General Information of the Compound
Compound ID |
CP0576528
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
N-[(5-chlorothiadiazol-4-yl)methyl]-1,2-benzothiazol-5-amine
Show/Hide
|
||||||||||||||||||
Formula |
C10H7ClN4S2
|
||||||||||||||||||
Molecular Weight |
282.781
|
||||||||||||||||||
Canonical SMILES |
Clc1snnc1CNc1ccc2sncc2c1
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C10H7ClN4S2/c11-10-8(14-15-17-10)5-12-7-1-2-9-6(3-7)4-13-16-9/h1-4,12H,5H2
Show/Hide
|
||||||||||||||||||
InChIKey |
JNQBSCAAQLKBDF-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 | |||||||||||||||||||
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