General Information of the Compound
| Compound ID |
CP0579642
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| Compound Name |
2-amino-4-(5-methylfuran-2-yl)-8-(3-phenylpropyl)pteridin-7-one
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| Structure |
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| Formula |
C20H19N5O2
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| Molecular Weight |
361.405
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| Canonical SMILES |
Cc1ccc(o1)-c1nc(N)nc2n(CCCc3ccccc3)c(=O)cnc12
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| InChI |
InChI=1S/C20H19N5O2/c1-13-9-10-15(27-13)17-18-19(24-20(21)23-17)25(16(26)12-22-18)11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H2,21,23,24)
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| InChIKey |
CMWXSRYHPVUFTA-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