General Information of the Compound
| Compound ID |
CP0966419
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(1-ethyl-2-((3-fluoropyridin-2-yl)(hydroxy)(p-tolyl)methyl)-1H-benzo[d]imidazol-6-yl)propan-1-ol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H26FN3O2
|
||||||||||||||||||
| Molecular Weight |
419.5
|
||||||||||||||||||
| Canonical SMILES |
CCn1c(C(O)(c2ccc(C)cc2)c2ncccc2F)nc2ccc(CCCO)cc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H26FN3O2/c1-3-29-22-16-18(6-5-15-30)10-13-21(22)28-24(29)25(31,19-11-8-17(2)9-12-19)23-20(26)7-4-14-27-23/h4,7-14,16,30-31H,3,5-6,15H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
QKJAPKXKEHUBFZ-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