General Information of the Compound
| Compound ID |
CP0851894
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
rac-1,3-dioxo-2-((1S,2R)-2-phenylcyclopropyl)-N-(2-(thiophen-3-yl)phenyl)hexahydroimidazo[1,5-a]pyrazine-7(1H)-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H24N4O3S
|
||||||||||||||||||
| Molecular Weight |
472.57
|
||||||||||||||||||
| Canonical SMILES |
O=C(Nc1ccccc1-c1ccsc1)N1CCN2C(=O)N([C@H]3C[C@@H]3c3ccccc3)C(=O)C2C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H24N4O3S/c31-24-23-15-28(25(32)27-21-9-5-4-8-19(21)18-10-13-34-16-18)11-12-29(23)26(33)30(24)22-14-20(22)17-6-2-1-3-7-17/h1-10,13,16,20,22-23H,11-12,14-15H2,(H,27,32)/t20-,22+,23?/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
OFSGZMLVVWEIEL-PTCKQWLISA-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