General Information of the Compound
| Compound ID |
CP0524651
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| Compound Name |
1-(1-tricyclo[3.3.0.03,7]octanyl)-3-(2,3,4-trifluorophenyl)urea
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| Structure |
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| Formula |
C15H15F3N2O
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| Molecular Weight |
296.292
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| Canonical SMILES |
Fc1ccc(NC(=O)NC23CC4CC2CC4C3)c(F)c1F
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| InChI |
InChI=1S/C15H15F3N2O/c16-10-1-2-11(13(18)12(10)17)19-14(21)20-15-5-7-3-9(15)4-8(7)6-15/h1-2,7-9H,3-6H2,(H2,19,20,21)
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| InChIKey |
TZTFXBATIOCQTO-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