General Information of the Compound
| Compound ID |
CP0001670
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(3-methyl-3-azabicyclo[3.3.1]non-6-en-7-yl)pyridine-4-carbonitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H17N3
|
||||||||||||||||||
| Molecular Weight |
239.322
|
||||||||||||||||||
| Canonical SMILES |
CN1CC2CC(C1)C=C(C2)c1cnccc1C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H17N3/c1-18-9-11-4-12(10-18)6-14(5-11)15-8-17-3-2-13(15)7-16/h2-3,5,8,11-12H,4,6,9-10H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
VSQMVWXIXKDVEZ-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