General Information of the Compound
| Compound ID |
CP0537671
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-formyl-3-hydroxy-N-[5-(trifluoromethyl)pyridin-2-yl]quinoline-8-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C17H10F3N3O3
|
||||||||||||||||||
| Molecular Weight |
361.279
|
||||||||||||||||||
| Canonical SMILES |
Oc1cc2cccc(C(=O)Nc3ccc(cn3)C(F)(F)F)c2nc1C=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H10F3N3O3/c18-17(19,20)10-4-5-14(21-7-10)23-16(26)11-3-1-2-9-6-13(25)12(8-24)22-15(9)11/h1-8,25H,(H,21,23,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
AGAIPYOYLQSXCV-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 | |||||||||||||||||||
| 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