General Information of the Compound
| Compound ID |
CP0374015
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| Compound Name |
3-((3,5-bis(4-(trifluoromethoxy)phenyl)-1H-pyrazol-1-yl)methyl)-N-(2H-tetrazol-5-yl)benzamide
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| Structure |
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| Formula |
C26H17F6N7O3
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| Molecular Weight |
589.456
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| Canonical SMILES |
FC(F)(F)Oc1ccc(cc1)-c1cc(-c2ccc(OC(F)(F)F)cc2)n(Cc2cccc(c2)C(=O)Nc2nnn[nH]2)n1
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| InChI |
InChI=1S/C26H17F6N7O3/c27-25(28,29)41-19-8-4-16(5-9-19)21-13-22(17-6-10-20(11-7-17)42-26(30,31)32)39(36-21)14-15-2-1-3-18(12-15)23(40)33-24-34-37-38-35-24/h1-13H,14H2,(H2,33,34,35,37,38,40)
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| InChIKey |
NEHBDABNFNVIPZ-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