General Information of the Compound
| Compound ID |
CP0500963
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-[6-[(3-chlorophenyl)methylamino]-2-(4-methoxyphenyl)-3-oxopyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H24ClN5O3
|
||||||||||||||||||
| Molecular Weight |
477.952
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)-c1nc2ccc(NCc3cccc(Cl)c3)nc2n(CCNC(C)=O)c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H24ClN5O3/c1-16(32)27-12-13-31-24-21(29-23(25(31)33)18-6-8-20(34-2)9-7-18)10-11-22(30-24)28-15-17-4-3-5-19(26)14-17/h3-11,14H,12-13,15H2,1-2H3,(H,27,32)(H,28,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XRGLTGDFWPFBQM-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