General Information of the Compound
| Compound ID |
CP0264787
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| Compound Name |
2-(1,2,3,6-Tetrahydro-pyridin-4-ylethynyl)-pyridine
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| Structure |
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| Formula |
C12H12N2
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| Molecular Weight |
184.242
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| Canonical SMILES |
C1CC(=CCN1)C#Cc1ccccn1
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| InChI |
InChI=1S/C12H12N2/c1-2-8-14-12(3-1)5-4-11-6-9-13-10-7-11/h1-3,6,8,13H,7,9-10H2
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| InChIKey |
UZNRTXNWHDCSNN-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