General Information of the Compound
| Compound ID |
CP0522345
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-4-(trifluoromethoxy)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H19F3N2O2
|
||||||||||||||||||
| Molecular Weight |
364.367
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)Oc1ccc(cc1)C(=O)NCCN1CCCc2ccccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H19F3N2O2/c20-19(21,22)26-16-9-7-15(8-10-16)18(25)23-11-13-24-12-3-5-14-4-1-2-6-17(14)24/h1-2,4,6-10H,3,5,11-13H2,(H,23,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HDFPRHCUOKOHIS-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