General Information of the Compound
| Compound ID |
CP0176061
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| Compound Name |
N-[(2,4-difluorophenyl)methyl]-5-piperazin-1-ylpyrazolo[1,5-a]pyrimidin-7-amine
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| Formula |
C17H18F2N6
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| Molecular Weight |
344.369
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| Canonical SMILES |
Fc1ccc(CNc2cc(nc3ccnn23)N2CCNCC2)c(F)c1
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| InChI |
InChI=1S/C17H18F2N6/c18-13-2-1-12(14(19)9-13)11-21-16-10-17(24-7-5-20-6-8-24)23-15-3-4-22-25(15)16/h1-4,9-10,20-21H,5-8,11H2
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| InChIKey |
HOKHNGDDTLBRMF-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