General Information of the Compound
| Compound ID |
CP0469209
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(2-Hydroxy-ethylamino)-pyrimido[2,1-a]isoquinolin-4-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H13N3O2
|
||||||||||||||||||
| Molecular Weight |
255.277
|
||||||||||||||||||
| Canonical SMILES |
OCCNc1cc(=O)n2ccc3ccccc3c2n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H13N3O2/c18-8-6-15-12-9-13(19)17-7-5-10-3-1-2-4-11(10)14(17)16-12/h1-5,7,9,15,18H,6,8H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
RJTRDYNXVMRCQR-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