General Information of the Compound
| Compound ID |
CP0527557
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(3-bromophenyl)-5,7-dihydroxy-6-methoxychromen-4-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H11BrO5
|
||||||||||||||||||
| Molecular Weight |
363.163
|
||||||||||||||||||
| Canonical SMILES |
COc1c(O)cc2oc(cc(=O)c2c1O)-c1cccc(Br)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H11BrO5/c1-21-16-11(19)7-13-14(15(16)20)10(18)6-12(22-13)8-3-2-4-9(17)5-8/h2-7,19-20H,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
MHDZAPHIOGYUOZ-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