General Information of the Compound
| Compound ID |
CP0459664
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| Compound Name |
5-[6-(trifluoromethyl)-1H-indazol-4-yl]pyridine-3-carbonitrile
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| Structure |
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| Formula |
C14H7F3N4
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| Molecular Weight |
288.232
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| Canonical SMILES |
FC(F)(F)c1cc(-c2cncc(c2)C#N)c2cn[nH]c2c1
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| InChI |
InChI=1S/C14H7F3N4/c15-14(16,17)10-2-11(12-7-20-21-13(12)3-10)9-1-8(4-18)5-19-6-9/h1-3,5-7H,(H,20,21)
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| InChIKey |
SCPCVOHBNFGSEL-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