General Information of the Compound
| Compound ID |
CP0953834
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| Compound Name |
N-(5-cyano-2-(4-(2,4-difluorophenoxy)piperidin-1-yl)phenyl)-2-methyl-5-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxamide
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| Structure |
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| Formula |
C26H21F2N5O3S
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| Molecular Weight |
521.549
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| Canonical SMILES |
Cc1cn2c(=O)c(C(=O)Nc3cc(C#N)ccc3N3CCC(Oc4ccc(F)cc4F)CC3)cnc2s1
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| InChI |
InChI=1S/C26H21F2N5O3S/c1-15-14-33-25(35)19(13-30-26(33)37-15)24(34)31-21-10-16(12-29)2-4-22(21)32-8-6-18(7-9-32)36-23-5-3-17(27)11-20(23)28/h2-5,10-11,13-14,18H,6-9H2,1H3,(H,31,34)
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| InChIKey |
SGABXNSUMISYJS-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