General Information of the Compound
| Compound ID |
CP0559741
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| Compound Name |
6-(3H-benzimidazol-5-yl)-N-[4-[4-(oxetan-3-yl)piperazin-1-yl]phenyl]imidazo[1,2-a]pyrazin-8-amine
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| Structure |
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| Formula |
C26H26N8O
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| Molecular Weight |
466.549
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| Canonical SMILES |
C1OCC1N1CCN(CC1)c1ccc(Nc2nc(cn3ccnc23)-c2ccc3nc[nH]c3c2)cc1
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| InChI |
InChI=1S/C26H26N8O/c1-6-22-23(29-17-28-22)13-18(1)24-14-34-8-7-27-26(34)25(31-24)30-19-2-4-20(5-3-19)32-9-11-33(12-10-32)21-15-35-16-21/h1-8,13-14,17,21H,9-12,15-16H2,(H,28,29)(H,30,31)
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| InChIKey |
FRELFUBHIVXDTH-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