General Information of the Compound
| Compound ID |
CP0308485
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-oxo-2-(pyrrolidin-2-ylmethyl)isoindoline-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H17N3O2
|
||||||||||||||||||
| Molecular Weight |
259.309
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)c1cccc2CN(CC3CCCN3)C(=O)c12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H17N3O2/c15-13(18)11-5-1-3-9-7-17(14(19)12(9)11)8-10-4-2-6-16-10/h1,3,5,10,16H,2,4,6-8H2,(H2,15,18)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XGTOVXYKFYVZOQ-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