General Information of the Compound
| Compound ID |
CP0431801
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| Compound Name |
1-phenyl-N-(piperidin-1-yl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-3-carboxamide
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| Structure |
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| Formula |
C19H21N5O
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| Molecular Weight |
335.411
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| Canonical SMILES |
O=C(NN1CCCCC1)c1cc(-n2cccc2)n(n1)-c1ccccc1
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| InChI |
InChI=1S/C19H21N5O/c25-19(21-23-13-5-2-6-14-23)17-15-18(22-11-7-8-12-22)24(20-17)16-9-3-1-4-10-16/h1,3-4,7-12,15H,2,5-6,13-14H2,(H,21,25)
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| InChIKey |
CXCNTDBGIZFJEC-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