General Information of the Compound
| Compound ID |
CP0569114
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-benzyl-N-[(5-chlorofuran-2-yl)methyl]-5-ethylbenzimidazol-2-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H20ClN3O
|
||||||||||||||||||
| Molecular Weight |
365.864
|
||||||||||||||||||
| Canonical SMILES |
CCc1ccc2n(Cc3ccccc3)c(NCc3ccc(Cl)o3)nc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H20ClN3O/c1-2-15-8-10-19-18(12-15)24-21(23-13-17-9-11-20(22)26-17)25(19)14-16-6-4-3-5-7-16/h3-12H,2,13-14H2,1H3,(H,23,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
GVXLNEJXMVOLNP-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 | |||||||||||||||||||
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