General Information of the Compound
| Compound ID |
CP0948232
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-((3-aminopyrazin-2-yl)amino)-6-(4-methoxyphenyl)-2,3-diphenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H23N7O2
|
||||||||||||||||||
| Molecular Weight |
501.55
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(-c2c(Nc3nccnc3N)[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H23N7O2/c1-38-21-14-12-19(13-15-21)23-26(33-27-25(30)31-16-17-32-27)34-28-22(18-8-4-2-5-9-18)24(35-36(28)29(23)37)20-10-6-3-7-11-20/h2-17,34H,1H3,(H2,30,31)(H,32,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KWAYQAJEQIKCES-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