General Information of the Compound
| Compound ID |
CP0561874
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| Compound Name |
1-(3-fluoropropyl)-4-[3-[3-(5-hydroxypyridin-2-yl)-1,2,4-oxadiazol-5-yl]propanoylamino]pyrrole-3-carboxylic acid
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| Structure |
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| Formula |
C18H18FN5O5
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| Molecular Weight |
403.37
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| Canonical SMILES |
OC(=O)c1cn(CCCF)cc1NC(=O)CCc1nc(no1)-c1ccc(O)cn1
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| InChI |
InChI=1S/C18H18FN5O5/c19-6-1-7-24-9-12(18(27)28)14(10-24)21-15(26)4-5-16-22-17(23-29-16)13-3-2-11(25)8-20-13/h2-3,8-10,25H,1,4-7H2,(H,21,26)(H,27,28)
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| InChIKey |
RVNMIVBZYNIUSW-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