General Information of the Compound
| Compound ID |
CP0441313
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[2-(N-phenylanilino)ethyl]propanamide
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| Structure |
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| Formula |
C24H26FN3O3S
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| Molecular Weight |
455.555
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| Canonical SMILES |
CC(C(=O)NCCN(c1ccccc1)c1ccccc1)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C24H26FN3O3S/c1-18(19-13-14-23(22(25)17-19)27-32(2,30)31)24(29)26-15-16-28(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,17-18,27H,15-16H2,1-2H3,(H,26,29)
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| InChIKey |
BXVBFPOWPOMZMF-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