General Information of the Compound
| Compound ID |
CP0941829
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-((4-amino-1,2,5-oxadiazol-3-yl)amino)-6-(4-methoxyphenyl)-2,3-diphenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Show/Hide
|
||||||||||||||||||
| Formula |
C27H21N7O3
|
||||||||||||||||||
| Molecular Weight |
491.511
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(-c2c(Nc3nonc3N)[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H21N7O3/c1-36-19-14-12-17(13-15-19)21-24(29-25-23(28)32-37-33-25)30-26-20(16-8-4-2-5-9-16)22(31-34(26)27(21)35)18-10-6-3-7-11-18/h2-15,30H,1H3,(H2,28,32)(H,29,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HARFQBIWXKQNCE-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