General Information of the Compound
| Compound ID |
CP0524994
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(4-butylphenyl)-5-(2-fluoroanilino)-1,3,4-oxadiazole-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H19FN4O2
|
||||||||||||||||||
| Molecular Weight |
354.385
|
||||||||||||||||||
| Canonical SMILES |
CCCCc1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H19FN4O2/c1-2-3-6-13-9-11-14(12-10-13)21-17(25)18-23-24-19(26-18)22-16-8-5-4-7-15(16)20/h4-5,7-12H,2-3,6H2,1H3,(H,21,25)(H,22,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ULADDUDXUUVSTN-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