General Information of the Compound
| Compound ID |
CP0561262
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| Compound Name |
16-ethyl-12,12-dimethyl-8-(2-methyloctan-2-yl)-3,11-dioxa-15,16-diazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2(7),8,13(17),14-pentaene
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| Structure |
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| Formula |
C26H38N2O2
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| Molecular Weight |
410.602
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| Canonical SMILES |
CCCCCCC(C)(C)c1cc2OC(C)(C)c3cnn(CC)c3-c2c2OCCCc12
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| InChI |
InChI=1S/C26H38N2O2/c1-7-9-10-11-14-25(3,4)19-16-21-22(24-18(19)13-12-15-29-24)23-20(26(5,6)30-21)17-27-28(23)8-2/h16-17H,7-15H2,1-6H3
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| InChIKey |
RCKHMOCSJZRSNE-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