General Information of the Compound
| Compound ID |
CP0060563
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| Compound Name |
2-[1-[2,4-dichloro-3-[2-(5-chlorofuran-2-yl)-5-methyl-4-(trifluoromethyl)imidazol-1-yl]phenyl]azetidin-3-yl]acetic acid
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| Structure |
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| Formula |
C20H15Cl3F3N3O3
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| Molecular Weight |
508.711
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| Canonical SMILES |
Cc1c(nc(-c2ccc(Cl)o2)n1-c1c(Cl)ccc(N2CC(CC(O)=O)C2)c1Cl)C(F)(F)F
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| InChI |
InChI=1S/C20H15Cl3F3N3O3/c1-9-18(20(24,25)26)27-19(13-4-5-14(22)32-13)29(9)17-11(21)2-3-12(16(17)23)28-7-10(8-28)6-15(30)31/h2-5,10H,6-8H2,1H3,(H,30,31)
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| InChIKey |
XOHQHRJLOSJORD-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