General Information of the Compound
| Compound ID |
CP0525589
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(4-methoxyphenyl)-2-[3-[2-[(4-methylphenyl)sulfonylamino]ethyl]indol-1-yl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H27N3O4S
|
||||||||||||||||||
| Molecular Weight |
477.586
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(NC(=O)Cn2cc(CCNS(=O)(=O)c3ccc(C)cc3)c3ccccc23)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H27N3O4S/c1-19-7-13-23(14-8-19)34(31,32)27-16-15-20-17-29(25-6-4-3-5-24(20)25)18-26(30)28-21-9-11-22(33-2)12-10-21/h3-14,17,27H,15-16,18H2,1-2H3,(H,28,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
LERCSXUOLSCXSO-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