General Information of the Compound
| Compound ID |
CP0540239
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| Compound Name |
3-[2-[2-[(2,4-difluorophenyl)methoxy]phenyl]-5-methylpyrrol-1-yl]benzamide
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| Structure |
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| Formula |
C25H20F2N2O2
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| Molecular Weight |
418.443
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| Canonical SMILES |
Cc1ccc(-c2ccccc2OCc2ccc(F)cc2F)n1-c1cccc(c1)C(N)=O
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| InChI |
InChI=1S/C25H20F2N2O2/c1-16-9-12-23(29(16)20-6-4-5-17(13-20)25(28)30)21-7-2-3-8-24(21)31-15-18-10-11-19(26)14-22(18)27/h2-14H,15H2,1H3,(H2,28,30)
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| InChIKey |
NZJJVOUMDSHTKC-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