General Information of the Compound
| Compound ID |
CP0521786
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| Compound Name |
5-(2-ethyl-5-naphthalen-1-ylpyrazol-3-yl)-1-methyl-1,2,4-triazole
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| Structure |
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| Formula |
C18H17N5
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| Molecular Weight |
303.369
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| Canonical SMILES |
CCn1nc(cc1-c1ncnn1C)-c1cccc2ccccc12
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| InChI |
InChI=1S/C18H17N5/c1-3-23-17(18-19-12-20-22(18)2)11-16(21-23)15-10-6-8-13-7-4-5-9-14(13)15/h4-12H,3H2,1-2H3
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| InChIKey |
JYGFFBQCZNEPMD-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C