General Information of the Compound
| Compound ID |
CP0569302
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[(4-bromophenyl)carbamoylamino]-2-cyclopentyl-N-(oxetan-3-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Formula |
C17H22BrN3O3
|
||||||||||||||||||
| Molecular Weight |
396.285
|
||||||||||||||||||
| Canonical SMILES |
Brc1ccc(NC(=O)NC(C2CCCC2)C(=O)NC2COC2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H22BrN3O3/c18-12-5-7-13(8-6-12)20-17(23)21-15(11-3-1-2-4-11)16(22)19-14-9-24-10-14/h5-8,11,14-15H,1-4,9-10H2,(H,19,22)(H2,20,21,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
NLXCZFNPDXVPLX-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 | |||||||||||||||||||
| 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