General Information of the Compound
| Compound ID |
CP0015177
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| Compound Name |
3-[2-[(5-chloro-3-methylpyrazol-1-yl)methyl]-7-methyl-4-oxopyrazolo[1,5-a]pyrazin-5-yl]propanenitrile
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| Structure |
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| Formula |
C15H15ClN6O
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| Molecular Weight |
330.779
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| Canonical SMILES |
Cc1cc(Cl)n(Cc2cc3n(n2)c(C)cn(CCC#N)c3=O)n1
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| InChI |
InChI=1S/C15H15ClN6O/c1-10-6-14(16)21(18-10)9-12-7-13-15(23)20(5-3-4-17)8-11(2)22(13)19-12/h6-8H,3,5,9H2,1-2H3
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| InChIKey |
BMSKUNPQVZERGL-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