General Information of the Compound
| Compound ID |
CP0713513
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| Compound Name |
methyl-6-[4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl]pyridine-3-carboxylate
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| Structure |
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| Formula |
C14H13N3O3
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| Molecular Weight |
271.276
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| Canonical SMILES |
COC(=O)c1ccc(-c2nc3c(c(=O)[nH]2)CCC3)nc1
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| InChI |
InChI=1S/C14H13N3O3/c1-20-14(19)8-5-6-11(15-7-8)12-16-10-4-2-3-9(10)13(18)17-12/h5-7H,2-4H2,1H3,(H,16,17,18)
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| InChIKey |
PUKLALZPIDZYIS-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