General Information of the Compound
| Compound ID |
CP0503311
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(3-chlorophenoxy)-N-(1-((1-(5-(trifluoromethyl)pyridin-2-yl)-1H-pyrrol-3-yl)methyl)piperidin-3-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H24ClF3N4O2
|
||||||||||||||||||
| Molecular Weight |
492.929
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1ccc(nc1)-n1ccc(CN2CCCC(C2)NC(=O)COc2cccc(Cl)c2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H24ClF3N4O2/c25-19-3-1-5-21(11-19)34-16-23(33)30-20-4-2-9-31(15-20)13-17-8-10-32(14-17)22-7-6-18(12-29-22)24(26,27)28/h1,3,5-8,10-12,14,20H,2,4,9,13,15-16H2,(H,30,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
GHUKLTCOUXCITL-UHFFFAOYSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound