General Information of the Compound
| Compound ID |
CP0440706
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| Compound Name |
N-cyclohexyl-1-(2,4-dichlorophenyl)-5-(2,5-dichloropyrrol-1-yl)-4-methylpyrazole-3-carboxamide
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| Structure |
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| Formula |
C21H20Cl4N4O
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| Molecular Weight |
486.23
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| Canonical SMILES |
Cc1c(nn(c1-n1c(Cl)ccc1Cl)-c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1
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| InChI |
InChI=1S/C21H20Cl4N4O/c1-12-19(20(30)26-14-5-3-2-4-6-14)27-29(16-8-7-13(22)11-15(16)23)21(12)28-17(24)9-10-18(28)25/h7-11,14H,2-6H2,1H3,(H,26,30)
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| InChIKey |
SYHZPKNXHWXRFH-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