General Information of the Compound
| Compound ID |
CP0569895
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-ethyl-2-[2-(4-methoxyanilino)ethylamino]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H19N5O2S
|
||||||||||||||||||
| Molecular Weight |
345.428
|
||||||||||||||||||
| Canonical SMILES |
CCc1cc(=O)n2nc(NCCNc3ccc(OC)cc3)sc2n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H19N5O2S/c1-3-11-10-14(22)21-16(19-11)24-15(20-21)18-9-8-17-12-4-6-13(23-2)7-5-12/h4-7,10,17H,3,8-9H2,1-2H3,(H,18,20)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RURVVFQWAYDPJI-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 | |||||||||||||||||||
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