General Information of the Compound
| Compound ID |
CP0471204
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N,3-dimethyl-1-(2-phenylethynyl)pyrrolo[1,2-a]pyrazine-7-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H15N3O
|
||||||||||||||||||
| Molecular Weight |
289.338
|
||||||||||||||||||
| Canonical SMILES |
CNC(=O)c1cc2c(nc(C)cn2c1)C#Cc1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H15N3O/c1-13-11-21-12-15(18(22)19-2)10-17(21)16(20-13)9-8-14-6-4-3-5-7-14/h3-7,10-12H,1-2H3,(H,19,22)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CIUXXKQZJMDZQL-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