General Information of the Compound
| Compound ID |
CP0396124
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-methylphenoxy)-N-pyridin-2-yl-N-(thiophen-2-ylmethyl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H18N2O2S
|
||||||||||||||||||
| Molecular Weight |
338.432
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc(OCC(=O)N(Cc2cccs2)c2ccccn2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H18N2O2S/c1-15-7-9-16(10-8-15)23-14-19(22)21(13-17-5-4-12-24-17)18-6-2-3-11-20-18/h2-12H,13-14H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
JAECINCSXZXFPR-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