General Information of the Compound
| Compound ID |
CP0372014
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-(4-chlorophenyl)-2-((6-chloropyridin-2-yl)(phenyl)methyl)thiazol-5-yl)acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H16Cl2N2O2S
|
||||||||||||||||||
| Molecular Weight |
455.366
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)Cc1sc(nc1-c1ccc(Cl)cc1)C(c1ccccc1)c1cccc(Cl)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H16Cl2N2O2S/c24-16-11-9-15(10-12-16)22-18(13-20(28)29)30-23(27-22)21(14-5-2-1-3-6-14)17-7-4-8-19(25)26-17/h1-12,21H,13H2,(H,28,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HGXFUGPKXLCJOZ-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