General Information of the Compound
| Compound ID |
CP0055438
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| Compound Name |
3-(naphthalen-2-ylmethoxy)-1-(2-piperidin-1-ylethyl)indazole
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| Structure |
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| Formula |
C25H27N3O
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| Molecular Weight |
385.511
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| Canonical SMILES |
C(Cn1nc(OCc2ccc3ccccc3c2)c2ccccc12)N1CCCCC1
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| InChI |
InChI=1S/C25H27N3O/c1-6-14-27(15-7-1)16-17-28-24-11-5-4-10-23(24)25(26-28)29-19-20-12-13-21-8-2-3-9-22(21)18-20/h2-5,8-13,18H,1,6-7,14-17,19H2
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| InChIKey |
XGSMKAMHMWHCFH-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