General Information of the Compound
| Compound ID |
CP0496122
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| Compound Name |
N-(2H-tetrazol-5-yl)-4-[[2-[4-(trifluoromethoxy)benzoyl]-6-(trifluoromethyl)indol-1-yl]methyl]benzamide
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| Structure |
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| Formula |
C26H16F6N6O3
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| Molecular Weight |
574.441
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| Canonical SMILES |
FC(F)(F)Oc1ccc(cc1)C(=O)c1cc2ccc(cc2n1Cc1ccc(cc1)C(=O)Nc1nnn[nH]1)C(F)(F)F
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| InChI |
InChI=1S/C26H16F6N6O3/c27-25(28,29)18-8-5-17-11-21(22(39)15-6-9-19(10-7-15)41-26(30,31)32)38(20(17)12-18)13-14-1-3-16(4-2-14)23(40)33-24-34-36-37-35-24/h1-12H,13H2,(H2,33,34,35,36,37,40)
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| InChIKey |
DWZBHPHJNHJQQU-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