General Information of the Compound
| Compound ID |
CP0137276
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| Compound Name |
3-methyl-1-[2-[5-methyl-6-(trifluoromethyl)furo[2,3-d]pyrimidin-4-yl]sulfanylacetyl]imidazolidin-4-one
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| Structure |
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| Formula |
C14H13F3N4O3S
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| Molecular Weight |
374.344
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| Canonical SMILES |
CN1CN(CC1=O)C(=O)CSc1ncnc2oc(c(C)c12)C(F)(F)F
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| InChI |
InChI=1S/C14H13F3N4O3S/c1-7-10-12(24-11(7)14(15,16)17)18-5-19-13(10)25-4-9(23)21-3-8(22)20(2)6-21/h5H,3-4,6H2,1-2H3
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| InChIKey |
RBXPIXMLWSPGAV-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
Protein ID: PT05574, Palmitoleoyl-protein carboxylesterase NOTUM