General Information of the Compound
| Compound ID |
CP0897797
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2,3-Dihexoxyterephthaldehyde-1,4-bis-guanylhydrazone dihydro dichloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H40Cl2N8O2
|
||||||||||||||||||
| Molecular Weight |
519.522
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCOc1c(/C=N/N=C(N)N)ccc(/C=N/NC(=N)N)c1OCCCCCC.Cl.Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H38N8O2.2ClH/c1-3-5-7-9-13-31-19-17(15-27-29-21(23)24)11-12-18(16-28-30-22(25)26)20(19)32-14-10-8-6-4-2;;/h11-12,15-16H,3-10,13-14H2,1-2H3,(H4,23,24,29)(H4,25,26,30);2*1H/b27-15+,28-16+;;
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZAIVUVCHQLTISI-HQRQQUDRSA-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