General Information of the Compound
| Compound ID |
CP0636594
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| Compound Name |
4'-Chloro-5-(3-ethyl-1-methyl-ureido)-biphenyl-3-carboxylic acid(1-pyrazin-2-yl-ethyl)-amide
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| Structure |
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| Formula |
C23H24ClN5O2
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| Molecular Weight |
437.931
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| Canonical SMILES |
CCNC(=O)N(C)c1cc(C(=O)NC(C)c2cnccn2)cc(-c2ccc(Cl)cc2)c1
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| InChI |
InChI=1S/C23H24ClN5O2/c1-4-26-23(31)29(3)20-12-17(16-5-7-19(24)8-6-16)11-18(13-20)22(30)28-15(2)21-14-25-9-10-27-21/h5-15H,4H2,1-3H3,(H,26,31)(H,28,30)
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| InChIKey |
BTNGTASORYIKPR-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