General Information of the Compound
| Compound ID |
CP0519040
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-[4-[[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]methyl]phenyl]pyrimidin-2-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H15N7O
|
||||||||||||||||||
| Molecular Weight |
333.355
|
||||||||||||||||||
| Canonical SMILES |
Cn1cc(cn1)-c1nc(Cc2ccc(cc2)-c2cnc(N)nc2)no1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H15N7O/c1-24-10-14(9-21-24)16-22-15(23-25-16)6-11-2-4-12(5-3-11)13-7-19-17(18)20-8-13/h2-5,7-10H,6H2,1H3,(H2,18,19,20)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KOSJBISHKMJPBO-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