General Information of the Compound
| Compound ID |
CP0461076
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| Compound Name |
5-[2-(trifluoromethyl)phenyl]-1H-indazole-6-carbonitrile
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| Structure |
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| Formula |
C15H8F3N3
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| Molecular Weight |
287.244
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| Canonical SMILES |
FC(F)(F)c1ccccc1-c1cc2cn[nH]c2cc1C#N
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| InChI |
InChI=1S/C15H8F3N3/c16-15(17,18)13-4-2-1-3-11(13)12-5-10-8-20-21-14(10)6-9(12)7-19/h1-6,8H,(H,20,21)
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| InChIKey |
KXWZZRHVIAVSMX-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