General Information of the Compound
| Compound ID |
CP0125698
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| Compound Name |
N-[4-[4-(oxetan-3-yl)piperazin-1-yl]phenyl]-6-(1H-pyrazolo[3,4-b]pyridin-6-yl)imidazo[1,2-a]pyrazin-8-amine
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| Structure |
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| Formula |
C25H25N9O
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| Molecular Weight |
467.537
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| Canonical SMILES |
C1OCC1N1CCN(CC1)c1ccc(Nc2nc(cn3ccnc23)-c2ccc3cn[nH]c3n2)cc1
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| InChI |
InChI=1S/C25H25N9O/c1-6-21(29-23-17(1)13-27-31-23)22-14-34-8-7-26-25(34)24(30-22)28-18-2-4-19(5-3-18)32-9-11-33(12-10-32)20-15-35-16-20/h1-8,13-14,20H,9-12,15-16H2,(H,28,30)(H,27,29,31)
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| InChIKey |
WINVKUCOBWBHLN-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