General Information of the Compound
| Compound ID |
CP0492493
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| Compound Name |
[1-(2-fluoro-4-methoxybenzoyl)piperidin-4-yl]-(2-fluoro-4-methoxyphenyl)methanone
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| Structure |
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| Formula |
C21H21F2NO4
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| Molecular Weight |
389.398
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| Canonical SMILES |
COc1ccc(C(=O)C2CCN(CC2)C(=O)c2ccc(OC)cc2F)c(F)c1
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| InChI |
InChI=1S/C21H21F2NO4/c1-27-14-3-5-16(18(22)11-14)20(25)13-7-9-24(10-8-13)21(26)17-6-4-15(28-2)12-19(17)23/h3-6,11-13H,7-10H2,1-2H3
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| InChIKey |
NWSKAHDSCGOVCK-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