General Information of the Compound
| Compound ID |
CP0436586
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| Compound Name |
3-[(2-methyl-4-oxazolyl)ethynyl]pyridine
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| Structure |
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| Formula |
C11H8N2O
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| Molecular Weight |
184.198
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| Canonical SMILES |
Cc1nc(co1)C#Cc1cccnc1
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| InChI |
InChI=1S/C11H8N2O/c1-9-13-11(8-14-9)5-4-10-3-2-6-12-7-10/h2-3,6-8H,1H3
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| InChIKey |
KQIRWQXAQKJGBF-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