General Information of the Compound
| Compound ID |
CP0507623
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
[3,5-dihydroxy-4-(3-methylphenyl)phenyl]-thiophen-2-ylmethanone
Show/Hide
|
||||||||||||||||||
| Formula |
C18H14O3S
|
||||||||||||||||||
| Molecular Weight |
310.374
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(c1)-c1c(O)cc(cc1O)C(=O)c1cccs1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H14O3S/c1-11-4-2-5-12(8-11)17-14(19)9-13(10-15(17)20)18(21)16-6-3-7-22-16/h2-10,19-20H,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
HTAOHWLDOHCYNA-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