General Information of the Compound
| Compound ID |
CP0564059
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[4-(2-fluorophenyl)piperazin-1-yl]-8-pyrazol-1-ylquinoline-3-carbonitrile
Show/Hide
|
||||||||||||||||||
| Formula |
C23H19FN6
|
||||||||||||||||||
| Molecular Weight |
398.445
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccccc1N1CCN(CC1)c1c(cnc2c(cccc12)-n1cccn1)C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H19FN6/c24-19-6-1-2-7-20(19)28-11-13-29(14-12-28)23-17(15-25)16-26-22-18(23)5-3-8-21(22)30-10-4-9-27-30/h1-10,16H,11-14H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
WLWQLSDIBLVCRG-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