General Information of the Compound
| Compound ID |
CP0509155
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-methyl-5-phenyl-5,6,8,9-tetrahydro-3H-[1,3]oxazolo[5,4-h][3]benzazepin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H18N2O2
|
||||||||||||||||||
| Molecular Weight |
294.354
|
||||||||||||||||||
| Canonical SMILES |
CN1CCc2cc3oc(=O)[nH]c3cc2C(C1)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H18N2O2/c1-20-8-7-13-9-17-16(19-18(21)22-17)10-14(13)15(11-20)12-5-3-2-4-6-12/h2-6,9-10,15H,7-8,11H2,1H3,(H,19,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
USQVNDTUQKYGMB-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
Protein ID: PT01195, D(1A) dopamine receptor
Protein ID: PT01005, D(2) dopamine receptor