General Information of the Compound
| Compound ID |
CP0432745
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| Compound Name |
4-[5-[5-(3-cyano-4-cyclopentyloxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydroindol-1-yl]-4-oxobutanoic acid
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| Structure |
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| Formula |
C26H24N4O5
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| Molecular Weight |
472.501
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| Canonical SMILES |
OC(=O)CCC(=O)N1CCc2cc(ccc12)-c1noc(n1)-c1ccc(OC2CCCC2)c(c1)C#N
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| InChI |
InChI=1S/C26H24N4O5/c27-15-19-14-18(6-8-22(19)34-20-3-1-2-4-20)26-28-25(29-35-26)17-5-7-21-16(13-17)11-12-30(21)23(31)9-10-24(32)33/h5-8,13-14,20H,1-4,9-12H2,(H,32,33)
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| InChIKey |
LKKGBNAPIPCJGC-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