General Information of the Compound
| Compound ID |
CP0969073
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(E)-5-(dimethylamino)-2-(pyridin-2-yldiazenyl)phenol 2-oxopropanoate
Show/Hide
|
||||||||||||||||||
| Formula |
C16H18N4O4
|
||||||||||||||||||
| Molecular Weight |
330.344
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)C(=O)O.CN(C)c1ccc(/N=N/c2ccccn2)c(O)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C13H14N4O.C3H4O3/c1-17(2)10-6-7-11(12(18)9-10)15-16-13-5-3-4-8-14-13;1-2(4)3(5)6/h3-9,18H,1-2H3;1H3,(H,5,6)/b16-15+;
Show/Hide
|
||||||||||||||||||
| InChIKey |
SHWWPYKGKMUBLA-GEEYTBSJSA-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 | |||||||||||||||||||
| 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