General Information of the Compound
| Compound ID |
CP0436161
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| Compound Name |
2-(3-chlorophenoxy)-N-(1-((1-(4-(trifluoromethyl)phenyl)-1H-pyrrol-3-yl)methyl)azetidin-3-yl)acetamide
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| Structure |
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| Formula |
C23H21ClF3N3O2
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| Molecular Weight |
463.887
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)-n1ccc(CN2CC(C2)NC(=O)COc2cccc(Cl)c2)c1
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| InChI |
InChI=1S/C23H21ClF3N3O2/c24-18-2-1-3-21(10-18)32-15-22(31)28-19-13-29(14-19)11-16-8-9-30(12-16)20-6-4-17(5-7-20)23(25,26)27/h1-10,12,19H,11,13-15H2,(H,28,31)
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| InChIKey |
UKENMFLEALPFDN-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