General Information of the Compound
| Compound ID |
CP0746874
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| Compound Name |
3-(1-Naphthylmethoxy)-5-nitro-1-(2-(pyrrolidin-1-yl)ethyl)indazole
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| Structure |
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| Formula |
C24H24N4O3
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| Molecular Weight |
416.481
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| Canonical SMILES |
O=[N+]([O-])c1ccc2c(c1)c(OCc1cccc3ccccc13)nn2CCN1CCCC1
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| InChI |
InChI=1S/C24H24N4O3/c29-28(30)20-10-11-23-22(16-20)24(25-27(23)15-14-26-12-3-4-13-26)31-17-19-8-5-7-18-6-1-2-9-21(18)19/h1-2,5-11,16H,3-4,12-15,17H2
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| InChIKey |
WIAPWRWFWPMXNO-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