General Information of the Compound
| Compound ID |
CP0517761
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| Compound Name |
2-butyl-5-[3-(5-chloro-6-hydroxynaphthalen-2-yl)propanoylamino]-3-methylimidazole-4-carboxylic acid
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| Structure |
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| Formula |
C22H24ClN3O4
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| Molecular Weight |
429.904
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| Canonical SMILES |
CCCCc1nc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(O)=O)n1C
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| InChI |
InChI=1S/C22H24ClN3O4/c1-3-4-5-17-24-21(20(22(29)30)26(17)2)25-18(28)11-7-13-6-9-15-14(12-13)8-10-16(27)19(15)23/h6,8-10,12,27H,3-5,7,11H2,1-2H3,(H,25,28)(H,29,30)
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| InChIKey |
QELUWCKYZGMBHR-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