cccc(NC(=O)c2cccc3-c4ccccc4C(=O)c23)c1
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InChI |
InChI=1S/C22H15NO4/c1-27-22(26)13-6-4-7-14(12-13)23-21(25)18-11-5-10-16-15-8-2-3-9-17(15)20(24)19(16)18/h2-12H,1H3,(H,23,25)
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InChIKey |
DNLKEYDSXUTYLC-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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