General Information of the Compound
| Compound ID |
CP0248307
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| Compound Name |
N-(3,5-difluorophenyl)-2-[4-[6-methyl-8-[[3-(piperidin-1-ylmethyl)-1,2-thiazol-5-yl]amino]imidazo[1,2-a]pyrazin-3-yl]pyrazol-1-yl]acetamide
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| Structure |
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| Formula |
C27H27F2N9OS
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| Molecular Weight |
563.638
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| Canonical SMILES |
Cc1cn2c(cnc2c(Nc2cc(CN3CCCCC3)ns2)n1)-c1cnn(CC(=O)Nc2cc(F)cc(F)c2)c1
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| InChI |
InChI=1S/C27H27F2N9OS/c1-17-13-38-23(18-11-31-37(14-18)16-24(39)33-21-8-19(28)7-20(29)9-21)12-30-27(38)26(32-17)34-25-10-22(35-40-25)15-36-5-3-2-4-6-36/h7-14H,2-6,15-16H2,1H3,(H,32,34)(H,33,39)
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| InChIKey |
XYVHEZGROKPBMY-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