General Information of the Compound
| Compound ID |
CP0262132
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| Compound Name |
N-[3-(2-amino-8-methyl-7-oxopyrido[2,3-d]pyrimidin-6-yl)-2,4-difluorophenyl]propane-1-sulfonamide
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| Structure |
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| Formula |
C17H17F2N5O3S
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| Molecular Weight |
409.418
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| Canonical SMILES |
CCCS(=O)(=O)Nc1ccc(F)c(c1F)-c1cc2cnc(N)nc2n(C)c1=O
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| InChI |
InChI=1S/C17H17F2N5O3S/c1-3-6-28(26,27)23-12-5-4-11(18)13(14(12)19)10-7-9-8-21-17(20)22-15(9)24(2)16(10)25/h4-5,7-8,23H,3,6H2,1-2H3,(H2,20,21,22)
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| InChIKey |
QOMAVDVRJHWHNF-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