General Information of the Compound
| Compound ID |
CP0439224
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(2-fluorophenyl)-N'-quinolin-5-ylcyclohexane-1-carbohydrazide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H22FN3O
|
||||||||||||||||||
| Molecular Weight |
363.436
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccccc1C1(CCCCC1)C(=O)NNc1cccc2ncccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H22FN3O/c23-18-10-3-2-9-17(18)22(13-4-1-5-14-22)21(27)26-25-20-12-6-11-19-16(20)8-7-15-24-19/h2-3,6-12,15,25H,1,4-5,13-14H2,(H,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SGNWRWYLGDKDCE-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
Protein ID: PT01449, P2X purinoceptor 7
Protein ID: PT03917, P2X purinoceptor 7