General Information of the Compound
| Compound ID |
CP0357725
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| Compound Name |
N-[[4-(ethylsulfonylamino)-2-(trifluoromethyl)phenyl]methyl]-1-[(3-fluorophenyl)methyl]indole-5-carboxamide
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| Structure |
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| Formula |
C26H23F4N3O3S
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| Molecular Weight |
533.547
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| Canonical SMILES |
CCS(=O)(=O)Nc1ccc(CNC(=O)c2ccc3n(Cc4cccc(F)c4)ccc3c2)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C26H23F4N3O3S/c1-2-37(35,36)32-22-8-6-20(23(14-22)26(28,29)30)15-31-25(34)19-7-9-24-18(13-19)10-11-33(24)16-17-4-3-5-21(27)12-17/h3-14,32H,2,15-16H2,1H3,(H,31,34)
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| InChIKey |
PFXAORZGRGUERN-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