General Information of the Compound
| Compound ID |
CP0425624
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-chloro-4-(4-methoxyphenoxy)-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)pyridazin-3-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H21ClN2O3
|
||||||||||||||||||
| Molecular Weight |
444.918
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(Oc2c(Cl)cnn(C3c4ccccc4CCc4ccccc34)c2=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H21ClN2O3/c1-31-19-12-14-20(15-13-19)32-25-23(27)16-28-29(26(25)30)24-21-8-4-2-6-17(21)10-11-18-7-3-5-9-22(18)24/h2-9,12-16,24H,10-11H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
IPLCWJLBWRPXQF-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