General Information of the Compound
| Compound ID |
CP0931266
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| Compound Name |
N-(5-cyano-2-(4-(2,4-difluorophenoxy)piperidin-1-yl)phenyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide
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| Structure |
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| Formula |
C28H23F2N5O3
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| Molecular Weight |
515.52
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| Canonical SMILES |
Cc1cccn2c(=O)c(C(=O)Nc3cc(C#N)ccc3N3CCC(Oc4ccc(F)cc4F)CC3)cnc12
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| InChI |
InChI=1S/C28H23F2N5O3/c1-17-3-2-10-35-26(17)32-16-21(28(35)37)27(36)33-23-13-18(15-31)4-6-24(23)34-11-8-20(9-12-34)38-25-7-5-19(29)14-22(25)30/h2-7,10,13-14,16,20H,8-9,11-12H2,1H3,(H,33,36)
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| InChIKey |
HWFDWYNUWIFBTL-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