General Information of the Compound
| Compound ID |
CP0190341
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| Compound Name |
2-[3-[2-[(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)methyl]-4-fluorophenyl]-5-(trifluoromethyl)indol-1-yl]acetic acid
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| Structure |
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| Formula |
C25H20F4N2O3
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| Molecular Weight |
472.438
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| Canonical SMILES |
Cc1noc(C2CC2)c1Cc1cc(F)ccc1-c1cn(CC(O)=O)c2ccc(cc12)C(F)(F)F
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| InChI |
InChI=1S/C25H20F4N2O3/c1-13-19(24(34-30-13)14-2-3-14)9-15-8-17(26)5-6-18(15)21-11-31(12-23(32)33)22-7-4-16(10-20(21)22)25(27,28)29/h4-8,10-11,14H,2-3,9,12H2,1H3,(H,32,33)
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| InChIKey |
XNWLFEZEXPUZOU-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