General Information of the Compound
| Compound ID |
CP0379504
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| Compound Name |
1-(4-chlorophenyl)-N-cyclohexyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-3-carboxamide
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| Structure |
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| Formula |
C20H21ClN4O
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| Molecular Weight |
368.868
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| Canonical SMILES |
Clc1ccc(cc1)-n1nc(cc1-n1cccc1)C(=O)NC1CCCCC1
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| InChI |
InChI=1S/C20H21ClN4O/c21-15-8-10-17(11-9-15)25-19(24-12-4-5-13-24)14-18(23-25)20(26)22-16-6-2-1-3-7-16/h4-5,8-14,16H,1-3,6-7H2,(H,22,26)
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| InChIKey |
JRJFRWURMSBKJJ-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