General Information of the Compound
| Compound ID |
CP0164749
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-[4-(1,3-benzodioxol-5-yl)-5-(4-methyl-1,3-thiazol-2-yl)-1H-imidazol-2-yl]-N-propylpentanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H26N4O3S
|
||||||||||||||||||
| Molecular Weight |
426.542
|
||||||||||||||||||
| Canonical SMILES |
CCCNC(=O)CCCCc1nc(c([nH]1)-c1nc(C)cs1)-c1ccc2OCOc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H26N4O3S/c1-3-10-23-19(27)7-5-4-6-18-25-20(21(26-18)22-24-14(2)12-30-22)15-8-9-16-17(11-15)29-13-28-16/h8-9,11-12H,3-7,10,13H2,1-2H3,(H,23,27)(H,25,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RONQOHXMQYEDIA-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