General Information of the Compound
| Compound ID |
CP0473407
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-[2-(3-fluorophenyl)pyrazol-3-yl]-1-(1H-indazol-6-yl)benzotriazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H14FN7
|
||||||||||||||||||
| Molecular Weight |
395.401
|
||||||||||||||||||
| Canonical SMILES |
Fc1cccc(c1)-n1nccc1-c1ccc2nnn(-c3ccc4cn[nH]c4c3)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H14FN7/c23-16-2-1-3-17(11-16)29-21(8-9-25-29)14-5-7-19-22(10-14)30(28-27-19)18-6-4-15-13-24-26-20(15)12-18/h1-13H,(H,24,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
AVUPAIPHIXRHMN-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