General Information of the Compound
| Compound ID |
CP0494059
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| Compound Name |
2-[1-(2-morpholin-4-ylethyl)-3-(naphthalene-1-carbonyl)indol-5-yl]oxyacetic acid
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| Structure |
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| Formula |
C27H26N2O5
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| Molecular Weight |
458.514
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| Canonical SMILES |
OC(=O)COc1ccc2n(CCN3CCOCC3)cc(C(=O)c3cccc4ccccc34)c2c1
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| InChI |
InChI=1S/C27H26N2O5/c30-26(31)18-34-20-8-9-25-23(16-20)24(17-29(25)11-10-28-12-14-33-15-13-28)27(32)22-7-3-5-19-4-1-2-6-21(19)22/h1-9,16-17H,10-15,18H2,(H,30,31)
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| InChIKey |
ZJKXVAVMNZYDNM-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