General Information of the Compound
| Compound ID |
CP0544269
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| Compound Name |
N-[[4-(cyclopropylsulfonylmethyl)-2-(trifluoromethyl)phenyl]methyl]-1-propan-2-ylindole-5-carboxamide
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| Structure |
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| Formula |
C24H25F3N2O3S
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| Molecular Weight |
478.536
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| Canonical SMILES |
CC(C)n1ccc2cc(ccc12)C(=O)NCc1ccc(CS(=O)(=O)C2CC2)cc1C(F)(F)F
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| InChI |
InChI=1S/C24H25F3N2O3S/c1-15(2)29-10-9-17-12-18(5-8-22(17)29)23(30)28-13-19-4-3-16(11-21(19)24(25,26)27)14-33(31,32)20-6-7-20/h3-5,8-12,15,20H,6-7,13-14H2,1-2H3,(H,28,30)
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| InChIKey |
FJOJQWFVZWXLMT-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