General Information of the Compound
| Compound ID |
CP0573884
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| Compound Name |
2-amino-8-[2-[4-[2-fluoro-4-(2-methoxyethoxy)phenyl]piperazin-1-yl]ethyl]-4-(5-methylfuran-2-yl)pteridin-7-one
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| Structure |
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| Formula |
C26H30FN7O4
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| Molecular Weight |
523.569
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| Canonical SMILES |
COCCOc1ccc(N2CCN(CCn3c4nc(N)nc(-c5ccc(C)o5)c4ncc3=O)CC2)c(F)c1
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| InChI |
InChI=1S/C26H30FN7O4/c1-17-3-6-21(38-17)23-24-25(31-26(28)30-23)34(22(35)16-29-24)12-9-32-7-10-33(11-8-32)20-5-4-18(15-19(20)27)37-14-13-36-2/h3-6,15-16H,7-14H2,1-2H3,(H2,28,30,31)
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| InChIKey |
OCQPYNZYCWMACM-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