General Information of the Compound
| Compound ID |
CP0521689
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| Compound Name |
1-[4-chloro-3-(trifluoromethyl)phenyl]-3-(3,3-diphenylpropyl)urea
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| Structure |
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| Formula |
C23H20ClF3N2O
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| Molecular Weight |
432.873
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| Canonical SMILES |
FC(F)(F)c1cc(NC(=O)NCCC(c2ccccc2)c2ccccc2)ccc1Cl
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| InChI |
InChI=1S/C23H20ClF3N2O/c24-21-12-11-18(15-20(21)23(25,26)27)29-22(30)28-14-13-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,19H,13-14H2,(H2,28,29,30)
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| InChIKey |
IDIQVEYPGKHMSA-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