General Information of the Compound
| Compound ID |
CP0445510
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3,3-dimethylbutan-2-yl 8-methyl-2-morpholin-4-yl-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazine-7-carboxylate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H29N3O4
|
||||||||||||||||||
| Molecular Weight |
363.458
|
||||||||||||||||||
| Canonical SMILES |
CC(OC(=O)c1cn2CCN(N3CCOCC3)C(=O)c2c1C)C(C)(C)C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H29N3O4/c1-13-15(18(24)26-14(2)19(3,4)5)12-20-6-7-22(17(23)16(13)20)21-8-10-25-11-9-21/h12,14H,6-11H2,1-5H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
XMYNASWBBIOCIR-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