General Information of the Compound
Compound ID |
CP0493747
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Compound Name |
N-(4-ethylphenyl)-2-[5-[(2-methoxyphenyl)methyl]-3-methyl-6-oxopyridazin-1-yl]acetamide
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Structure |
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Formula |
C23H25N3O3
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Molecular Weight |
391.471
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Canonical SMILES |
CCc1ccc(NC(=O)Cn2nc(C)cc(Cc3ccccc3OC)c2=O)cc1
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InChI |
InChI=1S/C23H25N3O3/c1-4-17-9-11-20(12-10-17)24-22(27)15-26-23(28)19(13-16(2)25-26)14-18-7-5-6-8-21(18)29-3/h5-13H,4,14-15H2,1-3H3,(H,24,27)
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InChIKey |
SAHXQKHCYJMGLY-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