General Information of the Compound
| Compound ID |
CP0401656
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-(4-fluorophenyl)-2-((3'-methoxybiphenyl-2-yl)methyl)thiazol-5-yl)acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H20FNO3S
|
||||||||||||||||||
| Molecular Weight |
433.504
|
||||||||||||||||||
| Canonical SMILES |
COc1cccc(c1)-c1ccccc1Cc1nc(c(CC(O)=O)s1)-c1ccc(F)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H20FNO3S/c1-30-20-7-4-6-17(13-20)21-8-3-2-5-18(21)14-23-27-25(22(31-23)15-24(28)29)16-9-11-19(26)12-10-16/h2-13H,14-15H2,1H3,(H,28,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VPDVRTVLTIGUTA-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