General Information of the Compound
| Compound ID |
CP0549398
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| Compound Name |
3-(naphthalen-2-ylmethoxy)-5-nitro-1-propylindazole
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| Structure |
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| Formula |
C21H19N3O3
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| Molecular Weight |
361.401
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| Canonical SMILES |
CCCn1nc(OCc2ccc3ccccc3c2)c2cc(ccc12)[N+]([O-])=O
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| InChI |
InChI=1S/C21H19N3O3/c1-2-11-23-20-10-9-18(24(25)26)13-19(20)21(22-23)27-14-15-7-8-16-5-3-4-6-17(16)12-15/h3-10,12-13H,2,11,14H2,1H3
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| InChIKey |
CVLQXGDFJBICRN-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