General Information of the Compound
| Compound ID |
CP0574204
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[1-(1-benzylpiperidin-4-yl)-2-oxopyrrolidin-3-yl]-3-(4-bromophenyl)urea
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H27BrN4O2
|
||||||||||||||||||
| Molecular Weight |
471.399
|
||||||||||||||||||
| Canonical SMILES |
Brc1ccc(NC(=O)NC2CCN(C3CCN(Cc4ccccc4)CC3)C2=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H27BrN4O2/c24-18-6-8-19(9-7-18)25-23(30)26-21-12-15-28(22(21)29)20-10-13-27(14-11-20)16-17-4-2-1-3-5-17/h1-9,20-21H,10-16H2,(H2,25,26,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OLZPOCYBXYWLNE-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 | |||||||||||||||||||
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