General Information of the Compound
| Compound ID |
CP0531613
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-chloro-N-(5-cyclobutyl-1,3-thiazol-2-yl)-4-fluorobenzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H12ClFN2OS
|
||||||||||||||||||
| Molecular Weight |
310.781
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(cc1Cl)C(=O)Nc1ncc(s1)C1CCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H12ClFN2OS/c15-10-6-9(4-5-11(10)16)13(19)18-14-17-7-12(20-14)8-2-1-3-8/h4-8H,1-3H2,(H,17,18,19)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VYEKJTMJVAJSDN-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