General Information of the Compound
| Compound ID |
CP0095083
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| Compound Name |
N-[4-[chloro(difluoro)methoxy]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 |
C19H16ClF2N7O2
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| Molecular Weight |
447.833
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| Canonical SMILES |
Cn1cnc(NCc2ccncc2)c1-c1nnc(Nc2ccc(OC(F)(F)Cl)cc2)o1
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| InChI |
InChI=1S/C19H16ClF2N7O2/c1-29-11-25-16(24-10-12-6-8-23-9-7-12)15(29)17-27-28-18(30-17)26-13-2-4-14(5-3-13)31-19(20,21)22/h2-9,11,24H,10H2,1H3,(H,26,28)
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| InChIKey |
OXKXXXGUZPQGGS-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