General Information of the Compound
| Compound ID |
CP0401726
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| Compound Name |
N-[2-[2-(2-acetamidoethoxy)ethoxy]ethyl]-5-[3-(4-methoxybenzoyl)-1-(oxan-4-ylmethyl)indol-7-yl]oxypentanamide
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| Structure |
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| Formula |
C35H47N3O8
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| Molecular Weight |
637.774
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| Canonical SMILES |
COc1ccc(cc1)C(=O)c1cn(CC2CCOCC2)c2c(OCCCCC(=O)NCCOCCOCCNC(C)=O)cccc12
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| InChI |
InChI=1S/C35H47N3O8/c1-26(39)36-15-20-44-22-23-45-21-16-37-33(40)8-3-4-17-46-32-7-5-6-30-31(35(41)28-9-11-29(42-2)12-10-28)25-38(34(30)32)24-27-13-18-43-19-14-27/h5-7,9-12,25,27H,3-4,8,13-24H2,1-2H3,(H,36,39)(H,37,40)
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| InChIKey |
VBAPZAPFIMXFJN-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