General Information of the Compound
| Compound ID |
CP0431799
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| Compound Name |
1-(4-chlorophenyl)-N-(piperidin-1-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-3-carboxamide
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| Structure |
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| Formula |
C19H20ClN5O
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| Molecular Weight |
369.856
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| Canonical SMILES |
Clc1ccc(cc1)-n1nc(cc1-n1cccc1)C(=O)NN1CCCCC1
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| InChI |
InChI=1S/C19H20ClN5O/c20-15-6-8-16(9-7-15)25-18(23-10-4-5-11-23)14-17(21-25)19(26)22-24-12-2-1-3-13-24/h4-11,14H,1-3,12-13H2,(H,22,26)
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| InChIKey |
BNSNZABUVFFRKP-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