General Information of the Compound
| Compound ID |
CP0861972
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(3-Carboxyphenyl)-2-phenylquinoxaline-6-carboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H14N2O4
|
||||||||||||||||||
| Molecular Weight |
370.364
|
||||||||||||||||||
| Canonical SMILES |
O=C(O)c1cccc(-c2nc3cc(C(=O)O)ccc3nc2-c2ccccc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H14N2O4/c25-21(26)15-8-4-7-14(11-15)20-19(13-5-2-1-3-6-13)23-17-10-9-16(22(27)28)12-18(17)24-20/h1-12H,(H,25,26)(H,27,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
MJSHHKCFUNJZHC-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