General Information of the Compound
| Compound ID |
CP0124812
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| Compound Name |
3-(Pyridin-2-ylethynyl)-1H-indazole
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| Structure |
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| Formula |
C14H9N3
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| Molecular Weight |
219.247
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| Canonical SMILES |
c1ccc(nc1)C#Cc1n[nH]c2ccccc12
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| InChI |
InChI=1S/C14H9N3/c1-2-7-13-12(6-1)14(17-16-13)9-8-11-5-3-4-10-15-11/h1-7,10H,(H,16,17)
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| InChIKey |
PDHRIFYPBBUERI-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