General Information of the Compound
| Compound ID |
CP0444517
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-chloro-2-methoxy-N-[4-([1,2,4]triazolo[4,3-a]quinoxalin-4-ylamino)phenyl]benzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Formula |
C22H17ClN6O3S
|
||||||||||||||||||
| Molecular Weight |
480.937
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Nc2nc3ccccc3n3cnnc23)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H17ClN6O3S/c1-32-19-11-6-14(23)12-20(19)33(30,31)28-16-9-7-15(8-10-16)25-21-22-27-24-13-29(22)18-5-3-2-4-17(18)26-21/h2-13,28H,1H3,(H,25,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
YYZQKHGVDKRRAI-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