General Information of the Compound
| Compound ID |
CP0497701
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-Benzenesulfonyl-5-methoxy-3-(2-morpholin-4-yl-ethyl)-1H-indole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H24N2O4S
|
||||||||||||||||||
| Molecular Weight |
400.5
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2n(cc(CCN3CCOCC3)c2c1)S(=O)(=O)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H24N2O4S/c1-26-18-7-8-21-20(15-18)17(9-10-22-11-13-27-14-12-22)16-23(21)28(24,25)19-5-3-2-4-6-19/h2-8,15-16H,9-14H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
BNEKZVNOMCFDII-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