General Information of the Compound
| Compound ID |
CP0547531
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-chloro-2-methylphenoxy)-N-[(E)-pyridin-2-ylmethylideneamino]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H14ClN3O2
|
||||||||||||||||||
| Molecular Weight |
303.749
|
||||||||||||||||||
| Canonical SMILES |
Cc1cc(Cl)ccc1OCC(=O)N\N=C\c1ccccn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H14ClN3O2/c1-11-8-12(16)5-6-14(11)21-10-15(20)19-18-9-13-4-2-3-7-17-13/h2-9H,10H2,1H3,(H,19,20)/b18-9+
Show/Hide
|
||||||||||||||||||
| InChIKey |
ICEFEDHDHNRVNT-GIJQJNRQSA-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: PT06716, Anoctamin-1
Protein ID: PT06826, Anoctamin-2