General Information of the Compound
| Compound ID |
CP0404709
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-(2,4-dichlorophenyl)ethyl]-4-[(N,N'-dicyclohexyl-N-methylcarbamimidoyl)amino]benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H38Cl2N4O
|
||||||||||||||||||
| Molecular Weight |
529.556
|
||||||||||||||||||
| Canonical SMILES |
CN(C1CCCCC1)C(Nc1ccc(cc1)C(=O)NCCc1ccc(Cl)cc1Cl)=NC1CCCCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H38Cl2N4O/c1-35(26-10-6-3-7-11-26)29(33-24-8-4-2-5-9-24)34-25-16-13-22(14-17-25)28(36)32-19-18-21-12-15-23(30)20-27(21)31/h12-17,20,24,26H,2-11,18-19H2,1H3,(H,32,36)(H,33,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
NUZLZQHKXQREHT-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