General Information of the Compound
| Compound ID |
CP0435516
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| Compound Name |
N-[5-(4-methoxyphenoxy)-6-oxo-1-(4-propan-2-ylphenyl)pyridazin-4-yl]acetamide
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| Structure |
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| Formula |
C22H23N3O4
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| Molecular Weight |
393.443
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| Canonical SMILES |
COc1ccc(Oc2c(NC(C)=O)cnn(-c3ccc(cc3)C(C)C)c2=O)cc1
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| InChI |
InChI=1S/C22H23N3O4/c1-14(2)16-5-7-17(8-6-16)25-22(27)21(20(13-23-25)24-15(3)26)29-19-11-9-18(28-4)10-12-19/h5-14H,1-4H3,(H,24,26)
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| InChIKey |
XFEAXFKIVNNTBQ-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