General Information of the Compound
| Compound ID |
CP0409474
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| Compound Name |
8-[(2E)-2-[(2,4-dihydroxyphenyl)methylidene]hydrazinyl]-1,3-dimethyl-7-prop-2-enyl-8,9-dihydropurine-2,6-dione
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| Structure |
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| Formula |
C17H20N6O4
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| Molecular Weight |
372.385
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| Canonical SMILES |
Cn1c2NC(N\N=C\c3ccc(O)cc3O)N(CC=C)c2c(=O)n(C)c1=O
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| InChI |
InChI=1S/C17H20N6O4/c1-4-7-23-13-14(21(2)17(27)22(3)15(13)26)19-16(23)20-18-9-10-5-6-11(24)8-12(10)25/h4-6,8-9,16,19-20,24-25H,1,7H2,2-3H3/b18-9+
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| InChIKey |
RBVXLFKDGKPLKA-GIJQJNRQSA-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