General Information of the Compound
| Compound ID |
CP0364549
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| Compound Name |
[6-[[5-[[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]methyl]pyridin-2-yl]methanol
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| Structure |
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| Formula |
C20H18N8OS
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| Molecular Weight |
418.486
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| Canonical SMILES |
Cc1cn2c(cnc2c(Nc2cc(Cc3cccc(CO)n3)ns2)n1)-c1cn[nH]c1
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| InChI |
InChI=1S/C20H18N8OS/c1-12-10-28-17(13-7-22-23-8-13)9-21-20(28)19(24-12)26-18-6-16(27-30-18)5-14-3-2-4-15(11-29)25-14/h2-4,6-10,29H,5,11H2,1H3,(H,22,23)(H,24,26)
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| InChIKey |
IHPKXSCATRDYFP-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