General Information of the Compound
| Compound ID |
CP0965775
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| Compound Name |
5-(3-((2-chloro-4-(trifluoromethyl)phenoxy)methyl)-5-fluorophenyl)-1H-tetrazole
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| Structure |
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| Formula |
C15H9ClF4N4O
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| Molecular Weight |
372.709
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| Canonical SMILES |
Fc1cc(COc2ccc(C(F)(F)F)cc2Cl)cc(-c2nnn[nH]2)c1
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| InChI |
InChI=1S/C15H9ClF4N4O/c16-12-6-10(15(18,19)20)1-2-13(12)25-7-8-3-9(5-11(17)4-8)14-21-23-24-22-14/h1-6H,7H2,(H,21,22,23,24)
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| InChIKey |
VLHTWKQWRYQIKP-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