General Information of the Compound
| Compound ID |
CP0538220
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[3-[(4-fluorobenzoyl)amino]phenyl]-4-(4-morpholin-4-ylanilino)-1,3-thiazole-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H24FN5O3S
|
||||||||||||||||||
| Molecular Weight |
517.586
|
||||||||||||||||||
| Canonical SMILES |
NC(=O)c1sc(nc1Nc1ccc(cc1)N1CCOCC1)-c1cccc(NC(=O)c2ccc(F)cc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H24FN5O3S/c28-19-6-4-17(5-7-19)26(35)31-21-3-1-2-18(16-21)27-32-25(23(37-27)24(29)34)30-20-8-10-22(11-9-20)33-12-14-36-15-13-33/h1-11,16,30H,12-15H2,(H2,29,34)(H,31,35)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HAUPUUPAINZAMP-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