General Information of the Compound
| Compound ID |
CP0516865
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| Compound Name |
N-[4-amino-3-(trifluoromethyl)phenyl]-4-tert-butylbenzenesulfonamide
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| Formula |
C17H19F3N2O2S
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| Molecular Weight |
372.412
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(N)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C17H19F3N2O2S/c1-16(2,3)11-4-7-13(8-5-11)25(23,24)22-12-6-9-15(21)14(10-12)17(18,19)20/h4-10,22H,21H2,1-3H3
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| InChIKey |
NHCNWQVFTNLDJV-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
Protein ID: PT02793, Free fatty acid receptor 1
Protein ID: PT04427, Free fatty acid receptor 4