General Information of the Compound
| Compound ID |
CP0535157
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-fluoro-2-[(4-fluorophenyl)methylsulfanyl]-5-piperazin-1-yl-1H-benzimidazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H18F2N4S
|
||||||||||||||||||
| Molecular Weight |
360.433
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(CSc2nc3cc(F)c(cc3[nH]2)N2CCNCC2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H18F2N4S/c19-13-3-1-12(2-4-13)11-25-18-22-15-9-14(20)17(10-16(15)23-18)24-7-5-21-6-8-24/h1-4,9-10,21H,5-8,11H2,(H,22,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SEDYDWNTXCUPNG-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