General Information of the Compound
| Compound ID |
CP0432114
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| Compound Name |
2-[1-diethoxyphosphoryl-2-(4-fluorophenyl)ethyl]naphthalene
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| Structure |
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| Formula |
C22H24FO3P
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| Molecular Weight |
386.403
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| Canonical SMILES |
CCOP(=O)(OCC)C(Cc1ccc(F)cc1)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C22H24FO3P/c1-3-25-27(24,26-4-2)22(15-17-9-13-21(23)14-10-17)20-12-11-18-7-5-6-8-19(18)16-20/h5-14,16,22H,3-4,15H2,1-2H3
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| InChIKey |
XNTDMTXDGKDOBG-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