General Information of the Compound
| Compound ID |
CP0424222
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| Compound Name |
2-(difluoromethyl)-5-(3-(1-fluorocyclopropyl)propyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione
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| Structure |
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| Formula |
C14H13F3N2O3
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| Molecular Weight |
314.263
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| Canonical SMILES |
FC(F)c1nc2oc(=O)cc(CCCC3(F)CC3)c2c(=O)[nH]1
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| InChI |
InChI=1S/C14H13F3N2O3/c15-10(16)11-18-12(21)9-7(2-1-3-14(17)4-5-14)6-8(20)22-13(9)19-11/h6,10H,1-5H2,(H,18,19,21)
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| InChIKey |
DNKJUZHUURYUHX-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