General Information of the Compound
| Compound ID |
CP0893459
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| Compound Name |
(2,2-bis(2,4-difluorophenyl)-6-fluorobenzo[d][1,3]dioxol-5-yl)(4,4-difluoropiperidin-1-yl)methanone
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| Structure |
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| Formula |
C25H16F7NO3
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| Molecular Weight |
511.393
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| Canonical SMILES |
O=C(c1cc2c(cc1F)OC(c1ccc(F)cc1F)(c1ccc(F)cc1F)O2)N1CCC(F)(F)CC1
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| InChI |
InChI=1S/C25H16F7NO3/c26-13-1-3-16(19(29)9-13)25(17-4-2-14(27)10-20(17)30)35-21-11-15(18(28)12-22(21)36-25)23(34)33-7-5-24(31,32)6-8-33/h1-4,9-12H,5-8H2
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| InChIKey |
YTHMRYNWHQGSRZ-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