General Information of the Compound
| Compound ID |
CP0491793
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[4-(cyclohexylmethoxy)-1H-benzimidazol-2-yl]methyl]-4-methoxyaniline
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H27N3O2
|
||||||||||||||||||
| Molecular Weight |
365.477
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(NCc2nc3c(OCC4CCCCC4)cccc3[nH]2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H27N3O2/c1-26-18-12-10-17(11-13-18)23-14-21-24-19-8-5-9-20(22(19)25-21)27-15-16-6-3-2-4-7-16/h5,8-13,16,23H,2-4,6-7,14-15H2,1H3,(H,24,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VLXYCCNZQXRRPI-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