General Information of the Compound
| Compound ID |
CP0346209
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| Compound Name |
N-[2,4-difluoro-3-[8-methyl-2-(oxan-4-ylamino)-7-oxopyrido[2,3-d]pyrimidin-6-yl]phenyl]propane-1-sulfonamide
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| Structure |
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| Formula |
C22H25F2N5O4S
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| Molecular Weight |
493.536
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| Canonical SMILES |
CCCS(=O)(=O)Nc1ccc(F)c(c1F)-c1cc2cnc(NC3CCOCC3)nc2n(C)c1=O
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| InChI |
InChI=1S/C22H25F2N5O4S/c1-3-10-34(31,32)28-17-5-4-16(23)18(19(17)24)15-11-13-12-25-22(26-14-6-8-33-9-7-14)27-20(13)29(2)21(15)30/h4-5,11-12,14,28H,3,6-10H2,1-2H3,(H,25,26,27)
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| InChIKey |
YZAAVFCNANVFCT-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