General Information of the Compound
| Compound ID |
CP0482765
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| Compound Name |
methyl 4-(adamantane-1-carbonylamino)-2-methylpyrazole-3-carboxylate
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| Structure |
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| Formula |
C17H23N3O3
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| Molecular Weight |
317.389
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| Canonical SMILES |
COC(=O)c1c(NC(=O)C23CC4CC(CC(C4)C2)C3)cnn1C
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| InChI |
InChI=1S/C17H23N3O3/c1-20-14(15(21)23-2)13(9-18-20)19-16(22)17-6-10-3-11(7-17)5-12(4-10)8-17/h9-12H,3-8H2,1-2H3,(H,19,22)
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| InChIKey |
RPUNCBUJNMVQOD-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