General Information of the Compound
| Compound ID |
CP0428250
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(imidazol-1-ylmethyl)-2-(4-methoxyphenyl)pyridine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H15N3O
|
||||||||||||||||||
| Molecular Weight |
265.316
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)-c1ccc(Cn2ccnc2)cn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H15N3O/c1-20-15-5-3-14(4-6-15)16-7-2-13(10-18-16)11-19-9-8-17-12-19/h2-10,12H,11H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
AOPYQGHIYMDBCU-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
Protein ID: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial