General Information of the Compound
| Compound ID |
CP0555742
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-[3,5-dimethoxy-N-[2-(propan-2-ylamino)ethyl]anilino]-3-[2-(dimethylamino)ethoxy]pyrido[1,2-a]pyrimidin-4-one
Show/Hide
|
||||||||||||||||||
| Formula |
C25H35N5O4
|
||||||||||||||||||
| Molecular Weight |
469.586
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(OC)cc(c1)N(CCNC(C)C)c1ccc2ncc(OCCN(C)C)c(=O)n2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H35N5O4/c1-18(2)26-9-10-29(20-13-21(32-5)15-22(14-20)33-6)19-7-8-24-27-16-23(25(31)30(24)17-19)34-12-11-28(3)4/h7-8,13-18,26H,9-12H2,1-6H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
QVHMSIABAVOFMT-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