General Information of the Compound
| Compound ID |
CP0437606
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1N-{2-(1H-3-indolyl)-1-[2-methoxybenzyl(methyl)carboxamidomethyl]ethyl}-2-(4-methoxyphenoxy)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H33N3O5
|
||||||||||||||||||
| Molecular Weight |
515.61
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(OCC(=O)NC(CN(Cc2ccccc2OC)C(C)=O)Cc2c[nH]c3ccccc23)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H33N3O5/c1-21(34)33(18-22-8-4-7-11-29(22)37-3)19-24(16-23-17-31-28-10-6-5-9-27(23)28)32-30(35)20-38-26-14-12-25(36-2)13-15-26/h4-15,17,24,31H,16,18-20H2,1-3H3,(H,32,35)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SIBIOTUKPPIJSS-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