General Information of the Compound
| Compound ID |
CP0413191
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| Compound Name |
4-Biphenyl-2-yl-3-biphenyl-4-yl-5-methyl-4H-1,2,4-triazole
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| Structure |
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| Formula |
C27H21N3
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| Molecular Weight |
387.486
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| Canonical SMILES |
Cc1nnc(-c2ccc(cc2)-c2ccccc2)n1-c1ccccc1-c1ccccc1
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| InChI |
InChI=1S/C27H21N3/c1-20-28-29-27(24-18-16-22(17-19-24)21-10-4-2-5-11-21)30(20)26-15-9-8-14-25(26)23-12-6-3-7-13-23/h2-19H,1H3
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| InChIKey |
YBUBXZYPRZBSRR-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