General Information of the Compound
| Compound ID |
CP0511849
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| Compound Name |
2-[(2-fluorophenyl)methoxy]-10-methoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
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| Formula |
C20H17FN2O3
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| Molecular Weight |
352.365
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| Canonical SMILES |
COc1ccc2CCn3c(cc(OCc4ccccc4F)nc3=O)-c2c1
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| InChI |
InChI=1S/C20H17FN2O3/c1-25-15-7-6-13-8-9-23-18(16(13)10-15)11-19(22-20(23)24)26-12-14-4-2-3-5-17(14)21/h2-7,10-11H,8-9,12H2,1H3
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| InChIKey |
PYXPFVPRFXCPKG-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