General Information of the Compound
| Compound ID |
CP0534042
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-bromo-2,8-dioxopyrano[2,3-f]chromene-3,9-dicarboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H5BrO8
|
||||||||||||||||||
| Molecular Weight |
381.09
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)c1cc2cc(Br)c3oc(=O)c(cc3c2oc1=O)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H5BrO8/c15-8-2-4-1-6(11(16)17)13(20)22-9(4)5-3-7(12(18)19)14(21)23-10(5)8/h1-3H,(H,16,17)(H,18,19)
Show/Hide
|
||||||||||||||||||
| InChIKey |
IFOGUCVJAXMZEF-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