General Information of the Compound
| Compound ID |
CP0528111
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| Compound Name |
6-[(2-Aminoethyl)amino]-5-phenylpyrimidine-2,4(1H,3H)-dione, 25
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| Structure |
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| Formula |
C12H14N4O2
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| Molecular Weight |
246.27
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| Canonical SMILES |
NCCNc1[nH]c(=O)[nH]c(=O)c1-c1ccccc1
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| InChI |
InChI=1S/C12H14N4O2/c13-6-7-14-10-9(8-4-2-1-3-5-8)11(17)16-12(18)15-10/h1-5H,6-7,13H2,(H3,14,15,16,17,18)
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| InChIKey |
BVRMCKUFYXTZJR-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