General Information of the Compound
| Compound ID |
CP0432022
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| Compound Name |
5-benzyl-3-(2-chlorophenyl)-1H-1,2,4-triazole
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| Structure |
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| Formula |
C15H12ClN3
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| Molecular Weight |
269.735
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| Canonical SMILES |
Clc1ccccc1-c1n[nH]c(Cc2ccccc2)n1
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| InChI |
InChI=1S/C15H12ClN3/c16-13-9-5-4-8-12(13)15-17-14(18-19-15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,17,18,19)
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| InChIKey |
OBYJDAHTJUNYFJ-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: PT01555, Oxysterols receptor LXR-alpha
Protein ID: PT01887, Oxysterols receptor LXR-beta