General Information of the Compound
| Compound ID |
CP0441311
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| Compound Name |
N-[(3,4-dichlorophenyl)methyl]-2-[3-fluoro-4-(methanesulfonamido)phenyl]propanamide
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| Structure |
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| Formula |
C17H17Cl2FN2O3S
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| Molecular Weight |
419.305
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| Canonical SMILES |
CC(C(=O)NCc1ccc(Cl)c(Cl)c1)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C17H17Cl2FN2O3S/c1-10(12-4-6-16(15(20)8-12)22-26(2,24)25)17(23)21-9-11-3-5-13(18)14(19)7-11/h3-8,10,22H,9H2,1-2H3,(H,21,23)
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| InChIKey |
JIQONNXVXZOTSM-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