General Information of the Compound
| Compound ID |
CP0881805
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| Compound Name |
4-amino-7-benzyl-2-methyl-5H-pyrrolo[2,3-d]pyrimidin-6(7H)-one
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| Structure |
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| Formula |
C14H14N4O
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| Molecular Weight |
254.293
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| Canonical SMILES |
Cc1nc(N)c2c(n1)N(Cc1ccccc1)C(=O)C2
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| InChI |
InChI=1S/C14H14N4O/c1-9-16-13(15)11-7-12(19)18(14(11)17-9)8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H2,15,16,17)
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| InChIKey |
YKFHXIPRYYTZDI-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