General Information of the Compound
| Compound ID |
CP0461151
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| Compound Name |
2-(4-tert-butylphenyl)-5-(4-(trifluoromethyl)phenyl)-2H-tetrazole
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| Structure |
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| Formula |
C18H17F3N4
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| Molecular Weight |
346.356
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)-n1nnc(n1)-c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C18H17F3N4/c1-17(2,3)13-8-10-15(11-9-13)25-23-16(22-24-25)12-4-6-14(7-5-12)18(19,20)21/h4-11H,1-3H3
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| InChIKey |
LWUQGENLMSVQPX-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