General Information of the Compound
| Compound ID |
CP0144488
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(2-(pyridin-4-yl)ethyl)-N-(4-(trifluoromethyl)phenyl)-1H-tetrazole-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H13F3N6O
|
||||||||||||||||||
| Molecular Weight |
362.315
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1ccc(NC(=O)c2nnnn2CCc2ccncc2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H13F3N6O/c17-16(18,19)12-1-3-13(4-2-12)21-15(26)14-22-23-24-25(14)10-7-11-5-8-20-9-6-11/h1-6,8-9H,7,10H2,(H,21,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZASYBODFQONKMD-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