General Information of the Compound
| Compound ID |
CP0500342
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[4-[bis(4-chlorophenyl)methyl]piperazin-1-yl]-3-trimethylsilylprop-2-yn-1-one
Show/Hide
|
||||||||||||||||||
| Formula |
C23H26Cl2N2OSi
|
||||||||||||||||||
| Molecular Weight |
445.466
|
||||||||||||||||||
| Canonical SMILES |
C[Si](C)(C)C#CC(=O)N1CCN(CC1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H26Cl2N2OSi/c1-29(2,3)17-12-22(28)26-13-15-27(16-14-26)23(18-4-8-20(24)9-5-18)19-6-10-21(25)11-7-19/h4-11,23H,13-16H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
YYGAAJYVNPSYKN-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