General Information of the Compound
| Compound ID |
CP0505372
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| Compound Name |
5-methyl-3-phenylethynyl[1,2,4]triazine
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| Synonyms |
1,2,4-Triazine, 5-methyl-3-(2-phenylethynyl)-
5-methyl-3-phenylethynyl[1,2,4]triazine
945915-49-1
BDBM50215455
CHEMBL227199
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| Structure |
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| Formula |
C12H9N3
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| Molecular Weight |
195.225
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| Canonical SMILES |
Cc1cnnc(n1)C#Cc1ccccc1
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| InChI |
InChI=1S/C12H9N3/c1-10-9-13-15-12(14-10)8-7-11-5-3-2-4-6-11/h2-6,9H,1H3
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| InChIKey |
PXUGAXNBWJVVQY-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
Clinical Information about the Compound