General Information of the Compound
| Compound ID |
CP0066809
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-(1-propan-2-ylpyrazol-4-yl)-1,3-benzothiazol-2-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C13H14N4S
|
||||||||||||||||||
| Molecular Weight |
258.35
|
||||||||||||||||||
| Canonical SMILES |
CC(C)n1cc(cn1)-c1ccc2nc(N)sc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C13H14N4S/c1-8(2)17-7-10(6-15-17)9-3-4-11-12(5-9)18-13(14)16-11/h3-8H,1-2H3,(H2,14,16)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SUHSEZWRGIEYSZ-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