General Information of the Compound
| Compound ID |
CP0361107
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| Compound Name |
3-(pyrazolo[1,5-a]pyridin-5-ylmethyl)-5-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine
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| Structure |
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| Formula |
C17H12F3N9
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| Molecular Weight |
399.34
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| Canonical SMILES |
FC(F)(F)Cn1cc(cn1)-c1cnc2nnn(Cc3ccn4nccc4c3)c2n1
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| InChI |
InChI=1S/C17H12F3N9/c18-17(19,20)10-27-9-12(6-23-27)14-7-21-15-16(24-14)29(26-25-15)8-11-2-4-28-13(5-11)1-3-22-28/h1-7,9H,8,10H2
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| InChIKey |
ACOZYEDLBCELKS-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
Protein ID: PT01201, Hepatocyte growth factor receptor
Cell Viability or Cytotoxicity Assay
| Cell Line ID | Cell Line Name | Cell Line Organism | |
| CL000450 | NCI-H441 | Homo sapiens (Human) | 1 |
| 1 |
IC50 = 77 nM
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