General Information of the Compound
| Compound ID |
CP0447987
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| Compound Name |
5-chloro-4-(3-ethylphenoxy)-2-(naphthalen-1-ylmethyl)pyridazin-3-one
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| Structure |
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| Formula |
C23H19ClN2O2
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| Molecular Weight |
390.87
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| Canonical SMILES |
CCc1cccc(Oc2c(Cl)cnn(Cc3cccc4ccccc34)c2=O)c1
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| InChI |
InChI=1S/C23H19ClN2O2/c1-2-16-7-5-11-19(13-16)28-22-21(24)14-25-26(23(22)27)15-18-10-6-9-17-8-3-4-12-20(17)18/h3-14H,2,15H2,1H3
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| InChIKey |
JUXDWFJELXVPRG-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