General Information of the Compound
| Compound ID |
CP0440586
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| Compound Name |
5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(6-methylpyridin-3-yl)pyrazole-3-carboxamide
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| Structure |
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| Formula |
C23H17Cl3N4O
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| Molecular Weight |
471.775
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| Canonical SMILES |
Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)Nc1ccc(C)nc1
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| InChI |
InChI=1S/C23H17Cl3N4O/c1-13-3-9-18(12-27-13)28-23(31)21-14(2)22(15-4-6-16(24)7-5-15)30(29-21)20-10-8-17(25)11-19(20)26/h3-12H,1-2H3,(H,28,31)
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| InChIKey |
XQIUOZXRVSDJGB-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2