General Information of the Compound
| Compound ID |
CP0486082
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-[[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]carbamoylamino]phenyl]prop-2-enamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H25N7O3
|
||||||||||||||||||
| Molecular Weight |
459.51
|
||||||||||||||||||
| Canonical SMILES |
C=CC(=O)Nc1cccc(NC(=O)Nc2ccnc(Nc3ccc(cc3)N3CCOCC3)n2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H25N7O3/c1-2-22(32)26-18-4-3-5-19(16-18)28-24(33)30-21-10-11-25-23(29-21)27-17-6-8-20(9-7-17)31-12-14-34-15-13-31/h2-11,16H,1,12-15H2,(H,26,32)(H3,25,27,28,29,30,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
LZKHGZOJRVSIFE-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