General Information of the Compound
| Compound ID |
CP0902913
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| Compound Name |
N-(5-cyano-2-(4-(2,4-difluorophenoxy)piperidin-1-yl)phenyl)-2,3-dimethyl-5-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxamide
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| Structure |
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| Formula |
C27H23F2N5O3S
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| Molecular Weight |
535.576
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| Canonical SMILES |
Cc1sc2ncc(C(=O)Nc3cc(C#N)ccc3N3CCC(Oc4ccc(F)cc4F)CC3)c(=O)n2c1C
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| InChI |
InChI=1S/C27H23F2N5O3S/c1-15-16(2)38-27-31-14-20(26(36)34(15)27)25(35)32-22-11-17(13-30)3-5-23(22)33-9-7-19(8-10-33)37-24-6-4-18(28)12-21(24)29/h3-6,11-12,14,19H,7-10H2,1-2H3,(H,32,35)
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| InChIKey |
JCQPOZNJSOYDEV-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