General Information of the Compound
| Compound ID |
CP0441322
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| Compound Name |
N-(3,3-diphenylpropyl)-2-[3-fluoro-4-(methanesulfonamido)phenyl]propanamide
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| Structure |
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| Formula |
C25H27FN2O3S
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| Molecular Weight |
454.567
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| Canonical SMILES |
CC(C(=O)NCCC(c1ccccc1)c1ccccc1)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C25H27FN2O3S/c1-18(21-13-14-24(23(26)17-21)28-32(2,30)31)25(29)27-16-15-22(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-14,17-18,22,28H,15-16H2,1-2H3,(H,27,29)
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| InChIKey |
RQIZTURHWZMSES-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