General Information of the Compound
| Compound ID |
CP0569039
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| Compound Name |
1-ethyl-3-[(2S)-1,1,1,5,5,5-hexafluoropentan-2-yl]-1-[(1R)-1-(3-imidazo[1,2-a]pyridin-6-ylphenyl)ethyl]urea
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| Formula |
C23H24F6N4O
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| Molecular Weight |
486.46
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| Canonical SMILES |
CCN([C@H](C)c1cccc(c1)-c1ccc2nccn2c1)C(=O)N[C@@H](CCC(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C23H24F6N4O/c1-3-33(21(34)31-19(23(27,28)29)9-10-22(24,25)26)15(2)16-5-4-6-17(13-16)18-7-8-20-30-11-12-32(20)14-18/h4-8,11-15,19H,3,9-10H2,1-2H3,(H,31,34)/t15-,19+/m1/s1
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| InChIKey |
MTADIKRUSNRSEU-BEFAXECRSA-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