General Information of the Compound
| Compound ID |
CP0434713
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-[2-oxo-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl]ethyl]pyridine-3-carbonitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H13F3N4O
|
||||||||||||||||||
| Molecular Weight |
334.301
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1c2CCCCn2nc1C(=O)Cc1ccc(cn1)C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H13F3N4O/c17-16(18,19)14-12-3-1-2-6-23(12)22-15(14)13(24)7-11-5-4-10(8-20)9-21-11/h4-5,9H,1-3,6-7H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
HAVDHYKFGIZULF-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