General Information of the Compound
| Compound ID |
CP0450488
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| Compound Name |
5-chloro-4-(4-methoxyphenoxy)-2-[(2-phenylphenyl)methyl]pyridazin-3-one
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| Structure |
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| Formula |
C24H19ClN2O3
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| Molecular Weight |
418.88
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| Canonical SMILES |
COc1ccc(Oc2c(Cl)cnn(Cc3ccccc3-c3ccccc3)c2=O)cc1
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| InChI |
InChI=1S/C24H19ClN2O3/c1-29-19-11-13-20(14-12-19)30-23-22(25)15-26-27(24(23)28)16-18-9-5-6-10-21(18)17-7-3-2-4-8-17/h2-15H,16H2,1H3
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| InChIKey |
JYYJBVRJKXYNIW-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