General Information of the Compound
| Compound ID |
CP0496353
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| Compound Name |
N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C21H12F3N5O
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| Molecular Weight |
407.355
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| Canonical SMILES |
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ccnc2c(cnn12)C#N
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| InChI |
InChI=1S/C21H12F3N5O/c22-21(23,24)16-5-1-4-14(9-16)20(30)28-17-6-2-3-13(10-17)18-7-8-26-19-15(11-25)12-27-29(18)19/h1-10,12H,(H,28,30)
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| InChIKey |
KLQVNFICRLTGGF-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