General Information of the Compound
| Compound ID |
CP0452364
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| Compound Name |
1-(5-tert-butyl-1,2-oxazol-3-yl)-3-(4-imidazo[2,1-b][1,3]benzothiazol-2-ylphenyl)urea
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| Structure |
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| Formula |
C23H21N5O2S
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| Molecular Weight |
431.521
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| Canonical SMILES |
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2ccccc32)no1
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| InChI |
InChI=1S/C23H21N5O2S/c1-23(2,3)19-12-20(27-30-19)26-21(29)24-15-10-8-14(9-11-15)16-13-28-17-6-4-5-7-18(17)31-22(28)25-16/h4-13H,1-3H3,(H2,24,26,27,29)
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| InChIKey |
IWPSRKCWTYJWAS-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