General Information of the Compound
| Compound ID |
CP0177102
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| Compound Name |
5-[4-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxymethyl]-4-fluoropiperidin-1-yl]pyridine-2-carboxylic acid
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| Structure |
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| Formula |
C25H24Cl2FN3O4
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| Molecular Weight |
520.388
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| Canonical SMILES |
OC(=O)c1ccc(cn1)N1CCC(F)(COCc2c(onc2-c2c(Cl)cccc2Cl)C2CC2)CC1
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| InChI |
InChI=1S/C25H24Cl2FN3O4/c26-18-2-1-3-19(27)21(18)22-17(23(35-30-22)15-4-5-15)13-34-14-25(28)8-10-31(11-9-25)16-6-7-20(24(32)33)29-12-16/h1-3,6-7,12,15H,4-5,8-11,13-14H2,(H,32,33)
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| InChIKey |
WLDBXYFWYGARIZ-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