General Information of the Compound
| Compound ID |
CP0275630
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Acetic acid 2-phenyl-5-propyl-thiazol-4-yl ester
Show/Hide
|
||||||||||||||||||
| Synonyms |
Acetic acid 2-phenyl-5-propyl-4-thiazolyl ester
Acetic acid 2-phenyl-5-propyl-thiazol-4-yl ester
BDBM50012407
CHEMBL413975
SCHEMBL9629413
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H15NO2S
|
||||||||||||||||||
| Molecular Weight |
261.346
|
||||||||||||||||||
| Canonical SMILES |
CCCc1sc(nc1OC(C)=O)-c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H15NO2S/c1-3-7-12-13(17-10(2)16)15-14(18-12)11-8-5-4-6-9-11/h4-6,8-9H,3,7H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
PNDOMGBHENBUGB-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
Clinical Information about the Compound