General Information of the Compound
| Compound ID |
CP0881769
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(1,3-Dihydro-isoindol-2-yl)-5-(1-methyl-1H-indol-5-yl)-benzoxazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H19N3O
|
||||||||||||||||||
| Molecular Weight |
365.436
|
||||||||||||||||||
| Canonical SMILES |
Cn1ccc2cc(-c3ccc4oc(N5Cc6ccccc6C5)nc4c3)ccc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H19N3O/c1-26-11-10-18-12-16(6-8-22(18)26)17-7-9-23-21(13-17)25-24(28-23)27-14-19-4-2-3-5-20(19)15-27/h2-13H,14-15H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
JSDIANPKQMJBEW-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: PT01099, Fatty-acid amide hydrolase 1
Protein ID: PT00961, Fatty-acid amide hydrolase 1