General Information of the Compound
| Compound ID |
CP0496762
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[2-(4-Chloro-phenyl)-2-(3-cyclopentyloxy-4-difluoromethoxy-phenyl)-ethyl]-pyridine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H24ClF2NO2
|
||||||||||||||||||
| Molecular Weight |
443.921
|
||||||||||||||||||
| Canonical SMILES |
FC(F)Oc1ccc(cc1OC1CCCC1)C(Cc1ccncc1)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H24ClF2NO2/c26-20-8-5-18(6-9-20)22(15-17-11-13-29-14-12-17)19-7-10-23(31-25(27)28)24(16-19)30-21-3-1-2-4-21/h5-14,16,21-22,25H,1-4,15H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
UQVHAWXUKZRMTH-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