General Information of the Compound
| Compound ID |
CP0081010
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(Aryl)-thiazole-5-carboxamide 16
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H12ClF2N3O3S
|
||||||||||||||||||
| Molecular Weight |
399.806
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(Cl)Oc1ccc(NC(=O)c2scnc2CCc2cnoc2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H12ClF2N3O3S/c17-16(18,19)25-12-4-2-11(3-5-12)22-15(23)14-13(20-9-26-14)6-1-10-7-21-24-8-10/h2-5,7-9H,1,6H2,(H,22,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ATTGFYAFMOTITM-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