General Information of the Compound
| Compound ID |
CP0369376
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| Compound Name |
2-(2-fluoroanilino)-4-propyl-1H-pyrimidin-6-one
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| Structure |
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| Formula |
C13H14FN3O
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| Molecular Weight |
247.273
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| Canonical SMILES |
CCCc1cc(=O)[nH]c(Nc2ccccc2F)n1
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| InChI |
InChI=1S/C13H14FN3O/c1-2-5-9-8-12(18)17-13(15-9)16-11-7-4-3-6-10(11)14/h3-4,6-8H,2,5H2,1H3,(H2,15,16,17,18)
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| InChIKey |
PKDFHRREPYQILX-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