General Information of the Compound
| Compound ID |
CP0210291
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
8-acetamido-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-2-(2-methylpropyl)-1-oxo-3H-2-benzazepine-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H38N4O4
|
||||||||||||||||||
| Molecular Weight |
518.658
|
||||||||||||||||||
| Canonical SMILES |
CC(C)CN1CC(=Cc2ccc(NC(C)=O)cc2C1=O)C(=O)Nc1ccc(CN(C)C2CCOCC2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H38N4O4/c1-20(2)17-34-19-24(15-23-7-10-26(31-21(3)35)16-28(23)30(34)37)29(36)32-25-8-5-22(6-9-25)18-33(4)27-11-13-38-14-12-27/h5-10,15-16,20,27H,11-14,17-19H2,1-4H3,(H,31,35)(H,32,36)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KMWBRTTZVRXQIB-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