General Information of the Compound
| Compound ID |
CP0415321
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[3-(3-chlorophenyl)-1-oxo-7-piperidin-4-yloxypyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H27ClN4O3
|
||||||||||||||||||
| Molecular Weight |
442.947
|
||||||||||||||||||
| Canonical SMILES |
CC(C)NC(=O)Cn1c(cn2cc(OC3CCNCC3)cc2c1=O)-c1cccc(Cl)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H27ClN4O3/c1-15(2)26-22(29)14-28-21(16-4-3-5-17(24)10-16)13-27-12-19(11-20(27)23(28)30)31-18-6-8-25-9-7-18/h3-5,10-13,15,18,25H,6-9,14H2,1-2H3,(H,26,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
LQWURXMNUIHWBJ-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