General Information of the Compound
| Compound ID |
CP0575725
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| Compound Name |
2-amino-4-(5-methylfuran-2-yl)-8-[2-(4-methylpiperazin-1-yl)ethyl]pteridin-7-one
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| Structure |
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| Formula |
C18H23N7O2
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| Molecular Weight |
369.429
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| Canonical SMILES |
CN1CCN(CCn2c3nc(N)nc(-c4ccc(C)o4)c3ncc2=O)CC1
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| InChI |
InChI=1S/C18H23N7O2/c1-12-3-4-13(27-12)15-16-17(22-18(19)21-15)25(14(26)11-20-16)10-9-24-7-5-23(2)6-8-24/h3-4,11H,5-10H2,1-2H3,(H2,19,21,22)
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| InChIKey |
DYBIIASEQSAQKZ-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