General Information of the Compound
| Compound ID |
CP0403617
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| Compound Name |
4-[3-[3-(4-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]propanoylamino]-1-methylpyrrole-3-carboxylic acid
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| Structure |
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| Formula |
C17H16N4O5
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| Molecular Weight |
356.338
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| Canonical SMILES |
Cn1cc(NC(=O)CCc2nc(no2)-c2ccc(O)cc2)c(c1)C(O)=O
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| InChI |
InChI=1S/C17H16N4O5/c1-21-8-12(17(24)25)13(9-21)18-14(23)6-7-15-19-16(20-26-15)10-2-4-11(22)5-3-10/h2-5,8-9,22H,6-7H2,1H3,(H,18,23)(H,24,25)
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| InChIKey |
QLDNWJSPEASFTL-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