General Information of the Compound
| Compound ID |
CP0438926
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| Compound Name |
N-[4-fluoro-3-[3-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C23H14F4N6O
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| Molecular Weight |
466.398
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| Canonical SMILES |
Fc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1-c1ccnc2c(cnn12)-c1cn[nH]c1
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| InChI |
InChI=1S/C23H14F4N6O/c24-19-5-4-16(32-22(34)13-2-1-3-15(8-13)23(25,26)27)9-17(19)20-6-7-28-21-18(12-31-33(20)21)14-10-29-30-11-14/h1-12H,(H,29,30)(H,32,34)
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| InChIKey |
AHQVZQVSHSOLDM-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