General Information of the Compound
| Compound ID |
CP0562766
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(5Z)-5-[(3-chloro-4-hydroxyphenyl)methylidene]-2-(3,3-difluorocyclobutyl)imino-3-(2-methylphenyl)-1,3-thiazolidin-4-one
Show/Hide
|
||||||||||||||||||
| Formula |
C21H17ClF2N2O2S
|
||||||||||||||||||
| Molecular Weight |
434.895
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccccc1N1C(=O)\C(S\C1=N/C1CC(F)(F)C1)=C\c1ccc(O)c(Cl)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H17ClF2N2O2S/c1-12-4-2-3-5-16(12)26-19(28)18(9-13-6-7-17(27)15(22)8-13)29-20(26)25-14-10-21(23,24)11-14/h2-9,14,27H,10-11H2,1H3/b18-9-,25-20-
Show/Hide
|
||||||||||||||||||
| InChIKey |
BKUCKRCPKUSCKK-SBXCSTAHSA-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