General Information of the Compound
| Compound ID |
CP0323338
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| Compound Name |
N-[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-[[6-(piperidin-1-ylmethyl)pyridin-2-yl]methyl]-1,2-thiazol-5-amine
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| Structure |
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| Formula |
C25H27N9S
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| Molecular Weight |
485.621
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| Canonical SMILES |
Cc1cn2c(cnc2c(Nc2cc(Cc3cccc(CN4CCCCC4)n3)ns2)n1)-c1cn[nH]c1
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| InChI |
InChI=1S/C25H27N9S/c1-17-15-34-22(18-12-27-28-13-18)14-26-25(34)24(29-17)31-23-11-21(32-35-23)10-19-6-5-7-20(30-19)16-33-8-3-2-4-9-33/h5-7,11-15H,2-4,8-10,16H2,1H3,(H,27,28)(H,29,31)
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| InChIKey |
DSGYDKJQGUWPJN-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