General Information of the Compound
| Compound ID |
CP0520851
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| Compound Name |
4-[3-[3-(5-hydroxypyridin-2-yl)-1,2,4-oxadiazol-5-yl]propanoylamino]-1-propan-2-ylpyrrole-3-carboxylic acid
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| Structure |
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| Formula |
C18H19N5O5
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| Molecular Weight |
385.38
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| Canonical SMILES |
CC(C)n1cc(NC(=O)CCc2nc(no2)-c2ccc(O)cn2)c(c1)C(O)=O
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| InChI |
InChI=1S/C18H19N5O5/c1-10(2)23-8-12(18(26)27)14(9-23)20-15(25)5-6-16-21-17(22-28-16)13-4-3-11(24)7-19-13/h3-4,7-10,24H,5-6H2,1-2H3,(H,20,25)(H,26,27)
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| InChIKey |
WKSSNATVXNMZGK-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