General Information of the Compound
| Compound ID |
CP0167046
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| Compound Name |
N-[4-chloro-3-(trifluoromethyl)phenyl]-5-[3-methyl-5-(pyridin-4-ylmethylamino)imidazol-4-yl]-1,3,4-oxadiazol-2-amine
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| Structure |
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| Formula |
C19H15ClF3N7O
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| Molecular Weight |
449.824
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| Canonical SMILES |
Cn1cnc(NCc2ccncc2)c1-c1nnc(Nc2ccc(Cl)c(c2)C(F)(F)F)o1
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| InChI |
InChI=1S/C19H15ClF3N7O/c1-30-10-26-16(25-9-11-4-6-24-7-5-11)15(30)17-28-29-18(31-17)27-12-2-3-14(20)13(8-12)19(21,22)23/h2-8,10,25H,9H2,1H3,(H,27,29)
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| InChIKey |
JVPRKVYXSKAMGM-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