General Information of the Compound
| Compound ID |
CP0953585
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(5-(((R)-1-(4-tert-butylbenzyl)piperidin-2-yl)methoxy)-1-oxoisoindolin-2-yl)piperidine-2,6-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H37N3O4
|
||||||||||||||||||
| Molecular Weight |
503.643
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(C)c1ccc(CN2CCCC[C@@H]2COc2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H37N3O4/c1-30(2,3)22-9-7-20(8-10-22)17-32-15-5-4-6-23(32)19-37-24-11-12-25-21(16-24)18-33(29(25)36)26-13-14-27(34)31-28(26)35/h7-12,16,23,26H,4-6,13-15,17-19H2,1-3H3,(H,31,34,35)/t23-,26?/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
CUWBODTYPCOOML-GEPVFLLWSA-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