General Information of the Compound
| Compound ID |
CP0399507
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| Compound Name |
5-[(E)-2-(furan-2-yl)ethenyl]-1-methyl-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one
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| Structure |
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| Formula |
C15H16N4O2
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| Molecular Weight |
284.319
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| Canonical SMILES |
CCCc1nn(C)c2c1nc(\C=C\c1ccco1)[nH]c2=O
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| InChI |
InChI=1S/C15H16N4O2/c1-3-5-11-13-14(19(2)18-11)15(20)17-12(16-13)8-7-10-6-4-9-21-10/h4,6-9H,3,5H2,1-2H3,(H,16,17,20)/b8-7+
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| InChIKey |
LYVJNPZTXRVPHN-BQYQJAHWSA-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