General Information of the Compound
Compound ID |
CP0503391
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Compound Name |
N-[4-[2-[di(propan-2-yl)amino]ethoxy]phenyl]-9-oxofluorene-2-carboxamide
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Structure |
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Formula |
C28H30N2O3
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Molecular Weight |
442.559
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Canonical SMILES |
CC(C)N(CCOc1ccc(NC(=O)c2ccc3-c4ccccc4C(=O)c3c2)cc1)C(C)C
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InChI |
InChI=1S/C28H30N2O3/c1-18(2)30(19(3)4)15-16-33-22-12-10-21(11-13-22)29-28(32)20-9-14-24-23-7-5-6-8-25(23)27(31)26(24)17-20/h5-14,17-19H,15-16H2,1-4H3,(H,29,32)
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InChIKey |
VOOLRVWMZSQHEC-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