General Information of the Compound
| Compound ID |
CP0559592
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-chloro-N-[(5-chloro-1-methylimidazol-2-yl)methyl]-2-fluoroaniline
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C11H10Cl2FN3
|
||||||||||||||||||
| Molecular Weight |
274.126
|
||||||||||||||||||
| Canonical SMILES |
Cn1c(Cl)cnc1CNc1ccc(Cl)cc1F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C11H10Cl2FN3/c1-17-10(13)5-16-11(17)6-15-9-3-2-7(12)4-8(9)14/h2-5,15H,6H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
MXQQACCIRYIGEE-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