General Information of the Compound
| Compound ID |
CP0456933
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-(3,5-dichloropyridin-4-yl)piperazin-1-yl)-6-(trifluoromethyl)-1H-benzo[d]imidazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H14Cl2F3N5
|
||||||||||||||||||
| Molecular Weight |
416.234
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1ccc2nc([nH]c2c1)N1CCN(CC1)c1c(Cl)cncc1Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H14Cl2F3N5/c18-11-8-23-9-12(19)15(11)26-3-5-27(6-4-26)16-24-13-2-1-10(17(20,21)22)7-14(13)25-16/h1-2,7-9H,3-6H2,(H,24,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XZTHSBGBPKWPGO-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