General Information of the Compound
| Compound ID |
CP0534013
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| Compound Name |
2-amino-8-[2-[4-[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 |
C26H31N7O4
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| Molecular Weight |
505.579
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| Canonical SMILES |
COCCOc1ccc(cc1)N1CCN(CCn2c3nc(N)nc(-c4ccc(C)o4)c3ncc2=O)CC1
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| InChI |
InChI=1S/C26H31N7O4/c1-18-3-8-21(37-18)23-24-25(30-26(27)29-23)33(22(34)17-28-24)14-11-31-9-12-32(13-10-31)19-4-6-20(7-5-19)36-16-15-35-2/h3-8,17H,9-16H2,1-2H3,(H2,27,29,30)
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| InChIKey |
ONAMVEAIHJHYNG-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