General Information of the Compound
Compound ID |
CP0421491
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Compound Name |
3-(1-methylpyrazol-4-yl)-5-[1-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]-1H-pyrazolo[4,3-b]pyridine
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Structure |
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Formula |
C17H15F3N8
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Molecular Weight |
388.357
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Canonical SMILES |
Cn1cc(cn1)-c1n[nH]c2ccc(nc12)N1CCn2cnc(c2C1)C(F)(F)F
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InChI |
InChI=1S/C17H15F3N8/c1-26-7-10(6-22-26)14-15-11(24-25-14)2-3-13(23-15)27-4-5-28-9-21-16(12(28)8-27)17(18,19)20/h2-3,6-7,9H,4-5,8H2,1H3,(H,24,25)
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InChIKey |
WJGOGIYVTGUDJS-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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