General Information of the Compound
| Compound ID |
CP0902464
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-Hydroxybenzylidene)-7-((4-methoxybenzyl)oxy)-2,3-dihydro-1H-inden-1-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H20O4
|
||||||||||||||||||
| Molecular Weight |
372.42
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(COc2cccc3c2C(=O)/C(=C/c2ccc(O)cc2)C3)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H20O4/c1-27-21-11-7-17(8-12-21)15-28-22-4-2-3-18-14-19(24(26)23(18)22)13-16-5-9-20(25)10-6-16/h2-13,25H,14-15H2,1H3/b19-13+
Show/Hide
|
||||||||||||||||||
| InChIKey |
GVJWXPXVMFNFQX-CPNJWEJPSA-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