General Information of the Compound
| Compound ID |
CP0387702
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(2,4-dimethoxyphenyl)-3,6-diethyl-N-pentan-3-ylpyrazin-2-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H31N3O2
|
||||||||||||||||||
| Molecular Weight |
357.498
|
||||||||||||||||||
| Canonical SMILES |
CCC(CC)Nc1nc(CC)c(nc1CC)-c1ccc(OC)cc1OC
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H31N3O2/c1-7-14(8-2)22-21-18(10-4)23-20(17(9-3)24-21)16-12-11-15(25-5)13-19(16)26-6/h11-14H,7-10H2,1-6H3,(H,22,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XLUVAJCDSFXIDU-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