General Information of the Compound
| Compound ID |
CP0750882
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| Compound Name |
3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(5-fluoro-6-methoxypyridin-3-yl)-6-(piperazin-1-yl)imidazo[1,2-a]pyridin-2-amine
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| Structure |
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| Formula |
C21H23FN10O
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| Molecular Weight |
450.482
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| Canonical SMILES |
COc1ncc(Nc2nc3ccc(N4CCNCC4)cn3c2-c2nc(C)nc(N)n2)cc1F
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| InChI |
InChI=1S/C21H23FN10O/c1-12-26-18(30-21(23)27-12)17-19(28-13-9-15(22)20(33-2)25-10-13)29-16-4-3-14(11-32(16)17)31-7-5-24-6-8-31/h3-4,9-11,24,28H,5-8H2,1-2H3,(H2,23,26,27,30)
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| InChIKey |
QRUFDISOBAPRHT-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