General Information of the Compound
| Compound ID |
CP0547770
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| Compound Name |
5-[5-fluoro-2-(trifluoromethyl)phenyl]-1H-indazole
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| Structure |
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| Formula |
C14H8F4N2
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| Molecular Weight |
280.224
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| Canonical SMILES |
Fc1ccc(c(c1)-c1ccc2[nH]ncc2c1)C(F)(F)F
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| InChI |
InChI=1S/C14H8F4N2/c15-10-2-3-12(14(16,17)18)11(6-10)8-1-4-13-9(5-8)7-19-20-13/h1-7H,(H,19,20)
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| InChIKey |
TVAIIHSCCMEHLG-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