General Information of the Compound
| Compound ID |
CP0473426
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| Compound Name |
4-[3-[3-(4-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]-1-(2-morpholin-4-ylethyl)pyrrole-3-carboxylic acid
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| Structure |
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| Formula |
C22H25N5O6
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| Molecular Weight |
455.471
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| Canonical SMILES |
OC(=O)c1cn(CCN2CCOCC2)cc1NC(=O)CCc1nc(no1)-c1ccc(O)cc1
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| InChI |
InChI=1S/C22H25N5O6/c28-16-3-1-15(2-4-16)21-24-20(33-25-21)6-5-19(29)23-18-14-27(13-17(18)22(30)31)8-7-26-9-11-32-12-10-26/h1-4,13-14,28H,5-12H2,(H,23,29)(H,30,31)
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| InChIKey |
UEBXWNNIZYGBBH-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