General Information of the Compound
| Compound ID |
CP0464163
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| Compound Name |
4-(3-phenoxylphenyl)-5-cyano-2H-1,2,3-triazole
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| Synonyms |
4-(3-phenoxylphenyl)-5-cyano-2H-1,2,3-triazole
BDBM50200766
CHEMBL428206
CTK8F9477
SCHEMBL17969160
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| Structure |
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| Formula |
C15H10N4O
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| Molecular Weight |
262.272
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| Canonical SMILES |
N#Cc1[nH]nnc1-c1ccc(Oc2ccccc2)cc1
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| InChI |
InChI=1S/C15H10N4O/c16-10-14-15(18-19-17-14)11-6-8-13(9-7-11)20-12-4-2-1-3-5-12/h1-9H,(H,17,18,19)
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| InChIKey |
LHOBXXROLCTUBM-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