General Information of the Compound
Compound ID |
CP0486178
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
2-[[2-(8-fluoro-1,3,4,5-tetrahydro-2-benzazepin-2-yl)-6-methylquinolin-4-yl]amino]ethanol
Show/Hide
|
||||||||||||||||||
Structure |
|
||||||||||||||||||
Formula |
C22H24FN3O
|
||||||||||||||||||
Molecular Weight |
365.452
|
||||||||||||||||||
Canonical SMILES |
Cc1ccc2nc(cc(NCCO)c2c1)N1CCCc2ccc(F)cc2C1
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C22H24FN3O/c1-15-4-7-20-19(11-15)21(24-8-10-27)13-22(25-20)26-9-2-3-16-5-6-18(23)12-17(16)14-26/h4-7,11-13,27H,2-3,8-10,14H2,1H3,(H,24,25)
Show/Hide
|
||||||||||||||||||
InChIKey |
GVLXAEVMZNYKHZ-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