General Information of the Compound
| Compound ID |
CP0563173
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(8-fluoro-1,3,4,5-tetrahydro-2-benzazepin-2-yl)-6-methyl-N-(2-piperidin-1-ylethyl)quinolin-4-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H33FN4
|
||||||||||||||||||
| Molecular Weight |
432.587
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc2nc(cc(NCCN3CCCCC3)c2c1)N1CCCc2ccc(F)cc2C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H33FN4/c1-20-7-10-25-24(16-20)26(29-11-15-31-12-3-2-4-13-31)18-27(30-25)32-14-5-6-21-8-9-23(28)17-22(21)19-32/h7-10,16-18H,2-6,11-15,19H2,1H3,(H,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UPNQBXYOGHSOMM-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