General Information of the Compound
| Compound ID |
CP0667777
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-(7-((3,5-dimethoxyphenyl)(2-(methylamino)ethyl)amino)quinoxalin-2-yl)-1H-pyrazol-1-yl)-N-methylacetamide hydrochloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H30ClN7O3
|
||||||||||||||||||
| Molecular Weight |
512.014
|
||||||||||||||||||
| Canonical SMILES |
CNCCN(c1cc(OC)cc(OC)c1)c1ccc2ncc(-c3cnn(CC(=O)NC)c3)nc2c1.Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H29N7O3.ClH/c1-26-7-8-32(19-9-20(34-3)12-21(10-19)35-4)18-5-6-22-23(11-18)30-24(14-28-22)17-13-29-31(15-17)16-25(33)27-2;/h5-6,9-15,26H,7-8,16H2,1-4H3,(H,27,33);1H
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZDXFCIBDTYOWRJ-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
Protein ID: PT01091, Fibroblast growth factor receptor 1
Protein ID: PT01411, Fibroblast growth factor receptor 3
Protein ID: PT01204, Receptor-type tyrosine-protein kinase FLT3
Protein ID: PT00864, Vascular endothelial growth factor receptor 2