General Information of the Compound
| Compound ID |
CP0382656
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| Compound Name |
N-[2-[2-(3-methoxyphenyl)ethyl]phenyl]pyridine-3-carboxamide
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| Structure |
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| Formula |
C21H20N2O2
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| Molecular Weight |
332.403
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| Canonical SMILES |
COc1cccc(CCc2ccccc2NC(=O)c2cccnc2)c1
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| InChI |
InChI=1S/C21H20N2O2/c1-25-19-9-4-6-16(14-19)11-12-17-7-2-3-10-20(17)23-21(24)18-8-5-13-22-15-18/h2-10,13-15H,11-12H2,1H3,(H,23,24)
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| InChIKey |
ZPGAAIQKBCLAPC-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