General Information of the Compound
| Compound ID |
CP0452482
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| Compound Name |
5-chloro-4-(4-methoxyphenoxy)-2-(4-pentylphenyl)pyridazin-3-one
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| Structure |
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| Formula |
C22H23ClN2O3
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| Molecular Weight |
398.89
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| Canonical SMILES |
CCCCCc1ccc(cc1)-n1ncc(Cl)c(Oc2ccc(OC)cc2)c1=O
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| InChI |
InChI=1S/C22H23ClN2O3/c1-3-4-5-6-16-7-9-17(10-8-16)25-22(26)21(20(23)15-24-25)28-19-13-11-18(27-2)12-14-19/h7-15H,3-6H2,1-2H3
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| InChIKey |
IKBWUBRQHGVCRZ-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