General Information of the Compound
| Compound ID |
CP0517977
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| Compound Name |
4-(1-benzofuran-5-yloxy)-5-chloro-2-(naphthalen-1-ylmethyl)pyridazin-3-one
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| Structure |
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| Formula |
C23H15ClN2O3
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| Molecular Weight |
402.837
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| Canonical SMILES |
Clc1cnn(Cc2cccc3ccccc23)c(=O)c1Oc1ccc2occc2c1
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| InChI |
InChI=1S/C23H15ClN2O3/c24-20-13-25-26(14-17-6-3-5-15-4-1-2-7-19(15)17)23(27)22(20)29-18-8-9-21-16(12-18)10-11-28-21/h1-13H,14H2
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| InChIKey |
CHMDFROTHGRHIN-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