General Information of the Compound
| Compound ID |
CP0555457
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| Compound Name |
3-(naphthalen-1-ylmethoxy)-5-nitro-1H-indazole
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| Structure |
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| Formula |
C18H13N3O3
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| Molecular Weight |
319.32
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| Canonical SMILES |
[O-][N+](=O)c1ccc2[nH]nc(OCc3cccc4ccccc34)c2c1
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| InChI |
InChI=1S/C18H13N3O3/c22-21(23)14-8-9-17-16(10-14)18(20-19-17)24-11-13-6-3-5-12-4-1-2-7-15(12)13/h1-10H,11H2,(H,19,20)
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| InChIKey |
PLOCEKRMGCPYFY-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